#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d6a s ARG 359 N 0.00 4.17 0.17 5.56 3.52 -1.26 -4.44 118.95 126.67 3d6a s ARG 359 Ca 0.00 2.47 0.10 0.00 -0.13 0.00 0.00 55.73 58.17 3d6a s ARG 359 Cb 0.00 -3.55 -0.04 0.00 -1.56 0.00 0.00 34.95 29.80 3d6a s ARG 359 CO 0.00 -0.78 -0.22 0.20 -0.81 0.00 0.00 175.30 173.69 3d6a s GLY 360 N 2.43 1.57 -0.15 8.12 0.00 -0.72 -0.47 107.32 118.11 3d6a s GLY 360 Ca 0.77 -1.56 0.00 0.00 0.00 0.00 0.00 44.72 43.94 3d6a s GLY 360 CO 0.34 -1.58 -0.11 -0.42 0.00 0.00 0.00 173.10 171.33 3d6a s ILE 361 N -1.70 1.41 -0.34 0.90 -1.09 0.15 -0.94 121.20 119.58 3d6a s ILE 361 Ca 0.18 -0.61 -0.06 0.00 -2.23 0.00 0.00 60.65 57.94 3d6a s ILE 361 Cb -0.08 -1.39 0.05 0.00 -1.58 0.00 0.00 42.46 39.46 3d6a s ILE 361 CO 0.08 0.36 0.10 -0.22 -1.23 0.00 0.00 174.94 174.03 3d6a s LEU 362 N 1.54 4.31 -0.11 2.97 2.96 0.20 -1.39 118.68 129.17 3d6a s LEU 362 Ca 0.04 -1.22 -0.19 0.00 -0.22 0.00 0.00 54.13 52.53 3d6a s LEU 362 Cb -0.13 -1.84 -0.04 0.00 0.50 0.00 0.00 46.19 44.67 3d6a s LEU 362 CO -0.09 -0.33 0.53 -0.69 -1.32 0.00 0.00 176.35 174.45 3d6a s VAL 363 N 1.37 5.15 -0.06 1.68 1.01 0.40 -0.81 120.40 129.14 3d6a s VAL 363 Ca -0.02 1.07 -0.00 0.00 0.00 0.00 0.00 61.98 63.03 3d6a s VAL 363 Cb -0.20 -3.87 0.02 0.00 0.00 0.00 0.00 36.38 32.33 3d6a s VAL 363 CO 0.02 0.30 -0.03 -0.63 0.00 0.00 0.00 175.10 174.76 3d6a s ILE 364 N 0.74 0.51 0.29 2.22 1.01 -0.35 -1.00 121.20 124.62 3d6a s ILE 364 Ca 0.29 -0.03 -0.28 0.00 0.00 0.00 0.00 60.65 60.63 3d6a s ILE 364 Cb -0.16 -0.59 -0.09 0.00 0.01 0.00 0.00 42.46 41.63 3d6a s ILE 364 CO 0.12 0.25 1.02 -0.60 0.00 0.00 0.00 174.94 175.73 3d6a s ARG 365 N 1.47 4.62 0.91 2.79 3.52 -0.36 -1.35 118.95 130.56 3d6a s ARG 365 Ca -0.02 1.59 -0.14 0.00 -0.13 0.00 0.00 55.73 57.03 3d6a s ARG 365 Cb -0.13 -3.05 0.00 0.00 -1.56 0.00 0.00 34.95 30.22 3d6a s ARG 365 CO -0.03 0.26 0.31 -2.39 -0.81 0.00 0.00 175.30 172.63 3d6a n HIS 366 N 0.97 -1.72 -1.42 5.12 1.44 -0.84 -1.64 115.22 117.14 3d6a n HIS 366 Ca 0.00 0.23 -0.30 0.00 -2.01 0.00 0.00 57.72 55.64 3d6a n HIS 366 Cb 0.47 -1.77 0.23 0.00 0.12 0.00 0.00 29.99 29.04 3d6a n HIS 366 CO 0.00 0.00 0.00 0.20 -2.81 0.00 0.00 176.34 173.73 3d6a s GLY 367 N -1.82 1.67 0.22 -1.39 0.00 -1.26 -2.99 107.32 101.75 3d6a s GLY 367 Ca 0.57 -1.11 -0.32 0.00 0.00 0.00 0.00 44.72 43.85 3d6a s GLY 367 CO 0.67 -0.24 1.49 -2.21 0.00 0.00 0.00 173.10 172.81 3d6a n GLU 368 N -4.42 2.16 -3.69 2.90 2.13 -1.26 -4.91 120.64 113.55 3d6a n GLU 368 Ca 0.15 0.77 -0.33 0.00 0.66 0.00 0.00 57.16 58.41 3d6a n GLU 368 Cb 0.60 -2.48 -0.05 0.00 0.27 0.00 0.00 31.44 29.77 3d6a n GLU 368 CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 3d6a s ARG 369 N 0.01 3.64 0.41 5.31 0.52 -1.26 -1.01 118.95 126.56 3d6a s ARG 369 Ca 0.71 -0.03 0.15 0.00 -0.52 0.00 0.00 55.73 56.04 3d6a s ARG 369 Cb -0.64 -2.98 1.01 0.00 0.52 0.00 0.00 34.95 32.87 3d6a s ARG 369 CO 0.46 0.56 1.90 -0.39 0.02 0.00 0.00 175.30 177.85 3d6a h VAL 370 N 2.60 0.78 0.00 3.52 -1.51 -1.72 -2.43 116.25 117.49 3d6a h VAL 370 Ca -0.48 -0.16 0.00 0.00 -1.23 0.00 0.00 66.70 64.83 3d6a h VAL 370 Cb 1.18 0.27 0.00 0.00 -2.13 0.00 0.00 31.29 30.61 3d6a h VAL 370 CO 0.69 0.09 -0.05 -2.24 -1.23 0.00 0.00 177.57 174.82 3d6a h ASP 371 N 0.47 0.00 -0.06 4.19 2.03 -1.85 -1.27 116.42 119.93 3d6a h ASP 371 Ca 0.40 -0.01 -0.06 0.00 -0.73 0.00 0.00 57.03 56.63 3d6a h ASP 371 Cb 0.88 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 39.36 3d6a h ASP 371 CO -0.15 0.00 -0.13 1.56 -1.03 0.00 0.00 179.24 179.50 3d6a h GLN 372 N 0.00 0.38 0.02 4.15 4.20 -1.74 -1.70 115.11 120.42 3d6a h GLN 372 Ca 0.00 -0.10 -0.39 0.00 0.06 0.00 0.00 58.65 58.22 3d6a h GLN 372 Cb 0.86 -0.05 -0.05 0.00 0.30 0.00 0.00 27.48 28.55 3d6a h GLN 372 CO 0.00 0.51 -2.23 0.28 -0.67 0.00 0.00 178.83 176.72 3d6a n VAL 373 N -4.23 1.57 0.43 -0.54 0.31 -1.11 -4.55 118.33 110.21 3d6a n VAL 373 Ca 0.00 -0.46 0.10 0.00 -0.01 0.00 0.00 64.34 63.98 3d6a n VAL 373 Cb 0.30 -1.71 0.15 0.00 -0.91 0.00 0.00 33.84 31.68 3d6a n VAL 373 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 3d6a n PHE 374 N -3.76 0.30 -0.28 3.52 3.72 -0.50 -5.09 117.46 115.38 3d6a n PHE 374 Ca -0.44 -0.18 0.04 0.00 -0.05 0.00 0.00 57.45 56.82 3d6a n PHE 374 Cb 0.93 -0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 39.46 3d6a n PHE 374 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3d6a n GLY 375 N 1.22 -1.46 0.31 1.37 0.00 -0.64 -4.03 105.19 101.97 3d6a n GLY 375 Ca 0.15 -1.46 0.20 0.00 0.00 0.00 0.00 46.02 44.91 3d6a n GLY 375 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3d6a h LYS 376 N -0.26 0.00 -0.29 1.61 1.57 -1.96 -2.26 116.57 114.98 3d6a h LYS 376 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3d6a h LYS 376 Cb 0.25 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.56 3d6a h LYS 376 CO 0.00 0.02 0.00 -1.13 -0.57 0.00 0.00 179.45 177.77 3d6a n SER 377 N -3.21 1.74 -0.27 0.86 3.41 -1.26 -4.43 113.62 110.45 3d6a n SER 377 Ca -0.02 -1.93 0.19 0.00 -0.26 0.00 0.00 58.87 56.85 3d6a n SER 377 Cb 0.16 -0.19 0.49 0.00 -0.26 0.00 0.00 64.21 64.40 3d6a n SER 377 CO 0.00 0.00 0.00 4.11 -0.16 0.00 0.00 175.04 178.99 3d6a h TRP 378 N 1.98 0.63 -0.29 7.33 5.08 -1.54 -0.87 115.95 128.28 3d6a h TRP 378 Ca 0.00 0.02 -0.09 0.00 1.08 0.00 0.00 58.89 59.90 3d6a h TRP 378 Cb 0.45 -0.19 -0.01 0.00 -3.00 0.00 0.00 29.16 26.40 3d6a h TRP 378 CO 0.19 0.15 -0.22 1.25 -1.28 0.00 0.00 178.44 178.53 3d6a h LEU 379 N 0.46 0.53 -1.29 0.11 5.85 -1.86 -2.37 115.31 116.74 3d6a h LEU 379 Ca 0.51 -0.17 -0.04 0.00 0.84 0.00 0.00 57.88 59.01 3d6a h LEU 379 Cb 1.19 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 42.06 3d6a h LEU 379 CO -0.22 0.75 0.04 1.56 -0.34 0.00 0.00 178.44 180.23 3d6a h GLN 380 N 0.48 0.52 0.00 1.25 7.50 -1.50 -2.61 115.11 120.75 3d6a h GLN 380 Ca 0.07 -0.10 -0.02 0.00 0.50 0.00 0.00 58.65 59.11 3d6a h GLN 380 Cb 0.64 -0.08 -0.00 0.00 0.05 0.00 0.00 27.48 28.08 3d6a h GLN 380 CO 0.05 0.51 -0.10 1.96 -1.50 0.00 0.00 178.83 179.75 3d6a h GLN 381 N 0.50 0.00 0.00 1.46 4.20 -1.25 -3.31 115.11 116.71 3d6a h GLN 381 Ca 0.11 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.82 3d6a h GLN 381 Cb 0.27 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.05 3d6a h GLN 381 CO 0.00 0.10 0.00 0.00 -0.67 0.00 0.00 178.83 178.27 3d6a s THR 383 N -0.74 1.58 0.56 0.00 -4.23 -1.00 -0.30 115.64 111.52 3d6a s THR 383 Ca 0.00 -0.85 -0.08 0.00 -1.18 0.00 0.00 61.69 59.58 3d6a s THR 383 Cb 0.00 -1.31 -0.03 0.00 1.34 0.00 0.00 72.50 72.49 3d6a s THR 383 CO 0.00 0.45 0.91 0.42 -0.54 0.00 0.00 174.62 175.86 3d6a s THR 384 N -0.42 4.69 0.14 3.99 -4.23 0.57 -4.87 115.64 115.49 3d6a s THR 384 Ca 0.07 0.49 0.02 0.00 -1.18 0.00 0.00 61.69 61.08 3d6a s THR 384 Cb -0.08 -3.83 0.18 0.00 1.34 0.00 0.00 72.50 70.11 3d6a s THR 384 CO -0.00 -0.95 0.67 0.00 -0.54 0.00 0.00 174.62 173.81 3d6a n ALA 385 N -2.52 0.24 -2.26 3.99 0.00 -1.26 0.57 120.51 119.27 3d6a n ALA 385 Ca 0.03 0.46 -0.32 0.00 0.00 0.00 0.00 53.44 53.61 3d6a n ALA 385 Cb 0.55 -0.35 0.02 0.00 0.00 0.00 0.00 19.45 19.67 3d6a n ALA 385 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3d6a n ASP 386 N -4.40 5.84 -0.82 0.00 8.00 -1.26 -4.94 116.55 118.97 3d6a n ASP 386 Ca 0.11 -3.77 -0.11 0.00 0.71 0.00 0.00 54.79 51.73 3d6a n ASP 386 Cb 0.35 -0.71 -0.05 0.00 -0.02 0.00 0.00 41.12 40.70 3d6a n ASP 386 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3d6a n GLY 387 N -0.50 1.18 3.72 0.44 0.00 0.19 -4.99 105.19 105.24 3d6a n GLY 387 Ca 0.45 -0.40 -0.40 0.00 0.00 0.00 0.00 46.02 45.67 3d6a n GLY 387 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3d6a s LYS 388 N -2.80 4.48 0.00 1.61 2.47 -1.24 -4.78 119.74 119.49 3d6a s LYS 388 Ca 0.00 1.05 -0.26 0.00 -1.56 0.00 0.00 55.97 55.21 3d6a s LYS 388 Cb 0.00 -3.43 -0.04 0.00 -1.46 0.00 0.00 37.83 32.90 3d6a s LYS 388 CO 0.00 0.09 0.79 -0.47 0.16 0.00 0.00 175.35 175.92 3d6a s TYR 389 N 0.65 3.67 0.28 4.03 5.04 -1.26 -0.32 117.35 129.45 3d6a s TYR 389 Ca 0.41 1.45 0.02 0.00 -2.44 0.00 0.00 57.07 56.52 3d6a s TYR 389 Cb -0.19 -2.88 -0.05 0.00 0.35 0.00 0.00 41.96 39.18 3d6a s TYR 389 CO 0.22 0.15 0.09 1.52 -1.34 0.00 0.00 175.55 176.19 3d6a s TYR 390 N 0.45 1.67 -0.49 4.97 1.13 0.60 -4.97 117.35 120.71 3d6a s TYR 390 Ca 0.41 -1.13 0.01 0.00 -1.41 0.00 0.00 57.07 54.96 3d6a s TYR 390 Cb -0.20 -1.02 0.13 0.00 -1.10 0.00 0.00 41.96 39.77 3d6a s TYR 390 CO 0.23 -0.24 0.25 0.50 -2.51 0.00 0.00 175.55 173.77 3d6a s ARG 391 N -3.98 2.00 0.00 -3.49 3.52 -1.26 -4.63 118.95 111.12 3d6a s ARG 391 Ca 0.37 -2.32 0.29 0.00 -0.13 0.00 0.00 55.73 53.94 3d6a s ARG 391 Cb 0.08 -3.43 1.33 0.00 -1.56 0.00 0.00 34.95 31.37 3d6a s ARG 391 CO 0.14 -1.08 1.97 -0.35 -0.81 0.00 0.00 175.30 175.17 3d6a