#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r0x s THR 389 N 0.00 0.44 0.08 6.66 -4.23 -1.26 -4.16 115.64 113.17 1r0x s THR 389 Ca 0.00 -2.00 0.04 0.00 -1.18 0.00 0.00 61.69 58.55 1r0x s THR 389 Cb 0.00 -2.39 -0.03 0.00 1.34 0.00 0.00 72.50 71.42 1r0x s THR 389 CO 0.00 0.00 -0.11 0.28 -0.54 0.00 0.00 174.62 174.25 1r0x s THR 390 N -3.30 0.92 0.81 3.99 -1.32 -1.17 -4.99 115.64 110.59 1r0x s THR 390 Ca 0.28 -1.50 -0.09 0.00 -1.21 0.00 0.00 61.69 59.17 1r0x s THR 390 Cb 0.03 -1.20 0.13 0.00 -1.51 0.00 0.00 72.50 69.95 1r0x s THR 390 CO 0.18 -0.47 1.14 -0.83 -2.21 0.00 0.00 174.62 172.43 1r0x s GLY 391 N -2.19 1.73 -0.13 6.08 0.00 -1.26 -4.19 107.32 107.37 1r0x s GLY 391 Ca 0.02 -1.18 -0.06 0.00 0.00 0.00 0.00 44.72 43.49 1r0x s GLY 391 CO 0.01 -0.59 0.30 -1.50 0.00 0.00 0.00 173.10 171.31 1r0x s ILE 392 N -3.50 -0.04 0.02 0.90 2.07 -0.10 -4.42 121.20 116.13 1r0x s ILE 392 Ca 0.67 0.13 0.08 0.00 -1.41 0.00 0.00 60.65 60.12 1r0x s ILE 392 Cb -0.07 -0.45 -0.02 0.00 0.13 0.00 0.00 42.46 42.04 1r0x s ILE 392 CO 0.48 0.05 -0.23 -0.63 -1.91 0.00 0.00 174.94 172.71 1r0x s ILE 393 N 1.31 1.81 -0.05 2.00 1.01 0.15 -0.72 121.20 126.71 1r0x s ILE 393 Ca -0.09 -1.14 -0.00 0.00 0.00 0.00 0.00 60.65 59.41 1r0x s ILE 393 Cb -0.10 -1.54 0.03 0.00 0.01 0.00 0.00 42.46 40.86 1r0x s ILE 393 CO -0.10 0.36 -0.00 -0.04 0.00 0.00 0.00 174.94 175.16 1r0x s MET 394 N -0.92 0.51 -0.22 2.79 -1.94 0.18 -1.11 119.30 118.59 1r0x s MET 394 Ca 0.09 0.08 0.02 0.00 -1.71 0.00 0.00 55.69 54.17 1r0x s MET 394 Cb -0.09 -0.78 0.04 0.00 2.01 0.00 0.00 34.83 36.01 1r0x s MET 394 CO 0.01 -0.22 -0.12 -1.21 -0.01 0.00 0.00 175.02 173.47 1r0x s GLU 395 N 1.54 2.28 -1.52 2.03 2.02 -0.20 -1.25 118.70 123.60 1r0x s GLU 395 Ca -0.02 -1.01 -0.11 0.00 0.02 0.00 0.00 54.97 53.85 1r0x s GLU 395 Cb -0.13 -2.61 0.08 0.00 0.10 0.00 0.00 34.13 31.57 1r0x s GLU 395 CO -0.03 -0.44 0.82 -1.71 0.02 0.00 0.00 175.26 173.92 1r0x n ASN 396 N 4.59 -3.28 -4.70 -0.19 4.05 -1.01 -2.10 115.26 112.62 1r0x n ASN 396 Ca -0.16 -0.87 -0.42 0