n PRO 392 N 3.66 0.14 -3.63 5.12 -0.04 -1.26 -4.78 135.00 134.21 3d6a n PRO 392 Ca 0.04 -0.00 -0.16 0.00 -0.04 0.00 0.00 63.50 63.35 3d6a n PRO 392 Cb 0.37 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 32.26 3d6a n PRO 392 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 3d6a s ASP 393 N -2.86 -0.50 0.51 3.54 -1.08 -1.26 -5.06 116.67 109.96 3d6a s ASP 393 Ca 0.19 0.63 0.34 0.00 -0.52 0.00 0.00 52.55 53.19 3d6a s ASP 393 Cb 0.19 0.62 1.64 0.00 -1.46 0.00 0.00 42.92 43.91 3d6a s ASP 393 CO 0.51 -0.47 2.03 -0.07 0.52 0.00 0.00 175.17 177.69 3d6a h LEU 394 N 3.78 0.00 -0.46 -1.34 3.38 -2.00 -2.29 115.31 116.38 3d6a h LEU 394 Ca -0.28 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.69 3d6a h LEU 394 Cb 1.16 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.91 3d6a h LEU 394 CO 0.34 0.00 0.00 -1.13 0.09 0.00 0.00 178.44 177.74 3d6a h ASN 395 N 0.00 0.00 -3.72 -0.43 -1.24 -1.98 -3.42 115.58 104.79 3d6a h ASN 395 Ca 0.00 0.00 -0.52 0.00 0.71 0.00 0.00 56.30 56.49 3d6a h ASN 395 Cb 0.25 0.00 0.05 0.00 0.73 0.00 0.00 38.32 39.35 3d6a h ASN 395 CO 0.00 0.00 0.63 -0.36 -1.29 0.00 0.00 177.43 176.41 3d6a s PHE 396 N -3.30 3.15 0.86 0.67 0.40 -0.86 -0.96 117.98 117.93 3d6a s PHE 396 Ca 0.06 1.37 -0.11 0.00 -0.60 0.00 0.00 56.93 57.66 3d6a s PHE 396 Cb 0.09 -3.63 0.11 0.00 0.51 0.00 0.00 43.02 40.10 3d6a s PHE 396 CO 0.57 -1.78 1.11 -1.25 0.70 0.00 0.00 175.22 174.56 3d6a s PRO 397 N -1.27 1.55 0.45 0.24 0.04 -1.26 -4.65 135.00 130.10 3d6a s PRO 397 Ca 0.51 1.21 0.21 0.00 0.04 0.00 0.00 61.00 62.97 3d6a s PRO 397 Cb -0.38 -1.81 1.08 0.00 0.04 0.00 0.00 34.50 33.42 3d6a s PRO 397 CO 0.47 -2.15 1.94 0.00 0.04 0.00 0.00 177.00 177.31 3d6a h ARG 398 N -1.50 0.00 -3.03 4.56 3.08 -1.95 -3.45 114.38 112.09 3d6a h ARG 398 Ca -0.45 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 59.54 3d6a h ARG 398 Cb 1.26 0.00 -0.15 0.00 0.08 0.00 0.00 29.97 31.16 3d6a h ARG 398 CO 0.49 0.23 -0.02 -1.54 -1.07 0.00 0.00 179.97 178.06 3d6a s SER 399 N -6.51 -0.35 -0.12 7.04 1.04 -1.26 -5.01 113.70 108.53 3d6a s SER 399 Ca -0.02 -0.02 -0.09 0.00 0.48 0.00 0.00 55.95 56.29 3d6a s SER 399 Cb 0.13 0.48 -0.04 0.00 0.10 0.00 0.00 66.02 66.68 3d6a s SER 399 CO 0.65 -0.76 0.19 -0.76 0.98 0.00 0.00 173.24 173.54 3d6a s LEU 400 N -2.27 4.36 0.75 2.42 1.43 -1.26 -5.11 118.68 119.00 3d6a s LEU 400 Ca -0.03 0.51 -0.13 0.00 -1.03 0.00 0.00 54.13 53.46 3d6a s LEU 400 Cb -0.00 -2.18 0.05 0.00 0.03 0.00 0.00 46.19 44.09 3d6a s LEU 400 CO -0.06 0.33 1.12 -2.16 0.23 0.00 0.00 176.35 175.82 3d6a s PRO 401 N -0.69 2.21 0.33 1.29 0.04 -1.26 -5.00 135.00 131.92 3d6a s PRO 401 Ca 0.15 1.39 -0.27 0.00 0.04 0.00 0.00 61.00 62.32 3d6a s PRO 401 Cb -0.13 -1.88 -0.09 0.00 0.04 0.00 0.00 34.50 32.44 3d6a s PRO 401 CO 0.04 -1.71 1.02 1.03 0.04 0.00 0.00 177.00 177.43 3d6a s ARG 402 N -4.45 4.49 0.08 4.56 0.52 -1.26 -5.05 118.95 117.84 3d6a s ARG 402 Ca 0.66 1.54 0.09 0.00 -0.52 0.00 0.00 55.73 57.50 3d6a s ARG 402 Cb -0.21 -2.88 -0.03 0.00 0.52 0.00 0.00 34.95 32.35 3d6a s ARG 402 CO 0.50 0.15 -0.25 1.03 0.02 0.00 0.00 175.30 176.75 3d6a s ARG 403 N -1.93 1.50 0.09 3.54 0.52 -1.26 -4.99 118.95 116.42 3d6a s ARG 403 Ca 0.50 -1.17 -0.34 0.00 -0.52 0.00 0.00 55.73 54.20 3d6a s ARG 403 Cb -0.24 -1.79 -0.16 0.00 0.52 0.00 0.00 34.95 33.28 3d6a s ARG 403 CO 0.31 0.44 1.59 0.66 0.02 0.00 0.00 175.30 178.32 3d6a h SER 404 N 4.41 -1.14 -0.29 0.23 4.64 -1.97 -3.00 113.55 116.43 3d6a h SER 404 Ca -0.47 0.09 -0.03 0.00 -0.47 0.00 0.00 61.79 60.90 3d6a h SER 404 Cb 1.16 0.37 -0.02 0.00 -0.31 0.00 0.00 62.40 63.59 3d6a h SER 404 CO 0.42 -0.61 0.04 0.59 -0.87 0.00 0.00 176.83 176.40 3d6a n ASN 405 N -5.53 3.22 0.00 4.97 3.02 -1.26 -5.02 115.26 114.66 3d6a n ASN 405 Ca -0.12 -2.48 0.00 0.00 -0.03 0.00 0.00 54.58 51.96 3d6a n ASN 405 Cb 0.43 -0.60 0.00 0.00 -0.61 0.00 0.00 39.78 39.00 3d6a n ASN 405 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3d6a n GLY 406 N 0.21 -1.39 0.30 7.41 0.00 -1.13 -4.53 105.19 106.06 3d6a n GLY 406 Ca 0.15 -1.58 0.15 0.00 0.00 0.00 0.00 46.02 44.74 3d6a n GLY 406 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 173.32 173.48 3d6a h ILE 407 N 0.00 0.52 -0.81 -0.61 3.07 -1.96 -2.54 117.51 115.19 3d6a h ILE 407 Ca 0.00 -0.03 0.20 0.00 1.55 0.00 0.00 64.86 66.58 3d6a h ILE 407 Cb 0.00 1.02 -0.05 0.00 -0.27 0.00 0.00 36.82 37.52 3d6a h ILE 407 CO 0.00 0.01 0.55 0.50 -1.05 0.00 0.00 178.15 178.16 3d6a h LYS 408 N 0.00 0.21 0.00 0.16 1.63 -2.01 0.13 116.57 116.70 3d6a h LYS 408 Ca -0.00 -0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.79 3d6a h LYS 408 Cb 0.02 -0.05 0.00 0.00 -0.60 0.00 0.00 32.23 31.60 3d6a h LYS 408 CO 0.00 0.14 0.00 -0.25 -3.45 0.00 0.00 179.45 175.89 3d6a n ASP 409 N -4.41 0.54 0.23 4.20 9.92 -0.96 -1.98 116.55 124.09 3d6a n ASP 409 Ca 0.16 0.65 0.10 0.00 -0.53 0.00 0.00 54.79 55.18 3d6a n ASP 409 Cb 0.73 -0.76 0.53 0.00 -0.64 0.00 0.00 41.12 40.98 3d6a n ASP 409 CO 0.00 0.00 0.00 -0.26 0.13 0.00 0.00 177.20 177.07 3d6a h PHE 410 N 0.00 0.00 -0.91 1.24 0.04 -0.94 -2.81 116.94 113.56 3d6a h PHE 410 Ca 0.00 0.00 0.09 0.00 2.80 0.00 0.00 57.97 60.86 3d6a h PHE 410 Cb 0.29 0.00 -0.07 0.00 2.20 0.00 0.00 35.95 38.37 3d6a h PHE 410 CO 0.00 0.21 0.56 0.93 -0.60 0.00 0.00 178.31 179.41 3d6a h GLU 411 N 0.00 0.94 -0.02 1.51 5.08 -1.56 -1.92 114.58 118.62 3d6a h GLU 411 Ca -0.00 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 3d6a h GLU 411 Cb 0.64 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.68 3d6a h GLU 411 CO 0.03 0.62 -0.34 0.09 -1.00 0.00 0.00 179.01 178.41 3d6a n ASN 412 N -4.63 2.25 -3.19 1.42 3.02 -1.22 -4.58 115.26 108.33 3d6a n ASN 412 Ca 0.15 -1.63 -0.22 0.00 -0.03 0.00 0.00 54.58 52.85 3d6a n ASN 412 Cb 0.25 0.35 -0.06 0.00 -0.61 0.00 0.00 39.78 39.71 3d6a n ASN 412 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 3d6a n ASP 413 N 0.33 0.56 -4.81 6.41 2.03 -1.01 -4.92 116.55 115.13 3d6a n ASP 413 Ca 0.10 -2.83 -0.33 0.00 0.52 0.00 0.00 54.79 52.26 3d6a n ASP 413 Cb 0.49 -0.63 0.01 0.00 -0.72 0.00 0.00 41.12 40.26 3d6a n ASP 413 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 3d6a s PRO 414 N -1.65 3.38 0.75 -0.67 0.04 -0.75 -4.51 135.00 131.59 3d6a s PRO 414 Ca 0.37 1.17 -0.09 0.00 0.04 0.00 0.00 61.00 62.49 3d6a s PRO 414 Cb 0.23 -2.04 0.07 0.00 0.04 0.00 0.00 34.50 32.79 3d6a s PRO 414 CO -0.10 -0.76 1.09 -1.25 0.04 0.00 0.00 177.00 176.02 3d6a s PRO 415 N -4.10 2.14 0.41 0.56 0.04 -1.26 -3.55 135.00 129.24 3d6a s PRO 415 Ca 0.63 -0.04 -0.26 0.00 0.04 0.00 0.00 61.00 61.36 3d6a s PRO 415 Cb -0.15 -2.06 -0.10 0.00 0.04 0.00 0.00 34.50 32.22 3d6a s PRO 415 CO 0.37 -1.38 1.36 1.28 0.04 0.00 0.00 177.00 178.67 3d6a n LEU 416 N -3.10 4.41 -4.70 -3.56 4.32 -1.26 -2.39 117.00 110.72 3d6a n LEU 416 Ca 0.08 1.15 -0.29 0.00 -0.02 0.00 0.00 56.01 56.92 3d6a n LEU 416 Cb 0.60 -1.55 0.19 0.00 -1.62 0.00 0.00 43.42 41.05 3d6a n LEU 416 CO 0.55 -0.33 0.68 -0.94 -1.22 0.00 0.00 177.39 176.13 3d6a s SER 417 N -0.41 2.19 0.23 -1.43 1.04 -0.18 -4.55 113.70 110.59 3d6a s SER 417 Ca 0.59 0.78 -0.07 0.00 0.48 0.00 0.00 55.95 57.72 3d6a s SER 417 Cb -0.49 -1.16 0.22 0.00 0.10 0.00 0.00 66.02 64.68 3d6a s SER 417 CO 0.60 -3.35 1.89 0.28 0.98 0.00 0.00 173.24 173.63 3d6a h SER 418 N -2.05 1.09 -0.64 7.02 0.02 -1.30 -2.12 113.55 115.56 3d6a h SER 418 Ca -0.48 -0.06 -0.04 0.00 -0.84 0.00 0.00 61.79 60.37 3d6a h SER 418 Cb 1.30 -0.28 -0.03 0.00 0.14 0.00 0.00 62.40 63.54 3d6a h SER 418 CO 0.47 0.83 0.26 0.00 -1.14 0.00 0.00 176.83 177.24 3d6a h GLY 420 N 0.90 1.31 0.80 0.00 0.00 -1.58 0.04 103.07 104.55 3d6a h GLY 420 Ca 0.21 -0.33 -0.00 0.00 0.00 0.00 0.00 47.33 47.21 3d6a h GLY 420 CO -0.02 0.15 -0.01 -2.22 0.00 0.00 0.00 176.54 174.45 3d6a h ILE 421 N 0.84 1.14 -0.74 2.60 2.04 -1.15 -1.30 117.51 120.94 3d6a h ILE 421 Ca 0.40 -0.46 0.15 0.00 1.00 0.00 0.00 64.86 65.95 3d6a h ILE 421 Cb 0.34 1.45 -0.10 0.00 -0.74 0.00 0.00 36.82 37.77 3d6a h ILE 421 CO -0.24 0.12 0.25 0.15 0.00 0.00 0.00 178.15 178.43 3d6a h PHE 422 N -0.22 0.41 -0.49 1.37 3.57 -0.96 -0.90 116.94 119.73 3d6a h PHE 422 Ca -0.00 0.04 -0.01 0.00 3.53 0.00 0.00 57.97 61.52 3d6a h PHE 422 Cb 0.21 -0.07 -0.02 0.00 2.79 0.00 0.00 35.95 38.86 3d6a h PHE 422 CO -0.01 -0.00 0.25 1.96 -2.23 0.00 0.00 178.31 178.28 3d6a h GLN 423 N 0.36 0.69 -0.02 1.11 4.20 -0.73 -1.21 115.11 119.52 3d6a h GLN 423 Ca 0.41 -0.09 -0.00 0.00 0.06 0.00 0.00 58.65 59.03 3d6a h GLN 423 Cb 0.66 -0.13 -0.00 0.00 0.30 0.00 0.00 27.48 28.31 3d6a h GLN 423 CO -0.45 0.56 0.01 0.00 -0.67 0.00 0.00 178.83 178.29 3d6a h ALA 424 N 1.09 0.03 -0.63 3.87 0.00 -0.91 -2.52 119.26 120.20 3d6a h ALA 424 Ca 0.17 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 3d6a h ALA 424 Cb 0.09 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 3d6a h ALA 424 CO -0.02 -0.44 0.31 0.00 0.00 0.00 0.00 179.25 179.09 3d6a h ARG 425 N -0.02 0.89 -0.61 0.00 3.08 -1.10 -1.64 114.38 114.98 3d6a h ARG 425 Ca 0.01 -0.11 -0.08 0.00 0.07 0.00 0.00 59.98 59.87 3d6a h ARG 425 Cb 0.05 -0.17 -0.02 0.00 0.08 0.00 0.00 29.97 29.91 3d6a h ARG 425 CO -0.00 0.68 0.07 1.25 -1.07 0.00 0.00 179.97 180.90 3d6a h LEU 426 N 0.89 0.98 -0.31 3.04 5.85 -1.10 -0.82 115.31 123.83 3d6a h LEU 426 Ca 0.22 -0.24 -0.14 0.00 0.84 0.00 0.00 57.88 58.56 3d6a h LEU 426 Cb 0.08 -0.26 -0.00 0.00 0.37 0.00 0.00 40.66 40.85 3d6a h LEU 426 CO -0.03 1.00 -0.34 0.00 -0.34 0.00 0.00 178.44 178.72 3d6a h ALA 427 N 1.11 0.46 -0.31 1.25 0.00 -1.14 -1.48 119.26 119.15 3d6a h ALA 427 Ca 0.18 -0.43 0.02 0.00 0.00 0.00 0.00 54.91 54.68 3d6a h ALA 427 Cb 0.46 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 3d6a h ALA 427 CO 0.02 0.52 0.16 0.78 0.00 0.00 0.00 179.25 180.73 3d6a h GLY 428 N 0.55 0.42 1.48 0.00 0.00 -1.15 -0.62 103.07 103.74 3d6a h GLY 428 Ca 0.04 -0.11 -0.03 0.00 0.00 0.00 0.00 47.33 47.23 3d6a h GLY 428 CO 0.08 0.09 0.19 -2.09 0.00 0.00 0.00 176.54 174.81 3d6a h GLU 429 N 0.33 0.67 -0.30 4.80 4.81 -1.12 -1.24 114.58 122.55 3d6a h GLU 429 Ca 0.13 -0.09 -0.17 0.00 -0.13 0.00 0.00 59.36 59.09 3d6a h GLU 429 Cb 0.03 -0.12 -0.00 0.00 0.63 0.00 0.00 28.75 29.29 3d6a h GLU 429 CO -0.08 0.56 -0.51 0.00 -0.73 0.00 0.00 179.01 178.25 3d6a h ALA 430 N 1.54 0.54 -0.77 2.92 0.00 -0.93 -1.88 119.26 120.68 3d6a h ALA 430 Ca 0.16 -0.50 -0.01 0.00 0.00 0.00 0.00 54.91 54.56 3d6a h ALA 430 Cb 0.14 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 17.80 3d6a h ALA 430 CO -0.02 0.68 0.44 -0.07 0.00 0.00 0.00 179.25 180.28 3d6a h LEU 431 N 0.65 0.94 0.43 0.00 3.38 -0.70 0.09 115.31 120.11 3d6a h LEU 431 Ca 0.03 -0.08 -0.02 0.00 0.09 0.00 0.00 57.88 57.89 3d6a h LEU 431 Cb 1.10 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.61 3d6a h LEU 431 CO 0.11 0.75 -0.21 0.25 0.09 0.00 0.00 178.44 179.44 3d6a h LEU 432 N 1.06 -0.49 -2.00 1.67 5.85 -1.20 -2.69 115.31 117.50 3d6a h LEU 432 Ca 0.27 -0.00 0.18 0.00 0.84 0.00 0.00 57.88 59.17 3d6a h LEU 432 Cb 0.01 0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.14 3d6a h LEU 432 CO -0.05 -0.32 0.45 0.44 -0.34 0.00 0.00 178.44 178.63 3d6a h ASP 433 N -0.62 0.00 0.89 1.25 5.19 -1.14 -2.08 116.42 119.91 3d6a h ASP 433 Ca -0.06 0.00 -0.04 0.00 -0.62 0.00 0.00 57.03 56.31 3d6a h ASP 433 Cb 0.47 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.97 3d6a h ASP 433 CO 0.10 0.00 -0.19 0.77 -3.12 0.00 0.00 179.24 176.80 3d6a h SER 434 N 0.00 0.00 0.00 6.45 4.64 -0.63 -3.47 113.55 120.54 3d6a h SER 434 Ca 0.29 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.61 3d6a h SER 434 Cb 1.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 3d6a h SER 434 CO -0.00 0.19 0.00 0.61 -0.87 0.00 0.00 176.83 176.75 3d6a n GLY 435 N 0.07 0.90 3.76 -0.77 0.00 -0.78 -5.03 105.19 103.33 3d6a n GLY 435 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 3d6a n GLY 435 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3d6a s VAL 436 N -3.59 2.88 -0.25 1.61 -7.23 -1.25 -5.00 120.40 107.56 3d6a s VAL 436 Ca 0.00 0.50 -0.09 0.00 -1.81 0.00 0.00 61.98 60.58 3d6a s VAL 436 Cb 0.00 -3.13 -0.04 0.00 0.56 0.00 0.00 36.38 33.77 3d6a s VAL 436 CO 0.00 -0.16 0.12 -0.60 -0.31 0.00 0.00 175.10 174.15 3d6a s ARG 437 N -3.55 3.82 -0.28 4.82 3.52 -1.26 -4.89 118.95 121.14 3d6a s ARG 437 Ca 0.73 -0.39 -0.16 0.00 -0.13 0.00 0.00 55.73 55.78 3d6a s ARG 437 Cb -0.26 -3.46 -0.03 0.00 -1.56 0.00 0.00 34.95 29.64 3d6a s ARG 437 CO 0.34 -0.13 0.44 0.08 -0.81 0.00 0.00 175.30 175.22 3d6a s VAL 438 N 1.53 5.12 -0.12 7.11 1.01 -1.26 0.35 120.40 134.14 3d6a s VAL 438 Ca 0.06 0.64 -0.13 0.00 0.00 0.00 0.00 61.98 62.56 3d6a s VAL 438 Cb -0.15 -3.78 -0.26 0.00 0.00 0.00 0.00 36.38 32.19 3d6a s VAL 438 CO 0.06 0.09 0.45 0.74 0.00 0.00 0.00 175.10 176.44 3d6a h THR 439 N 5.42 0.85 -3.31 3.92 2.02 -1.13 -3.46 112.91 117.23 3d6a h THR 439 Ca -0.30 -2.36 -0.06 0.00 0.77 0.00 0.00 66.41 64.46 3d6a h THR 439 Cb 1.15 2.57 -0.14 0.00 -1.74 0.00 0.00 68.15 70.00 3d6a h THR 439 CO 0.68 0.74 -0.08 0.00 0.37 0.00 0.00 175.52 177.23 3d6a s ALA 440 N -2.50 -0.94 -0.09 6.16 0.00 -1.23 -5.03 121.76 118.12 3d6a s ALA 440 Ca -0.22 0.03 -0.03 0.00 0.00 0.00 0.00 51.96 51.75 3d6a s ALA 440 Cb 0.06 0.60 0.04 0.00 0.00 0.00 0.00 23.12 23.82 3d6a s ALA 440 CO 0.75 -0.59 0.05 0.08 0.00 0.00 0.00 175.76 176.05 3d6a s VAL 441 N -3.47 0.05 -0.03 0.00 1.01 -1.26 -1.45 120.40 115.24 3d6a s VAL 441 Ca 0.01 0.15 0.02 0.00 0.00 0.00 0.00 61.98 62.16 3d6a s VAL 441 Cb 0.01 -0.40 -0.03 0.00 0.00 0.00 0.00 36.38 35.96 3d6a s VAL 441 CO -0.10 0.06 -0.06 -0.36 0.00 0.00 0.00 175.10 174.65 3d6a s PHE 442 N 2.09 2.94 0.01 5.22 0.40 0.04 -0.94 117.98 127.73 3d6a s PHE 442 Ca 0.04 0.01 0.01 0.00 -0.60 0.00 0.00 56.93 56.38 3d6a s PHE 442 Cb -0.13 -1.67 -0.01 0.00 0.51 0.00 0.00 43.02 41.72 3d6a s PHE 442 CO -0.05 0.36 -0.03 0.00 0.70 0.00 0.00 175.22 176.20 3d6a s ALA 443 N -0.91 0.19 0.66 5.36 0.00 -0.63 -0.48 121.76 125.95 3d6a s ALA 443 Ca 0.15 -0.26 -0.17 0.00 0.00 0.00 0.00 51.96 51.68 3d6a s ALA 443 Cb -0.11 0.01 0.00 0.00 0.00 0.00 0.00 23.12 23.02 3d6a s ALA 443 CO 0.05 -0.01 1.26 0.45 0.00 0.00 0.00 175.76 177.51 3d6a s SER 444 N -0.51 4.55 0.33 0.00 0.15 -0.43 -0.38 113.70 117.41 3d6a s SER 444 Ca -0.04 2.53 0.26 0.00 0.70 0.00 0.00 55.95 59.40 3d6a s SER 444 Cb -0.04 -2.61 1.11 0.00 -1.71 0.00 0.00 66.02 62.78 3d6a s SER 444 CO -0.00 -2.04 1.78 1.55 1.20 0.00 0.00 173.24 175.73 3d6a h PRO 445 N 0.35 0.00 -6.52 5.44 0.13 -1.92 -3.34 132.00 126.13 3d6a h PRO 445 Ca -0.50 0.00 -0.59 0.00 -0.87 0.00 0.00 66.00 64.04 3d6a h PRO 445 Cb 1.32 0.00 0.07 0.00 0.13 0.00 0.00 31.00 32.52 3d6a h PRO 445 CO 0.52 0.00 0.65 0.00 -0.23 0.00 0.00 178.00 178.95 3d6a n ALA 446 N -1.84 0.97 -0.21 -0.56 0.00 -1.26 -4.59 120.51 113.02 3d6a n ALA 446 Ca 0.01 0.43 0.01 0.00 0.00 0.00 0.00 53.44 53.90 3d6a n ALA 446 Cb 0.22 -2.28 0.12 0.00 0.00 0.00 0.00 19.45 17.52 3d6a n ALA 446 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 3d6a h LEU 447 N 4.82 0.09 -2.06 0.00 5.85 -1.85 -1.05 115.31 121.11 3d6a h LEU 447 Ca -0.45 0.10 0.11 0.00 0.84 0.00 0.00 57.88 58.48 3d6a h LEU 447 Cb 1.27 0.12 -0.01 0.00 0.37 0.00 0.00 40.66 42.41 3d6a h LEU 447 CO 0.80 0.05 0.35 0.08 -0.34 0.00 0.00 178.44 179.38 3d6a h ARG 448 N 0.32 0.00 0.18 1.25 0.11 -1.88 -0.27 114.38 114.08 3d6a h ARG 448 Ca 0.33 0.00 -0.33 0.00 0.10 0.00 0.00 59.98 60.08 3d6a h ARG 448 Cb 0.47 0.00 0.01 0.00 1.11 0.00 0.00 29.97 31.56 3d6a h ARG 448 CO -0.38 0.00 -1.61 0.00 0.10 0.00 0.00 179.97 178.08 3d6a h VAL 450 N 0.00 1.26 -0.64 0.00 2.07 -1.10 -0.74 116.25 117.11 3d6a h VAL 450 Ca -0.32 -1.24 -0.04 0.00 0.82 0.00 0.00 66.70 65.92 3d6a h VAL 450 Cb 2.02 1.09 -0.03 0.00 -1.52 0.00 0.00 31.29 32.85 3d6a h VAL 450 CO 0.16 0.42 0.25 1.56 0.02 0.00 0.00 177.57 179.99 3d6a h GLN 451 N 0.73 0.97 -0.21 1.57 4.20 -1.18 -1.80 115.11 119.38 3d6a h GLN 451 Ca 0.11 -0.18 -0.04 0.00 0.06 0.00 0.00 58.65 58.61 3d6a h GLN 451 Cb 0.65 -0.15 -0.01 0.00 0.30 0.00 0.00 27.48 28.27 3d6a h GLN 451 CO 0.05 0.82 -0.01 1.15 -0.67 0.00 0.00 178.83 180.16 3d6a h THR 452 N 0.91 1.26 -0.40 -0.54 2.02 -1.17 -2.48 112.91 112.51 3d6a h THR 452 Ca 0.21 -0.92 0.08 0.00 0.77 0.00 0.00 66.41 66.55 3d6a h THR 452 Cb 0.22 1.46 -0.08 0.00 -1.74 0.00 0.00 68.15 68.01 3d6a h THR 452 CO -0.02 0.28 -0.13 0.00 0.37 0.00 0.00 175.52 176.03 3d6a h ALA 453 N 0.78 0.22 -0.00 6.16 0.00 -1.12 -1.44 119.26 123.86 3d6a h ALA 453 Ca 0.06 0.15 0.01 0.00 0.00 0.00 0.00 54.91 55.14 3d6a h ALA 453 Cb 0.43 0.36 -0.02 0.00 0.00 0.00 0.00 17.79 18.56 3d6a h ALA 453 CO 0.01 -0.48 -0.08 -0.22 0.00 0.00 0.00 179.25 178.48 3d6a h LYS 454 N -0.04 -0.13 -0.40 0.00 3.64 -1.24 -0.50 116.57 117.90 3d6a h LYS 454 Ca 0.20 0.01 -0.05 0.00 -1.27 0.00 0.00 60.65 59.53 3d6a h LYS 454 Cb 0.34 0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.17 3d6a h LYS 454 CO -0.44 -0.09 0.02 0.45 -2.27 0.00 0.00 179.45 177.13 3d6a h HIS 455 N -0.13 0.66 0.03 1.91 3.86 -1.39 0.15 115.15 120.24 3d6a h HIS 455 Ca 0.03 -0.07 -0.00 0.00 -1.16 0.00 0.00 60.37 59.17 3d6a h HIS 455 Cb 0.17 -0.19 0.00 0.00 1.06 0.00 0.00 27.41 28.46 3d6a h HIS 455 CO -0.15 0.61 -0.01 0.82 0.86 0.00 0.00 177.93 180.06 3d6a h ILE 456 N 0.60 1.04 -0.57 2.45 2.04 -1.02 -2.91 117.51 119.14 3d6a h ILE 456 Ca 0.13 -0.21 -0.03 0.00 1.00 0.00 0.00 64.86 65.75 3d6a h ILE 456 Cb 0.35 1.18 -0.03 0.00 -0.74 0.00 0.00 36.82 37.58 3d6a h ILE 456 CO 0.01 0.05 0.24 -0.07 0.00 0.00 0.00 178.15 178.38 3d6a h LEU 457 N -0.13 0.75 -0.80 1.44 3.38 -0.64 -1.62 115.31 117.69 3d6a h LEU 457 Ca -0.00 -0.09 0.04 0.00 0.09 0.00 0.00 57.88 57.91 3d6a h LEU 457 Cb 0.12 -0.19 -0.05 0.00 0.09 0.00 0.00 40.66 40.63 3d6a h LEU 457 CO 0.01 0.67 0.51 -0.33 0.09 0.00 0.00 178.44 179.38 3d6a h GLU 458 N 0.82 0.95 0.00 1.13 5.08 -0.65 0.19 114.58 122.10 3d6a h GLU 458 Ca 0.20 -0.06 -0.08 0.00 -1.00 0.00 0.00 59.36 58.42 3d6a h GLU 458 Cb 0.14 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.17 3d6a h GLU 458 CO -0.02 0.63 -0.56 0.93 -1.00 0.00 0.00 179.01 178.99 3d6a h GLU 459 N 0.98 0.00 0.00 2.33 4.39 -1.25 -2.38 114.58 118.66 3d6a h GLU 459 Ca 0.32 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.02 3d6a h GLU 459 Cb 0.04 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.69 3d6a h GLU 459 CO -0.12 0.32 0.00 1.28 -1.16 0.00 0.00 179.01 179.32 3d6a n LEU 460 N -3.10 0.06 -3.53 1.33 4.77 -0.65 -4.29 117.00 111.59 3d6a n LEU 460 Ca 0.01 0.51 -0.25 0.00 -0.03 0.00 0.00 56.01 56.25 3d6a n LEU 460 Cb 0.69 -0.50 0.05 0.00 -2.33 0.00 0.00 43.42 41.32 3d6a n LEU 460 CO 0.39 -0.25 0.13 0.29 -1.33 0.00 0.00 177.39 176.62 3d6a n LYS 461 N -1.57 -6.21 -0.06 3.23 5.02 -0.68 -4.92 118.16 112.99 3d6a n LYS 461 Ca 0.04 0.76 0.03 0.00 -2.02 0.00 0.00 58.31 57.11 3d6a n LYS 461 Cb 0.19 -5.70 0.04 0.00 -0.02 0.00 0.00 35.03 29.55 3d6a n LYS 461 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 3d6a n LEU 462 N -4.59 1.75 0.19 -0.35 4.77 -0.03 -4.81 117.00 113.93 3d6a n LEU 462 Ca -0.01 -2.05 0.07 0.00 -0.03 0.00 0.00 56.01 53.99 3d6a n LEU 462 Cb 0.56 -0.13 0.25 0.00 -2.33 0.00 0.00 43.42 41.77 3d6a n LEU 462 CO 0.63 0.49 0.66 1.05 -1.33 0.00 0.00 177.39 178.89 3d6a h GLU 463 N 0.00 0.00 0.08 3.23 9.09 -1.81 0.33 114.58 125.50 3d6a h GLU 463 Ca 0.00 0.00 -0.27 0.00 0.05 0.00 0.00 59.36 59.14 3d6a h GLU 463 Cb 0.77 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.86 3d6a h GLU 463 CO 0.00 0.33 -1.29 0.87 0.05 0.00 0.00 179.01 178.96 3d6a h LYS 464 N 0.00 0.18 0.19 1.06 1.57 -1.92 -3.39 116.57 114.25 3d6a h LYS 464 Ca -0.00 -0.30 -0.28 0.00 -1.87 0.00 0.00 60.65 58.19 3d6a h LYS 464 Cb 1.04 0.11 0.02 0.00 0.08 0.00 0.00 32.23 33.48 3d6a h LYS 464 CO 0.04 1.08 -1.29 -0.22 -0.57 0.00 0.00 179.45 178.49 3d6a h LYS 465 N 0.05 0.39 -5.25 3.15 3.64 -1.82 -3.44 116.57 113.28 3d6a h LYS 465 Ca -0.14 -0.67 -0.63 0.00 -1.27 0.00 0.00 60.65 57.94 3d6a h LYS 465 Cb 1.94 0.25 -0.19 0.00 -0.41 0.00 0.00 32.23 33.82 3d6a h LYS 465 CO 0.16 1.32 -0.61 -0.51 -2.27 0.00 0.00 179.45 177.55 3d6a s LEU 466 N -7.64 3.57 0.01 5.20 1.43 0.08 -5.10 118.68 116.23 3d6a s LEU 466 Ca -0.13 -0.03 -0.16 0.00 -1.03 0.00 0.00 54.13 52.78 3d6a s LEU 466 Cb 0.03 -1.89 -0.06 0.00 0.03 0.00 0.00 46.19 44.30 3d6a s LEU 466 CO 0.87 0.15 0.45 -0.54 0.23 0.00 0.00 176.35 177.51 3d6a s LYS 467 N 0.50 4.03 0.01 1.70 1.02 -1.26 -4.67 119.74 121.06 3d6a s LYS 467 Ca 0.01 0.50 -0.30 0.00 0.02 0.00 0.00 55.97 56.19 3d6a s LYS 467 Cb -0.13 -3.24 -0.04 0.00 -0.52 0.00 0.00 37.83 33.89 3d6a s LYS 467 CO 0.02 0.63 1.18 0.42 -0.92 0.00 0.00 175.35 176.68 3d6a s ILE 468 N -0.94 4.20 -0.42 2.17 1.01 0.32 -4.50 121.20 123.04 3d6a s ILE 468 Ca 0.25 1.56 -0.13 0.00 0.00 0.00 0.00 60.65 62.33 3d6a s ILE 468 Cb -0.17 -4.00 0.04 0.00 0.01 0.00 0.00 42.46 38.34 3d6a s ILE 468 CO 0.15 0.07 0.29 -0.13 0.00 0.00 0.00 174.94 175.32 3d6a s ARG 469 N 1.55 2.88 -0.04 2.79 0.52 -0.12 0.21 118.95 126.74 3d6a s ARG 469 Ca 0.57 -1.18 -0.30 0.00 -0.52 0.00 0.00 55.73 54.30 3d6a s ARG 469 Cb -0.27 -3.92 -0.04 0.00 0.52 0.00 0.00 34.95 31.24 3d6a s ARG 469 CO 0.26 -0.84 1.28 0.08 0.02 0.00 0.00 175.30 176.11 3d6a s VAL 470 N 1.60 4.04 -0.39 3.52 1.01 -1.26 -1.60 120.40 127.31 3d6a s VAL 470 Ca 0.04 1.38 0.02 0.00 0.00 0.00 0.00 61.98 63.42 3d6a s VAL 470 Cb -0.21 -3.89 0.11 0.00 0.00 0.00 0.00 36.38 32.40 3d6a s VAL 470 CO 0.07 -0.01 0.15 -0.70 0.00 0.00 0.00 175.10 174.61 3d6a s GLU 471 N 2.34 1.33 0.66 2.72 2.56 0.48 -4.76 118.70 124.03 3d6a s GLU 471 Ca 0.59 -1.84 0.31 0.00 0.00 0.00 0.00 54.97 54.03 3d6a s GLU 471 Cb -0.27 -2.70 1.67 0.00 2.00 0.00 0.00 34.13 34.83 3d6a s GLU 471 CO 0.24 -1.04 1.94 -1.35 -0.56 0.00 0.00 175.26 174.49 3d6a h PRO 472 N 7.31 0.00 0.00 4.30 0.11 -1.85 -1.35 132.00 140.52 3d6a h PRO 472 Ca -0.07 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.04 3d6a h PRO 472 Cb 0.97 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.08 3d6a h PRO 472 CO 0.53 0.00 0.00 0.78 -0.21 0.00 0.00 178.00 179.10 3d6a h GLY 473 N 0.00 0.00 -2.32 -0.55 0.00 -1.92 -2.81 103.07 95.47 3d6a h GLY 473 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3d6a h GLY 473 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 176.54 176.83 3d6a n ILE 474 N -3.06 2.32 -1.19 2.60 -5.35 -0.51 -4.34 119.36 109.84 3d6a n ILE 474 Ca 0.00 -1.62 -0.31 0.00 -0.27 0.00 0.00 62.75 60.55 3d6a n ILE 474 Cb 0.26 -0.18 0.11 0.00 -1.74 0.00 0.00 39.64 38.09 3d6a n ILE 474 CO 0.00 0.00 0.00 0.12 -1.76 0.00 0.00 176.55 174.91 3d6a s PHE 475 N -2.62 2.44 1.25 4.28 5.36 -1.06 -4.57 117.98 123.07 3d6a s PHE 475 Ca 0.46 1.53 -0.15 0.00 -0.96 0.00 0.00 56.93 57.81 3d6a s PHE 475 Cb 0.35 -3.09 0.32 0.00 -0.34 0.00 0.00 43.02 40.26 3d6a s PHE 475 CO 0.13 -1.99 0.98 -0.85 -1.46 0.00 0.00 175.22 172.02 3d6a n GLU 476 N -3.65 -3.05 -2.53 10.12 0.28 -1.26 -4.93 120.64 115.62 3d6a n GLU 476 Ca 0.09 -0.87 -0.43 0.00 -0.16 0.00 0.00 57.16 55.79 3d6a n GLU 476 Cb 0.53 -2.11 -0.02 0.00 1.43 0.00 0.00 31.44 31.27 3d6a n GLU 476 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 177.13 176.51 3d6a s TRP 477 N -2.34 3.00 -0.16 -1.84 -0.00 -1.26 -4.93 118.94 111.41 3d6a s TRP 477 Ca 0.69 1.14 0.01 0.00 -0.00 0.00 0.00 56.10 57.93 3d6a s TRP 477 Cb -0.24 -3.57 0.19 0.00 -0.00 0.00 0.00 33.47 29.86 3d6a s TRP 477 CO 0.65 -1.20 1.50 -1.33 -0.00 0.00 0.00 176.95 176.56 3d6a n MET 478 N 6.74 1.44 -0.05 5.86 2.81 -1.26 -2.53 117.12 130.12 3d6a n MET 478 Ca 0.13 -0.99 -0.09 0.00 -1.81 0.00 0.00 57.70 54.95 3d6a n MET 478 Cb 0.46 -1.39 -0.03 0.00 -0.71 0.00 0.00 33.22 31.55 3d6a n MET 478 CO 0.00 0.00 0.00 1.17 1.51 0.00 0.00 175.97 178.65 3d6a n LYS 479 N 0.19 0.34 -0.18 0.03 0.00 -1.25 -3.25 118.16 114.04 3d6a n LYS 479 Ca 0.19 0.14 0.13 0.00 0.00 0.00 0.00 58.31 58.77 3d6a n LYS 479 Cb 0.78 -1.08 0.45 0.00 0.00 0.00 0.00 35.03 35.18 3d6a n LYS 479 CO 0.00 0.00 0.00 -1.49 0.00 0.00 0.00 177.40 175.91 3d6a h TRP 480 N -0.62 0.60 -2.14 5.64 6.55 -1.89 -3.44 115.95 120.66 3d6a h TRP 480 Ca -0.10 0.02 -0.60 0.00 0.95 0.00 0.00 58.89 59.15 3d6a h TRP 480 Cb 0.80 -0.19 0.04 0.00 -0.86 0.00 0.00 29.16 28.94 3d6a h TRP 480 CO -0.22 0.25 0.94 -1.91 -1.05 0.00 0.00 178.44 176.46 3d6a n GLU 481 N -4.50 2.14 -2.14 0.49 0.00 -1.05 -4.88 120.64 110.70 3d6a n GLU 481 Ca 0.14 0.78 -0.42 0.00 0.00 0.00 0.00 57.16 57.65 3d6a n GLU 481 Cb 0.44 -2.59 0.00 0.00 0.00 0.00 0.00 31.44 29.29 3d6a n GLU 481 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 3d6a n ALA 482 N 5.02 4.93 -3.00 4.31 0.00 -1.26 -4.80 120.51 125.71 3d6a n ALA 482 Ca 0.20 -3.99 0.00 0.00 0.00 0.00 0.00 53.44 49.65 3d6a n ALA 482 Cb 0.29 -3.40 0.00 0.00 0.00 0.00 0.00 19.45 16.34 3d6a n ALA 482 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3d6a n SER 483 N 6.12 0.00 0.00 0.00 2.88 -1.26 -4.95 113.62 116.40 3d6a n SER 483 Ca 0.48 -0.07 0.00 0.00 -1.33 0.00 0.00 58.87 57.95 3d6a n SER 483 Cb 0.40 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.86 3d6a n SER 483 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 3d6a n LYS 484 N 0.00 0.00 -0.67 -1.46 4.81 -1.26 -4.96 118.16 114.62 3d6a n LYS 484 Ca 0.00 0.00 0.04 0.00 -0.87 0.00 0.00 58.31 57.48 3d6a n LYS 484 Cb 0.00 0.00 0.20 0.00 0.02 0.00 0.00 35.03 35.25 3d6a n LYS 484 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3d6a n ALA 485 N -2.42 3.82 -1.81 3.14 0.00 -1.26 -4.74 120.51 117.22 3d6a n ALA 485 Ca 0.00 -3.30 -0.21 0.00 0.00 0.00 0.00 53.44 49.94 3d6a n ALA 485 Cb 0.00 -0.41 0.07 0.00 0.00 0.00 0.00 19.45 19.10 3d6a n ALA 485 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3d6a n THR 486 N -1.11 2.67 -4.33 0.00 -2.24 -1.26 -4.97 114.28 103.03 3d6a n THR 486 Ca 0.22 -3.77 -0.33 0.00 -2.27 0.00 0.00 64.05 57.89 3d6a n THR 486 Cb 0.75 -0.96 -0.15 0.00 -2.10 0.00 0.00 70.33 67.87 3d6a n THR 486 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 3d6a s LEU 487 N -3.56 2.51 -0.09 3.22 0.20 -1.26 -4.81 118.68 114.88 3d6a s LEU 487 Ca 0.51 -0.48 -0.01 0.00 0.69 0.00 0.00 54.13 54.84 3d6a s LEU 487 Cb 0.42 -1.58 0.03 0.00 -0.43 0.00 0.00 46.19 44.62 3d6a s LEU 487 CO 0.02 0.05 -0.04 -0.89 -0.29 0.00 0.00 176.35 175.20 3d6a s THR 488 N 1.02 0.72 0.66 3.68 2.01 -1.26 -5.14 115.64 117.32 3d6a s THR 488 Ca -0.01 -0.10 -0.11 0.00 0.31 0.00 0.00 61.69 61.78 3d6a s THR 488 Cb -0.15 -0.80 -0.02 0.00 0.01 0.00 0.00 72.50 71.55 3d6a s THR 488 CO -0.03 0.31 1.05 -0.36 -0.69 0.00 0.00 174.62 174.91 3d6a s PHE 489 N 1.80 3.47 0.32 4.92 0.08 -1.26 -4.85 117.98 122.45 3d6a s PHE 489 Ca 0.04 1.24 -0.29 0.00 0.12 0.00 0.00 56.93 58.05 3d6a s PHE 489 Cb -0.12 -2.83 -0.10 0.00 -0.57 0.00 0.00 43.02 39.39 3d6a s PHE 489 CO -0.06 -0.91 1.28 -0.51 -0.10 0.00 0.00 175.22 174.92 3d6a s LEU 490 N -5.29 4.44 0.75 -0.37 1.43 -1.26 -5.03 118.68 113.35 3d6a s LEU 490 Ca 0.56 2.62 -0.11 0.00 -1.03 0.00 0.00 54.13 56.17 3d6a s LEU 490 Cb -0.11 -3.64 0.04 0.00 0.03 0.00 0.00 46.19 42.50 3d6a s LEU 490 CO 0.54 -0.49 1.08 0.42 0.23 0.00 0.00 176.35 178.12 3d6a s THR 491 N -1.04 3.57 0.33 5.49 -4.23 -1.26 -4.83 115.64 113.67 3d6a s THR 491 Ca 0.49 0.51 0.05 0.00 -1.18 0.00 0.00 61.69 61.56 3d6a s THR 491 Cb -0.39 -3.21 0.30 0.00 1.34 0.00 0.00 72.50 70.55 3d6a s THR 491 CO 0.50 -0.67 1.87 -0.07 -0.54 0.00 0.00 174.62 175.71 3d6a h LEU 492 N -0.93 0.77 -0.02 4.79 3.38 -1.98 0.86 115.31 122.18 3d6a h LEU 492 Ca -0.45 0.04 -0.00 0.00 0.09 0.00 0.00 57.88 57.55 3d6a h LEU 492 Cb 1.23 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.87 3d6a h LEU 492 CO 0.57 0.42 0.00 -0.33 0.09 0.00 0.00 178.44 179.19 3d6a h GLU 493 N 0.83 0.04 -0.70 1.13 3.07 -1.98 0.12 114.58 117.08 3d6a h GLU 493 Ca 0.45 -0.01 0.05 0.00 -0.50 0.00 0.00 59.36 59.35 3d6a h GLU 493 Cb 0.56 -0.00 -0.05 0.00 -0.84 0.00 0.00 28.75 28.41 3d6a h GLU 493 CO -0.21 0.27 0.42 0.93 -1.40 0.00 0.00 179.01 179.01 3d6a h GLU 494 N -0.20 0.76 -0.36 2.33 5.08 -1.81 0.89 114.58 121.25 3d6a h GLU 494 Ca 0.01 -0.05 -0.00 0.00 -1.00 0.00 0.00 59.36 58.32 3d6a h GLU 494 Cb 0.25 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.31 3d6a h GLU 494 CO 0.00 0.50 0.22 -0.07 -1.00 0.00 0.00 179.01 178.66 3d6a h LEU 495 N 0.78 0.44 -1.04 1.33 3.38 -0.61 -0.51 115.31 119.08 3d6a h LEU 495 Ca 0.30 -0.06 -0.07 0.00 0.09 0.00 0.00 57.88 58.15 3d6a h LEU 495 Cb 0.13 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 3d6a h LEU 495 CO -0.16 0.37 -0.06 0.50 0.09 0.00 0.00 178.44 179.18 3d6a h LYS 496 N 0.47 0.61 -0.64 1.13 3.64 -0.62 -1.04 116.57 120.12 3d6a h LYS 496 Ca 0.13 -0.17 0.03 0.00 -1.27 0.00 0.00 60.65 59.37 3d6a h LYS 496 Cb 0.01 -0.07 -0.04 0.00 -0.41 0.00 0.00 32.23 31.72 3d6a h LYS 496 CO -0.02 0.68 0.40 0.93 -2.27 0.00 0.00 179.45 179.16 3d6a h GLU 497 N 0.57 0.76 -0.53 1.90 5.08 -0.37 -1.97 114.58 120.01 3d6a h GLU 497 Ca 0.11 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 3d6a h GLU 497 Cb 0.46 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.54 3d6a h GLU 497 CO 0.02 0.50 0.00 0.00 -1.00 0.00 0.00 179.01 178.53 3d6a n ALA 498 N -2.30 2.62 -1.83 3.43 0.00 -0.24 -4.89 120.51 117.29 3d6a n ALA 498 Ca 0.06 -0.30 -0.07 0.00 0.00 0.00 0.00 53.44 53.13 3d6a n ALA 498 Cb 0.08 -1.01 -0.01 0.00 0.00 0.00 0.00 19.45 18.51 3d6a n ALA 498 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3d6a n ASN 499 N 0.01 -3.03 -4.66 0.00 5.03 -0.74 -5.03 115.26 106.84 3d6a n ASN 499 Ca 0.05 0.05 -0.40 0.00 0.87 0.00 0.00 54.58 55.15 3d6a n ASN 499 Cb 0.27 -1.97 -0.06 0.00 -1.02 0.00 0.00 39.78 37.01 3d6a n ASN 499 CO 0.00 0.00 0.00 -0.36 -1.83 0.00 0.00 177.26 175.07 3d6a s PHE 500 N -2.32 3.37 -1.17 3.10 0.40 -0.45 -4.98 117.98 115.94 3d6a s PHE 500 Ca 0.00 0.96 -0.19 0.00 -0.60 0.00 0.00 56.93 57.10 3d6a s PHE 500 Cb 0.00 -2.83 -0.04 0.00 0.51 0.00 0.00 43.02 40.66 3d6a s PHE 500 CO 0.00 -0.20 1.99 -1.71 0.70 0.00 0.00 175.22 176.00 3d6a n ASN 501 N 5.15 3.52 -4.87 1.36 5.15 -1.26 -3.75 115.26 120.55 3d6a n ASN 501 Ca -0.00 -2.78 -0.30 0.00 -0.60 0.00 0.00 54.58 50.89 3d6a n ASN 501 Cb 0.49 -1.52 -0.00 0.00 -0.53 0.00 0.00 39.78 38.23 3d6a n ASN 501 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 3d6a s VAL 502 N 5.20 4.73 -0.66 3.44 -7.23 -1.26 -0.53 120.40 124.10 3d6a s VAL 502 Ca 0.55 0.77 -0.20 0.00 -1.81 0.00 0.00 61.98 61.29 3d6a s VAL 502 Cb 0.10 -3.84 0.10 0.00 0.56 0.00 0.00 36.38 33.29 3d6a s VAL 502 CO 0.04 -0.99 0.85 -0.62 -0.31 0.00 0.00 175.10 174.07 3d6a s ASP 503 N -3.96 6.24 0.62 4.85 -1.08 0.13 -4.68 116.67 118.79 3d6a s ASP 503 Ca 0.54 -1.36 0.40 0.00 -0.52 0.00 0.00 52.55 51.61 3d6a s ASP 503 Cb -0.11 -2.35 1.96 0.00 -1.46 0.00 0.00 42.92 40.96 3d6a s ASP 503 CO 0.48 -1.22 2.20 -0.07 0.52 0.00 0.00 175.17 177.08 3d6a h LEU 504 N 10.49 0.00 -0.19 -1.34 3.38 -1.95 -2.99 115.31 122.71 3d6a h LEU 504 Ca -0.24 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.73 3d6a h LEU 504 Cb 1.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.82 3d6a h LEU 504 CO 1.12 0.00 -0.86 0.47 0.09 0.00 0.00 178.44 179.27 3d6a n ASP 505 N -3.09 1.15 -4.71 -0.43 8.00 -1.26 -4.95 116.55 111.26 3d6a n ASP 505 Ca -0.01 -1.04 -0.42 0.00 0.71 0.00 0.00 54.79 54.02 3d6a n ASP 505 Cb 0.18 0.84 -0.03 0.00 -0.02 0.00 0.00 41.12 42.09 3d6a n ASP 505 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 3d6a s TYR 506 N -2.90 3.06 -0.39 1.24 5.04 -1.13 -5.00 117.35 117.27 3d6a s TYR 506 Ca 0.10 0.75 -0.16 0.00 -2.44 0.00 0.00 57.07 55.33 3d6a s TYR 506 Cb 0.17 -3.80 0.01 0.00 0.35 0.00 0.00 41.96 38.68 3d6a s TYR 506 CO 0.80 -2.94 0.38 1.03 -1.34 0.00 0.00 175.55 173.47 3d6a s ARG 507 N 1.37 3.27 0.51 4.97 1.81 -1.26 -5.01 118.95 124.61 3d6a s ARG 507 Ca 0.68 -0.67 -0.19 0.00 -1.72 0.00 0.00 55.73 53.83 3d6a s ARG 507 Cb -0.39 -3.90 -0.07 0.00 -0.45 0.00 0.00 34.95 30.13 3d6a s ARG 507 CO 0.31 -0.69 1.03 -2.14 -0.68 0.00 0.00 175.30 173.12 3d6a s PRO 508 N 1.99 3.72 0.18 3.54 0.02 -1.26 -4.95 135.00 138.24 3d6a s PRO 508 Ca 0.10 1.26 -0.13 0.00 0.02 0.00 0.00 61.00 62.26 3d6a s PRO 508 Cb -0.17 -2.09 0.09 0.00 0.02 0.00 0.00 34.50 32.35 3d6a s PRO 508 CO 0.12 -0.49 1.84 0.00 -0.33 0.00 0.00 177.00 178.15 3d6a h ALA 509 N 1.22 0.77 -3.26 -1.55 0.00 -1.93 -3.40 119.26 111.12 3d6a h ALA 509 Ca -0.48 -0.05 -0.61 0.00 0.00 0.00 0.00 54.91 53.76 3d6a h ALA 509 Cb 1.21 -0.25 -0.34 0.00 0.00 0.00 0.00 17.79 18.42 3d6a h ALA 509 CO 0.59 0.22 -0.85 -1.17 0.00 0.00 0.00 179.25 178.04 3d6a s LEU 510 N -10.11 1.85 0.52 0.00 2.96 -1.26 -5.01 118.68 107.63 3d6a s LEU 510 Ca -0.13 -0.48 -0.22 0.00 -0.22 0.00 0.00 54.13 53.08 3d6a s LEU 510 Cb 0.13 -1.20 -0.06 0.00 0.50 0.00 0.00 46.19 45.57 3d6a s LEU 510 CO 0.76 0.04 1.27 -2.84 -1.32 0.00 0.00 176.35 174.26 3d6a s PRO 511 N 0.89 3.36 0.56 0.98 0.02 -1.26 -3.96 135.00 135.59 3d6a s PRO 511 Ca -0.08 2.02 0.34 0.00 0.02 0.00 0.00 61.00 63.30 3d6a s PRO 511 Cb -0.15 -2.28 1.55 0.00 0.02 0.00 0.00 34.50 33.64 3d6a s PRO 511 CO -0.01 -0.95 2.06 0.07 -0.33 0.00 0.00 177.00 177.84 3d6a h ARG 512 N 1.63 0.00 -0.00 5.54 0.11 -1.99 -1.93 114.38 117.74 3d6a h ARG 512 Ca -0.50 0.00 -0.16 0.00 0.10 0.00 0.00 59.98 59.42 3d6a h ARG 512 Cb 1.28 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 32.34 3d6a h ARG 512 CO 0.58 0.03 -0.77 0.00 0.10 0.00 0.00 179.97 179.92 3d6a h SER 514 N 0.01 0.01 0.00 0.00 0.02 -1.73 -3.45 113.55 108.41 3d6a h SER 514 Ca -0.01 -0.00 -0.49 0.00 -0.84 0.00 0.00 61.79 60.45 3d6a h SER 514 Cb 1.35 -0.00 -0.08 0.00 0.14 0.00 0.00 62.40 63.81 3d6a h SER 514 CO 0.10 0.65 1.60 0.18 -1.14 0.00 0.00 176.83 178.23 3d6a n LEU 515 N -3.77 0.31 -4.59 5.07 7.99 -1.20 -4.77 117.00 116.03 3d6a n LEU 515 Ca -0.01 0.21 -0.42 0.00 -0.01 0.00 0.00 56.01 55.78 3d6a n LEU 515 Cb 0.64 -0.86 -0.03 0.00 -0.11 0.00 0.00 43.42 43.07 3d6a n LEU 515 CO 0.42 -0.67 1.80 -0.04 -1.51 0.00 0.00 177.39 177.39 3d6a s MET 516 N 8.13 3.03 0.62 3.23 -1.94 -1.26 -4.81 119.30 126.30 3d6a s MET 516 Ca 1.25 1.80 0.32 0.00 -1.71 0.00 0.00 55.69 57.35 3d6a s MET 516 Cb -1.19 -4.36 1.78 0.00 2.01 0.00 0.00 34.83 33.06 3d6a s MET 516 CO 0.47 -2.22 2.09 -1.00 -0.01 0.00 0.00 175.02 174.35 3d6a h PRO 517 N 15.18 0.00 -3.20 2.03 0.13 -1.90 -3.35 132.00 140.89 3d6a h PRO 517 Ca -0.37 0.00 -0.29 0.00 -0.87 0.00 0.00 66.00 64.47 3d6a h PRO 517 Cb 1.23 0.00 -0.35 0.00 0.13 0.00 0.00 31.00 32.01 3d6a h PRO 517 CO 1.00 0.00 -0.65 0.00 -0.23 0.00 0.00 178.00 178.13 3d6a s ALA 518 N -4.41 -0.12 0.09 -0.56 0.00 -1.26 -4.85 121.76 110.65 3d6a s ALA 518 Ca -0.04 0.53 0.05 0.00 0.00 0.00 0.00 51.96 52.49 3d6a s ALA 518 Cb 0.13 -0.64 -0.03 0.00 0.00 0.00 0.00 23.12 22.58 3d6a s ALA 518 CO 0.45 -0.40 -0.13 -1.83 0.00 0.00 0.00 175.76 173.85 3d6a s GLU 519 N 1.86 0.89 0.80 0.00 -1.05 -1.20 -5.01 118.70 114.97 3d6a s GLU 519 Ca -0.01 -1.10 -0.06 0.00 -0.15 0.00 0.00 54.97 53.65 3d6a s GLU 519 Cb -0.12 -0.76 0.17 0.00 -0.44 0.00 0.00 34.13 32.98 3d6a s GLU 519 CO -0.05 0.15 1.09 -1.13 0.95 0.00 0.00 175.26 176.26 3d6a n SER 520 N 0.84 0.83 -0.19 0.83 3.41 -1.26 -3.78 113.62 114.31 3d6a n SER 520 Ca -0.18 -1.85 -0.08 0.00 -0.26 0.00 0.00 58.87 56.50 3d6a n SER 520 Cb 0.56 -0.76 0.02 0.00 -0.26 0.00 0.00 64.21 63.77 3d6a n SER 520 CO 0.00 0.00 0.00 0.22 -0.16 0.00 0.00 175.04 175.10 3d6a h TYR 521 N -1.05 0.85 -0.35 7.33 3.20 -2.01 -2.61 116.97 122.32 3d6a h TYR 521 Ca -0.36 -0.07 -0.06 0.00 3.14 0.00 0.00 58.73 61.38 3d6a h TYR 521 Cb 1.16 -0.25 -0.02 0.00 1.54 0.00 0.00 36.73 39.17 3d6a h TYR 521 CO 0.00 0.71 -0.05 -0.44 -1.64 0.00 0.00 178.16 176.73 3d6a h ASP 522 N 0.75 0.55 -0.10 -2.11 3.32 -2.00 -2.12 116.42 114.70 3d6a h ASP 522 Ca 0.18 -0.13 -0.05 0.00 0.02 0.00 0.00 57.03 57.05 3d6a h ASP 522 Cb 0.23 -0.15 -0.00 0.00 0.22 0.00 0.00 39.33 39.64 3d6a h ASP 522 CO -0.01 0.66 -0.12 1.56 -1.72 0.00 0.00 179.24 179.60 3d6a h GLN 523 N 0.54 0.27 0.09 3.56 4.20 -1.94 -3.02 115.11 118.82 3d6a h GLN 523 Ca 0.11 -0.15 0.02 0.00 0.06 0.00 0.00 58.65 58.69 3d6a h GLN 523 Cb 0.43 0.01 -0.05 0.00 0.30 0.00 0.00 27.48 28.17 3d6a h GLN 523 CO 0.02 0.70 -0.44 -0.92 -0.67 0.00 0.00 178.83 177.52 3d6a h TYR 524 N -0.15 -1.24 -0.29 2.96 3.20 -1.21 -2.35 116.97 117.89 3d6a h TYR 524 Ca 0.01 0.03 -0.00 0.00 3.14 0.00 0.00 58.73 61.92 3d6a h TYR 524 Cb 0.66 0.53 -0.01 0.00 1.54 0.00 0.00 36.73 39.45 3d6a h TYR 524 CO 0.09 -0.53 0.17 -0.39 -1.64 0.00 0.00 178.16 175.87 3d6a h VAL 525 N -0.65 1.08 0.02 1.81 -1.51 -1.49 -1.64 116.25 113.87 3d6a h VAL 525 Ca 0.02 -0.18 -0.00 0.00 -1.23 0.00 0.00 66.70 65.31 3d6a h VAL 525 Cb 0.69 0.68 0.00 0.00 -2.13 0.00 0.00 31.29 30.53 3d6a h VAL 525 CO -0.27 0.09 -0.01 -0.08 -1.23 0.00 0.00 177.57 176.07 3d6a h GLU 526 N 0.39 -0.02 -0.42 5.19 4.81 -1.37 -2.14 114.58 121.02 3d6a h GLU 526 Ca 0.10 0.00 0.08 0.00 -0.13 0.00 0.00 59.36 59.42 3d6a h GLU 526 Cb -0.02 0.00 -0.07 0.00 0.63 0.00 0.00 28.75 29.29 3d6a h GLU 526 CO -0.02 0.30 -0.05 -0.09 -0.73 0.00 0.00 179.01 178.42 3d6a h ARG 527 N -0.34 0.05 -0.74 1.92 2.43 -1.00 0.17 114.38 116.86 3d6a h ARG 527 Ca -0.00 -0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.16 3d6a h ARG 527 Cb 0.33 -0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 29.83 3d6a h ARG 527 CO 0.00 0.03 0.46 0.00 -1.51 0.00 0.00 179.97 178.96 3d6a h ALA 529 N 1.24 0.41 0.01 0.00 0.00 -0.77 -0.59 119.26 119.56 3d6a h ALA 529 Ca 0.27 -0.08 0.03 0.00 0.00 0.00 0.00 54.91 55.13 3d6a h ALA 529 Cb -0.05 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 17.56 3d6a h ALA 529 CO -0.05 -0.06 -0.35 0.28 0.00 0.00 0.00 179.25 179.07 3d6a h VAL 530 N 0.39 0.26 -0.83 0.00 2.07 -0.31 -1.99 116.25 115.84 3d6a h VAL 530 Ca 0.11 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.61 3d6a h VAL 530 Cb 0.07 0.26 -0.04 0.00 -1.52 0.00 0.00 31.29 30.06 3d6a h VAL 530 CO -0.02 0.00 0.44 0.28 0.02 0.00 0.00 177.57 178.30 3d6a h SER 531 N -0.50 1.04 -0.25 0.57 0.02 -0.90 -2.49 113.55 111.05 3d6a h SER 531 Ca 0.06 -0.11 -0.06 0.00 -0.84 0.00 0.00 61.79 60.84 3d6a h SER 531 Cb 0.59 -0.27 -0.02 0.00 0.14 0.00 0.00 62.40 62.84 3d6a h SER 531 CO -0.28 0.85 -0.04 0.24 -1.14 0.00 0.00 176.83 176.46 3d6a h MET 532 N 1.16 0.59 -0.07 3.45 2.86 -0.98 -0.19 114.93 121.74 3d6a h MET 532 Ca 0.29 -0.15 0.04 0.00 -2.06 0.00 0.00 59.70 57.82 3d6a h MET 532 Cb 0.05 -0.07 -0.05 0.00 0.06 0.00 0.00 31.60 31.58 3d6a h MET 532 CO -0.04 0.64 -0.27 0.78 1.06 0.00 0.00 176.91 179.08 3d6a h GLY 533 N 0.91 -0.36 0.81 8.32 0.00 -0.92 -0.96 103.07 110.87 3d6a h GLY 533 Ca 0.11 0.32 0.01 0.00 0.00 0.00 0.00 47.33 47.77 3d6a h GLY 533 CO 0.02 -0.21 -0.11 -1.61 0.00 0.00 0.00 176.54 174.63 3d6a h GLN 534 N -0.37 -0.21 -0.90 4.80 4.15 -1.12 -2.63 115.11 118.83 3d6a h GLN 534 Ca 0.08 0.01 0.11 0.00 0.77 0.00 0.00 58.65 59.63 3d6a h GLN 534 Cb 0.49 0.05 -0.07 0.00 0.21 0.00 0.00 27.48 28.16 3d6a h GLN 534 CO -0.28 -0.14 0.58 0.82 -1.93 0.00 0.00 178.83 177.88 3d6a h ILE 535 N -0.22 0.93 0.00 2.39 2.04 -0.89 0.57 117.51 122.33 3d6a h ILE 535 Ca 0.02 -0.29 0.00 0.00 1.00 0.00 0.00 64.86 65.59 3d6a h ILE 535 Cb 0.23 0.01 0.00 0.00 -0.74 0.00 0.00 36.82 36.32 3d6a h ILE 535 CO -0.06 0.15 0.00 0.40 0.00 0.00 0.00 178.15 178.64 3d6a h ILE 536 N 0.84 0.00 0.00 -0.67 1.08 -1.00 -3.12 117.51 114.64 3d6a h ILE 536 Ca 0.43 -0.47 -0.20 0.00 -0.39 0.00 0.00 64.86 64.23 3d6a h ILE 536 Cb 0.50 1.43 -0.04 0.00 -3.07 0.00 0.00 36.82 35.64 3d6a h ILE 536 CO -0.19 0.00 -2.19 0.59 -0.69 0.00 0.00 178.15 175.67 3d6a n ASN 537 N -2.94 0.02 0.23 1.72 3.02 0.14 -4.51 115.26 112.94 3d6a n ASN 537 Ca 0.01 0.01 -0.09 0.00 -0.03 0.00 0.00 54.58 54.48 3d6a n ASN 537 Cb 0.30 1.44 -0.04 0.00 -0.61 0.00 0.00 39.78 40.86 3d6a n ASN 537 CO 0.00 0.00 0.00 0.74 -2.62 0.00 0.00 177.26 175.38 3d6a h THR 538 N 0.00 0.00 -1.27 3.41 2.02 -0.06 -3.44 112.91 113.57 3d6a h THR 538 Ca -0.29 0.00 -0.73 0.00 0.77 0.00 0.00 66.41 66.16 3d6a h THR 538 Cb 1.67 0.00 0.06 0.00 -1.74 0.00 0.00 68.15 68.14 3d6a h THR 538 CO 0.02 0.00 0.07 0.00 0.37 0.00 0.00 175.52 175.97 3d6a s PRO 540 N -0.14 2.16 0.53 0.00 0.02 -1.26 -4.91 135.00 131.39 3d6a s PRO 540 Ca 0.83 1.32 0.35 0.00 0.02 0.00 0.00 61.00 63.52 3d6a s PRO 540 Cb -1.10 -1.88 1.50 0.00 0.02 0.00 0.00 34.50 33.05 3d6a s PRO 540 CO 0.54 -1.74 1.80 1.96 -0.33 0.00 0.00 177.00 179.24 3d6a h GLN 541 N -0.94 0.04 -6.23 5.54 4.20 -1.96 -3.41 115.11 112.35 3d6a h GLN 541 Ca -0.44 -0.00 -0.70 0.00 0.06 0.00 0.00 58.65 57.57 3d6a h GLN 541 Cb 1.25 -0.01 0.04 0.00 0.30 0.00 0.00 27.48 29.05 3d6a h GLN 541 CO 0.50 0.03 0.65 -0.25 -0.67 0.00 0.00 178.83 179.09 3d6a n ASP 542 N -4.24 2.03 0.00 1.46 8.00 -1.26 -4.96 116.55 117.58 3d6a n ASP 542 Ca 0.25 1.10 0.00 0.00 0.71 0.00 0.00 54.79 56.85 3d6a n ASP 542 Cb 1.20 -1.19 0.00 0.00 -0.02 0.00 0.00 41.12 41.11 3d6a n ASP 542 CO 0.00 0.00 0.00 1.15 -0.39 0.00 0.00 177.20 177.96 3d6a n MET 543 N 3.74 0.00 0.00 -1.24 0.00 -1.26 -4.99 117.12 113.36 3d6a n MET 543 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.91 3d6a n MET 543 Cb 0.18 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.40 3d6a n MET 543 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 3d6a n GLY 544 N 3.53 0.24 3.15 3.17 0.00 -1.26 -4.71 105.19 109.30 3d6a n GLY 544 Ca 0.00 -0.97 -0.30 0.00 0.00 0.00 0.00 46.02 44.76 3d6a n GLY 544 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3d6a s ILE 545 N 0.00 1.76 -0.18 -0.61 1.01 0.16 -1.75 121.20 121.59 3d6a s ILE 545 Ca 0.00 -0.84 -0.17 0.00 0.00 0.00 0.00 60.65 59.64 3d6a s ILE 545 Cb 0.00 -1.55 -0.04 0.00 0.01 0.00 0.00 42.46 40.89 3d6a s ILE 545 CO 0.00 0.49 0.44 -0.89 0.00 0.00 0.00 174.94 174.98 3d6a s THR 546 N 0.52 5.18 -0.02 2.92 2.01 -0.12 -0.59 115.64 125.54 3d6a s THR 546 Ca -0.16 0.81 -0.20 0.00 0.31 0.00 0.00 61.69 62.45 3d6a s THR 546 Cb -0.17 -3.77 -0.05 0.00 0.01 0.00 0.00 72.50 68.52 3d6a s THR 546 CO 0.06 0.26 0.58 -0.76 -0.69 0.00 0.00 174.62 174.07 3d6a s LEU 547 N 1.17 4.39 -0.36 4.42 1.02 -0.53 -0.63 118.68 128.17 3d6a s LEU 547 Ca 0.22 1.11 0.03 0.00 0.02 0.00 0.00 54.13 55.51 3d6a s LEU 547 Cb -0.15 -2.89 0.10 0.00 0.02 0.00 0.00 46.19 43.28 3d6a s LEU 547 CO 0.09 0.08 0.09 -0.63 0.02 0.00 0.00 176.35 176.00 3d6a s ILE 548 N -0.05 2.15 -0.40 -0.59 -1.09 0.01 -0.78 121.20 120.45 3d6a s ILE 548 Ca 0.30 -2.38 -0.18 0.00 -2.23 0.00 0.00 60.65 56.16 3d6a s ILE 548 Cb -0.18 -2.57 0.01 0.00 -1.58 0.00 0.00 42.46 38.14 3d6a s ILE 548 CO 0.16 -0.64 0.49 -0.69 -1.23 0.00 0.00 174.94 173.03 3d6a s VAL 549 N 0.80 5.02 0.00 2.92 1.01 0.36 -1.21 120.40 129.31 3d6a s VAL 549 Ca 0.12 -0.04 0.00 0.00 0.00 0.00 0.00 61.98 62.06 3d6a s VAL 549 Cb -0.20 -4.03 0.00 0.00 0.00 0.00 0.00 36.38 32.15 3d6a s VAL 549 CO -0.09 -0.37 0.00 -0.24 0.00 0.00 0.00 175.10 174.40 3d6a n SER 550 N 5.75 0.52 -4.91 3.32 2.88 -0.45 -1.31 113.62 119.41 3d6a n SER 550 Ca -0.06 0.00 -0.23 0.00 -1.33 0.00 0.00 58.87 57.26 3d6a n SER 550 Cb 0.48 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 63.93 3d6a n SER 550 CO 0.00 0.00 0.00 -1.00 -1.23 0.00 0.00 175.04 172.81 3d6a s HIS 551 N 0.37 2.13 0.24 0.66 3.76 -1.26 -1.98 115.29 119.21 3d6a s HIS 551 Ca 0.00 -0.65 -0.02 0.00 -0.15 0.00 0.00 55.06 54.23 3d6a s HIS 551 Cb 0.00 -2.09 0.28 0.00 1.11 0.00 0.00 32.58 31.89 3d6a s HIS 551 CO 0.00 -0.40 1.71 0.66 -0.85 0.00 0.00 174.74 175.85 3d6a h SER 552 N 0.80 0.74 -0.07 1.40 4.64 -1.94 -2.11 113.55 117.02 3d6a h SER 552 Ca -0.38 -0.22 0.01 0.00 -0.47 0.00 0.00 61.79 60.73 3d6a h SER 552 Cb 1.28 -0.20 -0.00 0.00 -0.31 0.00 0.00 62.40 63.17 3d6a h SER 552 CO 0.55 0.88 0.05 0.77 -0.87 0.00 0.00 176.83 178.21 3d6a h SER 553 N 0.69 0.06 0.19 4.97 4.64 -1.96 -2.71 113.55 119.42 3d6a h SER 553 Ca 0.12 -0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.41 3d6a h SER 553 Cb 0.58 -0.01 -0.00 0.00 -0.31 0.00 0.00 62.40 62.65 3d6a h SER 553 CO 0.04 0.04 -0.11 0.00 -0.87 0.00 0.00 176.83 175.93 3d6a h ALA 554 N 1.96 1.55 0.00 5.18 0.00 -1.76 -1.56 119.26 124.63 3d6a h ALA 554 Ca 0.03 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.84 3d6a h ALA 554 Cb 0.03 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.80 3d6a h ALA 554 CO -0.00 0.14 0.00 -0.07 0.00 0.00 0.00 179.25 179.31 3d6a h LEU 555 N 0.00 0.00 0.00 0.00 4.07 -1.58 0.45 115.31 118.25 3d6a h LEU 555 Ca -0.00 0.00 -0.36 0.00 0.08 0.00 0.00 57.88 57.60 3d6a h LEU 555 Cb 0.23 0.00 -0.05 0.00 1.08 0.00 0.00 40.66 41.92 3d6a h LEU 555 CO 0.01 0.00 -2.20 -0.67 -1.08 0.00 0.00 178.44 174.51 3d6a n ASP 556 N -3.05 1.52 0.27 -0.43 2.03 -0.94 -4.37 116.55 111.58 3d6a n ASP 556 Ca -0.02 0.26 0.16 0.00 0.52 0.00 0.00 54.79 55.71 3d6a n ASP 556 Cb 0.14 -0.62 0.64 0.00 -0.72 0.00 0.00 41.12 40.55 3d6a n ASP 556 CO 0.00 0.00 0.00 0.77 -1.92 0.00 0.00 177.20 176.05 3d6a h SER 557 N -0.76 0.00 -0.02 1.67 4.64 -1.21 0.25 113.55 118.13 3d6a h SER 557 Ca -0.54 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.78 3d6a h SER 557 Cb 1.48 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.57 3d6a h SER 557 CO -0.33 0.03 -0.07 0.00 -0.87 0.00 0.00 176.83 175.60 3d6a n THR 559 N 0.92 0.52 -0.24 0.00 -2.24 -0.73 -4.55 114.28 107.95 3d6a n THR 559 Ca 0.14 -0.19 0.02 0.00 -2.27 0.00 0.00 64.05 61.75 3d6a n THR 559 Cb 0.53 -0.87 0.14 0.00 -2.10 0.00 0.00 70.33 68.04 3d6a n THR 559 CO 0.00 0.00 0.00 0.03 -0.57 0.00 0.00 175.07 174.53 3d6a h ARG 560 N -0.02 0.54 -0.61 -0.78 3.08 -1.21 -1.39 114.38 113.99 3d6a h ARG 560 Ca -0.20 -0.03 -0.01 0.00 0.07 0.00 0.00 59.98 59.80 3d6a h ARG 560 Cb 1.31 -0.12 -0.03 0.00 0.08 0.00 0.00 29.97 31.20 3d6a h ARG 560 CO -0.04 0.36 0.32 -1.35 -1.07 0.00 0.00 179.97 178.19 3d6a h PRO 561 N 0.56 0.84 -0.31 0.04 0.11 -1.79 0.15 132.00 131.59 3d6a h PRO 561 Ca 0.35 -0.09 -0.07 0.00 0.11 0.00 0.00 66.00 66.31 3d6a h PRO 561 Cb 0.40 -0.17 -0.02 0.00 0.11 0.00 0.00 31.00 31.33 3d6a h PRO 561 CO -0.29 0.62 -0.09 -0.07 -0.21 0.00 0.00 178.00 177.96 3d6a h LEU 562 N 0.84 0.50 -0.69 2.35 3.38 -1.53 -2.64 115.31 117.51 3d6a h LEU 562 Ca 0.21 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 58.06 3d6a h LEU 562 Cb 0.04 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 40.66 3d6a h LEU 562 CO -0.03 0.63 0.00 0.18 0.09 0.00 0.00 178.44 179.31 3d6a n LEU 563 N -4.22 1.01 -1.98 1.67 4.77 -0.64 -3.98 117.00 113.63 3d6a n LEU 563 Ca 0.01 -0.50 -0.19 0.00 -0.03 0.00 0.00 56.01 55.29 3d6a n LEU 563 Cb 0.31 -0.13 -0.05 0.00 -2.33 0.00 0.00 43.42 41.22 3d6a n LEU 563 CO 0.40 0.25 -0.21 0.61 -1.33 0.00 0.00 177.39 177.11 3d6a n GLY 564 N 0.79 0.66 3.86 -0.72 0.00 -0.99 -4.92 105.19 103.87 3d6a n GLY 564 Ca 0.06 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.74 3d6a n GLY 564 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3d6a s LEU 565 N -5.24 4.25 0.83 0.99 1.43 -0.00 -5.02 118.68 115.92 3d6a s LEU 565 Ca 0.00 0.34 -0.11 0.00 -1.03 0.00 0.00 54.13 53.33 3d6a s LEU 565 Cb 0.00 -2.32 0.09 0.00 0.03 0.00 0.00 46.19 43.99 3d6a s LEU 565 CO 0.00 0.32 1.09 -2.16 0.23 0.00 0.00 176.35 175.84 3d6a s PRO 566 N -1.52 1.80 0.63 1.29 0.04 -1.26 -4.04 135.00 131.94 3d6a s PRO 566 Ca 0.21 0.72 -0.17 0.00 0.04 0.00 0.00 61.00 61.81 3d6a s PRO 566 Cb -0.12 -1.88 -0.02 0.00 0.04 0.00 0.00 34.50 32.52 3d6a s PRO 566 CO 0.12 -1.84 1.14 -1.25 0.04 0.00 0.00 177.00 175.21 3d6a s PRO 567 N -5.07 2.89 0.65 0.56 0.04 -1.26 -4.96 135.00 127.85 3d6a s PRO 567 Ca 0.62 1.55 -0.13 0.00 0.04 0.00 0.00 61.00 63.07 3d6a s PRO 567 Cb -0.16 -1.95 -0.01 0.00 0.04 0.00 0.00 34.50 32.43 3d6a s PRO 567 CO 0.55 -1.21 1.06 1.03 0.04 0.00 0.00 177.00 178.48 3d6a s ARG 568 N -3.76 3.04 0.31 4.56 0.52 -1.26 -5.01 118.95 117.35 3d6a s ARG 568 Ca 0.71 1.11 -0.30 0.00 -0.52 0.00 0.00 55.73 56.73 3d6a s ARG 568 Cb -0.24 -2.00 -0.11 0.00 0.52 0.00 0.00 34.95 33.12 3d6a s ARG 568 CO 0.37 -1.02 1.58 -2.00 0.02 0.00 0.00 175.30 174.25 3d6a s GLU 569 N -4.55 4.11 0.40 3.54 2.12 -1.26 -4.78 118.70 118.29 3d6a s GLU 569 Ca 0.61 2.59 0.15 0.00 0.36 0.00 0.00 54.97 58.69 3d6a s GLU 569 Cb -0.15 -3.01 1.02 0.00 0.26 0.00 0.00 34.13 32.24 3d6a s GLU 569 CO 0.46 -0.63 1.87 0.00 -0.54 0.00 0.00 175.26 176.42 3d6a h GLY 571 N 0.47 1.06 0.97 0.00 0.00 -1.99 -2.22 103.07 101.36 3d6a h GLY 571 Ca 0.45 -0.97 -0.07 0.00 0.00 0.00 0.00 47.33 46.74 3d6a h GLY 571 CO -0.18 0.88 -0.03 -1.80 0.00 0.00 0.00 176.54 175.41 3d6a h ASP 572 N 0.82 0.74 0.08 0.19 3.58 -1.30 -2.10 116.42 118.43 3d6a h ASP 572 Ca 0.10 -0.33 0.01 0.00 0.42 0.00 0.00 57.03 57.23 3d6a h ASP 572 Cb 0.83 -0.20 -0.02 0.00 1.72 0.00 0.00 39.33 41.66 3d6a h ASP 572 CO 0.07 0.89 -0.13 0.15 -2.88 0.00 0.00 179.24 177.35 3d6a h PHE 573 N 0.58 -0.33 -0.44 0.28 3.57 -1.31 -2.77 116.94 116.52 3d6a h PHE 573 Ca 0.11 0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.56 3d6a h PHE 573 Cb 0.53 0.14 -0.02 0.00 2.79 0.00 0.00 35.95 39.39 3d6a h PHE 573 CO 0.04 -0.19 0.01 0.00 -2.23 0.00 0.00 178.31 175.94 3d6a h ALA 574 N 0.64 1.20 -0.65 2.41 0.00 -1.36 -1.04 119.26 120.45 3d6a h ALA 574 Ca 0.02 -0.24 -0.07 0.00 0.00 0.00 0.00 54.91 54.62 3d6a h ALA 574 Cb 0.27 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 3d6a h ALA 574 CO -0.07 0.53 0.12 0.37 0.00 0.00 0.00 179.25 180.20 3d6a h GLN 575 N 0.67 1.06 0.10 0.00 4.15 -1.35 -2.51 115.11 117.24 3d6a h GLN 575 Ca 0.14 -0.28 -0.29 0.00 0.77 0.00 0.00 58.65 58.99 3d6a h GLN 575 Cb 0.40 -0.13 0.03 0.00 0.21 0.00 0.00 27.48 27.98 3d6a h GLN 575 CO 0.01 0.97 -1.22 -0.07 -1.93 0.00 0.00 178.83 176.60 3d6a h LEU 576 N 0.98 0.84 -0.95 -2.39 3.38 -1.19 -3.36 115.31 112.63 3d6a h LEU 576 Ca 0.20 -0.77 -0.10 0.00 0.09 0.00 0.00 57.88 57.30 3d6a h LEU 576 Cb 0.41 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 3d6a h LEU 576 CO 0.01 1.58 -0.28 0.58 0.09 0.00 0.00 178.44 180.42 3d6a h VAL 577 N 0.28 1.27 0.00 1.22 2.07 -1.15 -2.99 116.25 116.94 3d6a h VAL 577 Ca -0.18 -1.30 0.00 0.00 0.82 0.00 0.00 66.70 66.05 3d6a h VAL 577 Cb 1.89 1.40 0.00 0.00 -1.52 0.00 0.00 31.29 33.06 3d6a h VAL 577 CO 0.23 0.41 0.00 -2.11 0.02 0.00 0.00 177.57 176.12 3d6a n ARG 578 N -4.11 0.03 -0.37 1.57 1.85 -0.95 -2.80 116.66 111.89 3d6a n ARG 578 Ca -0.01 0.29 0.08 0.00 -1.00 0.00 0.00 57.85 57.21 3d6a n ARG 578 Cb 0.42 -1.50 0.24 0.00 -1.05 0.00 0.00 32.46 30.57 3d6a n ARG 578 CO 0.00 0.00 0.00 1.63 -0.01 0.00 0.00 177.63 179.25 3d6a n LYS 579 N -1.46 3.10 -2.88 2.89 4.76 -1.13 -4.95 118.16 118.49 3d6a n LYS 579 Ca 0.03 -2.51 -0.42 0.00 -2.87 0.00 0.00 58.31 52.55 3d6a n LYS 579 Cb 0.11 -1.60 -0.04 0.00 -1.84 0.00 0.00 35.03 31.67 3d6a n LYS 579 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 3d6a s ILE 580 N -1.73 4.86 0.83 -0.18 1.01 -1.12 -5.05 121.20 119.82 3d6a s ILE 580 Ca 0.36 1.63 -0.12 0.00 0.00 0.00 0.00 60.65 62.52 3d6a s ILE 580 Cb 0.24 -4.14 0.09 0.00 0.01 0.00 0.00 42.46 38.66 3d6a s ILE 580 CO 0.17 -0.00 1.19 -2.16 0.00 0.00 0.00 174.94 174.14 3d6a s PRO 581 N 2.33 1.81 0.30 2.79 0.04 -1.26 -4.93 135.00 136.08 3d6a s PRO 581 Ca 0.38 0.07 -0.29 0.00 0.04 0.00 0.00 61.00 61.20 3d6a s PRO 581 Cb -0.16 -1.94 -0.13 0.00 0.04 0.00 0.00 34.50 32.31 3d6a s PRO 581 CO 0.11 -1.70 1.22 0.43 0.04 0.00 0.00 177.00 177.11 3d6a n SER 582 N -3.38 2.28 -0.14 6.66 7.64 -1.26 -1.33 113.62 124.10 3d6a n SER 582 Ca 0.09 1.19 -0.02 0.00 1.01 0.00 0.00 58.87 61.13 3d6a n SER 582 Cb 0.61 -1.41 -0.01 0.00 -1.01 0.00 0.00 64.21 62.39 3d6a n SER 582 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 3d6a n LEU 583 N 1.18 0.63 -4.72 -3.43 7.99 -0.65 -4.96 117.00 113.04 3d6a n LEU 583 Ca 0.08 0.04 -0.42 0.00 -0.01 0.00 0.00 56.01 55.70 3d6a n LEU 583 Cb 0.34 -2.23 -0.00 0.00 -0.11 0.00 0.00 43.42 41.41 3d6a n LEU 583 CO 0.62 -0.86 0.98 0.61 -1.51 0.00 0.00 177.39 177.23 3d6a n GLY 584 N 0.28 0.79 3.24 -0.72 0.00 -0.44 -4.61 105.19 103.73 3d6a n GLY 584 Ca -0.02 0.31 -0.21 0.00 0.00 0.00 0.00 46.02 46.10 3d6a n GLY 584 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3d6a s MET 585 N -1.97 1.00 -0.03 1.61 -1.94 -1.26 -1.22 119.30 115.48 3d6a s MET 585 Ca 0.55 -1.11 0.01 0.00 -1.71 0.00 0.00 55.69 53.43 3d6a s MET 585 Cb -0.54 -1.10 0.02 0.00 2.01 0.00 0.00 34.83 35.23 3d6a s MET 585 CO 0.63 0.24 -0.02 0.00 -0.01 0.00 0.00 175.02 175.86 3d6a s PHE 587 N 0.92 1.81 -0.13 0.00 5.36 -1.26 -0.45 117.98 124.22 3d6a s PHE 587 Ca -0.11 -0.87 0.03 0.00 -0.96 0.00 0.00 56.93 55.02 3d6a s PHE 587 Cb -0.14 -1.35 0.01 0.00 -0.34 0.00 0.00 43.02 41.20 3d6a s PHE 587 CO -0.01 -0.49 -0.22 0.00 -1.46 0.00 0.00 175.22 173.04 3d6a s GLU 589 N 0.73 3.22 -0.22 0.00 2.02 0.62 -0.67 118.70 124.40 3d6a s GLU 589 Ca -0.09 -0.51 -0.11 0.00 0.02 0.00 0.00 54.97 54.28 3d6a s GLU 589 Cb -0.16 -2.93 -0.05 0.00 0.10 0.00 0.00 34.13 31.09 3d6a s GLU 589 CO 0.00 0.61 0.19 -2.00 0.02 0.00 0.00 175.26 174.08 3d6a s GLU 590 N -2.31 4.14 -0.61 1.61 2.12 0.38 -0.10 118.70 123.93 3d6a s GLU 590 Ca 0.31 -0.17 -0.21 0.00 0.36 0.00 0.00 54.97 55.26 3d6a s GLU 590 Cb -0.13 -3.49 0.08 0.00 0.26 0.00 0.00 34.13 30.85 3d6a s GLU 590 CO 0.23 0.14 0.84 1.21 -0.54 0.00 0.00 175.26 177.14 3d6a s ASN 591 N 0.79 6.20 0.16 -1.70 3.84 -0.03 -4.40 114.94 119.79 3d6a s ASN 591 Ca 0.10 -1.07 -0.08 0.00 0.21 0.00 0.00 52.86 52.01 3d6a s ASN 591 Cb -0.13 -2.37 0.01 0.00 -0.55 0.00 0.00 41.25 38.21 3d6a s ASN 591 CO 0.03 -1.26 1.48 0.08 -2.79 0.00 0.00 177.10 174.64 3d6a h ARG 592 N 9.36 0.81 -0.34 0.43 0.11 -1.97 0.33 114.38 123.11 3d6a h ARG 592 Ca -0.29 -0.46 -0.14 0.00 0.10 0.00 0.00 59.98 59.20 3d6a h ARG 592 Cb 1.08 0.03 -0.01 0.00 1.11 0.00 0.00 29.97 32.18 3d6a h ARG 592 CO 1.12 1.09 -0.34 1.49 0.10 0.00 0.00 179.97 183.44 3d6a h GLU 593 N 0.65 0.75 -0.02 0.08 4.22 -1.97 -3.15 114.58 115.15 3d6a h GLU 593 Ca 0.04 -0.36 0.00 0.00 0.08 0.00 0.00 59.36 59.12 3d6a h GLU 593 Cb 1.03 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.28 3d6a h GLU 593 CO 0.10 0.98 -0.19 -0.25 -2.18 0.00 0.00 179.01 177.47 3d6a n ASP 594 N -4.06 1.81 -3.46 1.04 9.92 -1.18 -5.01 116.55 115.61 3d6a n ASP 594 Ca -0.01 -1.44 -0.16 0.00 -0.53 0.00 0.00 54.79 52.65 3d6a n ASP 594 Cb 0.50 0.15 0.01 0.00 -0.64 0.00 0.00 41.12 41.14 3d6a n ASP 594 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3d6a n GLY 595 N 1.32 -1.22 3.61 0.44 0.00 0.09 -5.01 105.19 104.42 3d6a n GLY 595 Ca 0.14 0.52 -0.02 0.00 0.00 0.00 0.00 46.02 46.65 3d6a n GLY 595 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3d6a s LYS 596 N -4.34 0.31 -0.03 1.61 -2.85 -1.11 -5.04 119.74 108.28 3d6a s LYS 596 Ca 0.11 -0.14 0.03 0.00 -1.00 0.00 0.00 55.97 54.97 3d6a s LYS 596 Cb -0.04 0.13 -0.03 0.00 -2.06 0.00 0.00 37.83 35.83 3d6a s LYS 596 CO 0.83 -0.14 -0.12 -1.58 0.10 0.00 0.00 175.35 174.44 3d6a s TRP 597 N -2.39 2.76 -0.14 1.78 0.52 -1.26 -0.85 118.94 119.37 3d6a s TRP 597 Ca 0.11 -0.11 -0.00 0.00 0.02 0.00 0.00 56.10 56.11 3d6a s TRP 597 Cb 0.01 -1.62 -0.01 0.00 -1.15 0.00 0.00 33.47 30.70 3d6a s TRP 597 CO -0.04 0.26 -0.12 -0.51 0.02 0.00 0.00 176.95 176.55 3d6a s ASP 598 N -0.97 4.04 -0.02 2.95 1.01 0.85 -4.67 116.67 119.86 3d6a s ASP 598 Ca 0.13 -0.33 -0.30 0.00 0.71 0.00 0.00 52.55 52.76 3d6a s ASP 598 Cb -0.11 -1.62 -0.04 0.00 1.01 0.00 0.00 42.92 42.16 3d6a s ASP 598 CO 0.03 0.15 1.27 -0.22 0.21 0.00 0.00 175.17 176.61 3d6a s LEU 599 N 0.44 4.30 0.21 1.23 2.96 -1.26 -0.28 118.68 126.28 3d6a s LEU 599 Ca -0.09 1.95 0.02 0.00 -0.22 0.00 0.00 54.13 55.78 3d6a s LEU 599 Cb -0.16 -3.56 -0.05 0.00 0.50 0.00 0.00 46.19 42.92 3d6a s LEU 599 CO 0.05 -0.62 0.04 -0.69 -1.32 0.00 0.00 176.35 173.80 3d6a s VAL 600 N 2.15 0.64 0.13 1.68 1.01 0.81 -4.95 120.40 121.88 3d6a s VAL 600 Ca 0.59 -1.99 -0.31 0.00 0.00 0.00 0.00 61.98 60.27 3d6a s VAL 600 Cb -0.28 -2.31 -0.11 0.00 0.00 0.00 0.00 36.38 33.68 3d6a s VAL 600 CO 0.24 -0.30 1.83 0.20 0.00 0.00 0.00 175.10 177.08 3d6a s ASN 601 N -3.23 6.41 0.68 3.32 0.01 -1.26 -4.11 114.94 116.76 3d6a s ASN 601 Ca 0.29 2.78 -0.17 0.00 -0.71 0.00 0.00 52.86 55.05 3d6a s ASN 601 Cb 0.07 -2.57 0.00 0.00 0.41 0.00 0.00 41.25 39.16 3d6a s ASN 601 CO 0.08 -1.01 1.15 -2.65 -1.51 0.00 0.00 177.10 173.15 3d6a n PRO 602 N 5.58 0.80 0.00 -0.60 -0.02 -1.26 -4.91 135.00 134.59 3d6a n PRO 602 Ca 0.18 0.33 0.09 0.00 -2.02 0.00 0.00 63.50 62.08 3d6a n PRO 602 Cb 0.38 -2.38 0.41 0.00 -0.02 0.00 0.00 33.50 31.89 3d6a n PRO 602 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 3d6a n PRO 603 N -1.94 0.09 -4.33 0.52 -0.04 -1.26 -4.73 135.00 123.31 3d6a n PRO 603 Ca 0.15 0.16 -0.23 0.00 -0.04 0.00 0.00 63.50 63.54 3d6a n PRO 603 Cb 0.49 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 32.33 3d6a n PRO 603 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 3d6a s VAL 604 N -2.86 1.84 0.96 0.52 -7.23 -1.26 -4.86 120.40 107.51 3d6a s VAL 604 Ca 0.12 -1.84 -0.12 0.00 -1.81 0.00 0.00 61.98 58.33 3d6a s VAL 604 Cb 0.12 -1.80 0.17 0.00 0.56 0.00 0.00 36.38 35.43 3d6a s VAL 604 CO 0.31 -0.24 1.09 -0.54 -0.31 0.00 0.00 175.10 175.41 3d6a s LYS 605 N -2.58 0.72 0.92 4.82 -0.14 -1.26 -5.05 119.74 117.17 3d6a s LYS 605 Ca 0.14 0.79 -0.12 0.00 -1.36 0.00 0.00 55.97 55.42 3d6a s LYS 605 Cb -0.07 -1.75 0.14 0.00 -1.68 0.00 0.00 37.83 34.47 3d6a s LYS 605 CO 0.06 -2.60 1.10 -0.08 -0.76 0.00 0.00 175.35 173.06 3d6a s THR 606 N -2.86 2.48 -0.21 2.17 -1.32 -1.26 -5.07 115.64 109.58 3d6a s THR 606 Ca 0.65 0.16 0.00 0.00 -1.21 0.00 0.00 61.69 61.29 3d6a s THR 606 Cb -0.19 -2.68 0.05 0.00 -1.51 0.00 0.00 72.50 68.17 3d6a s THR 606 CO 0.58 -0.21 -0.06 -0.22 -2.21 0.00 0.00 174.62 172.51 3d6a s LEU 607 N -6.24 2.27 -0.17 9.08 2.96 -1.26 -5.11 118.68 120.20 3d6a s LEU 607 Ca 0.64 -1.01 -0.02 0.00 -0.22 0.00 0.00 54.13 53.52 3d6a s LEU 607 Cb -0.18 -1.12 -0.01 0.00 0.50 0.00 0.00 46.19 45.39 3d6a s LEU 607 CO 0.57 -0.21 -0.10 -0.89 -1.32 0.00 0.00 176.35 174.40 3d6a s THR 608 N 1.46 3.15 0.14 3.68 2.01 -1.26 -5.04 115.64 119.78 3d6a s THR 608 Ca -0.03 -0.60 -0.09 0.00 0.31 0.00 0.00 61.69 61.28 3d6a s THR 608 Cb -0.18 -2.37 -0.00 0.00 0.01 0.00 0.00 72.50 69.96 3d6a s THR 608 CO -0.07 0.48 0.26 -1.38 -0.69 0.00 0.00 174.62 173.22 3d6a s HIS 609 N 0.87 0.27 0.71 4.92 -3.43 -1.26 -5.17 115.29 112.20 3d6a s HIS 609 Ca -0.03 -0.66 -0.02 0.00 -0.80 0.00 0.00 55.06 53.56 3d6a s HIS 609 Cb -0.15 -0.03 0.11 0.00 -1.43 0.00 0.00 32.58 31.08 3d6a s HIS 609 CO 0.00 -0.66 0.98 0.20 -2.00 0.00 0.00 174.74 173.26 3d6a s GLY 610 N -2.92 1.77 0.70 -1.38 0.00 -1.26 -5.11 107.32 99.12 3d6a s GLY 610 Ca 0.12 -1.56 -0.08 0.00 0.00 0.00 0.00 44.72 43.20 3d6a s GLY 610 CO -0.05 -1.04 1.03 0.00 0.00 0.00 0.00 173.10 173.05 3d6a s ALA 611 N -3.14 3.06 -0.14 3.20 0.00 -1.26 -5.10 121.76 118.39 3d6a s ALA 611 Ca 0.65 -0.75 -0.00 0.00 0.00 0.00 0.00 51.96 51.85 3d6a s ALA 611 Cb -0.06 -2.72 0.03 0.00 0.00 0.00 0.00 23.12 20.36 3d6a s ALA 611 CO 0.44 -1.24 -0.10 1.21 0.00 0.00 0.00 175.76 176.07 3d6a s ASN 612 N -4.46 2.51 0.46 0.00 2.47 -1.26 -5.13 114.94 109.52 3d6a s ASN 612 Ca 0.59 -0.45 -0.15 0.00 0.42 0.00 0.00 52.86 53.26 3d6a s ASN 612 Cb -0.11 -0.98 -0.08 0.00 -1.45 0.00 0.00 41.25 38.63 3d6a s ASN 612 CO 0.46 -0.11 0.90 -0.44 -3.72 0.00 0.00 177.10 174.20 3d6a s SER 613 N 1.61 6.66 0.11 -4.21 0.01 -1.26 -5.01 113.70 111.61 3d6a s SER 613 Ca 0.04 1.45 -0.36 0.00 1.31 0.00 0.00 55.95 58.39 3d6a s SER 613 Cb -0.13 -2.45 -0.16 0.00 0.21 0.00 0.00 66.02 63.48 3d6a s SER 613 CO -0.09 -0.47 1.31 0.52 0.41 0.00 0.00 173.24 174.92 3d6a n VAL 614 N -1.26 0.22 -4.50 3.43 0.31 -1.26 -5.01 118.33 110.26 3d6a n VAL 614 Ca 0.05 -0.06 -0.24 0.00 -0.01 0.00 0.00 64.34 64.09 3d6a n VAL 614 Cb 0.54 -0.86 -0.17 0.00 -0.91 0.00 0.00 33.84 32.44 3d6a n VAL 614 CO 0.00 0.00 0.00 0.12 -1.32 0.00 0.00 176.83 175.63 3d6a s PHE 615 N 0.33 1.33 -0.29 3.52 5.36 -1.26 -5.10 117.98 121.87 3d6a s PHE 615 Ca 0.81 -0.48 0.03 0.00 -0.96 0.00 0.00 56.93 56.33 3d6a s PHE 615 Cb -0.92 -1.00 0.08 0.00 -0.34 0.00 0.00 43.02 40.84 3d6a s PHE 615 CO 0.48 -0.26 -0.04 1.21 -1.46 0.00 0.00 175.22 175.15 3d6a s ASN 616 N 0.72 4.48 0.38 6.13 2.47 -1.26 -5.01 114.94 122.85 3d6a s ASN 616 Ca -0.14 -1.66 0.12 0.00 0.42 0.00 0.00 52.86 51.61 3d6a s ASN 616 Cb -0.16 -1.51 0.93 0.00 -1.45 0.00 0.00 41.25 39.07 3d6a s ASN 616 CO 0.03 -0.27 1.86 4.11 -3.72 0.00 0.00 177.10 179.11 3d6a h TRP 617 N 7.75 0.71 -0.86 0.43 5.08 -2.00 -1.68 115.95 125.37 3d6a h TRP 617 Ca -0.13 0.02 0.08 0.00 1.08 0.00 0.00 58.89 59.94 3d6a h TRP 617 Cb 1.04 -0.22 -0.06 0.00 -3.00 0.00 0.00 29.16 26.92 3d6a h TRP 617 CO 0.55 0.23 0.56 0.00 -1.28 0.00 0.00 178.44 178.49 3d6a h ARG 618 N 0.57 0.86 0.00 0.12 3.08 -2.00 -0.07 114.38 116.94 3d6a h ARG 618 Ca 0.46 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.46 3d6a h ARG 618 Cb 0.91 -0.19 0.00 0.00 0.08 0.00 0.00 29.97 30.76 3d6a h ARG 618 CO -0.20 0.57 0.00 -0.91 -1.07 0.00 0.00 179.97 178.36 3d6a h ASN 619 N 0.89 0.00 0.00 7.04 2.35 -1.74 -3.40 115.58 120.72 3d6a h ASN 619 Ca 0.38 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.13 3d6a h ASN 619 Cb 0.33 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.70 3d6a h ASN 619 CO -0.15 0.00 -0.45 0.79 -1.65 0.00 0.00 177.43 175.97 3d6a n TRP 620 N -2.52 0.00 0.08 1.19 7.02 -0.76 -4.96 117.44 117.49 3d6a n TRP 620 Ca -0.01 0.00 -0.19 0.00 -1.02 0.00 0.00 57.50 56.29 3d6a n TRP 620 Cb 0.11 0.14 -0.14 0.00 -2.42 0.00 0.00 31.31 29.00 3d6a n TRP 620 CO 0.00 0.00 0.00 0.82 -2.02 0.00 0.00 177.69 176.49 3d6a h ILE 621 N 0.00 1.19 0.00 -0.99 5.03 -1.24 -3.52 117.51 117.98 3d6a h ILE 621 Ca 0.00 -2.78 0.00 0.00 -0.12 0.00 0.00 64.86 61.96 3d6a h ILE 621 Cb 0.45 2.82 0.00 0.00 -3.03 0.00 0.00 36.82 37.06 3d6a h ILE 621 CO 0.00 0.83 0.00 -1.54 -0.68 0.00 0.00 178.15 176.76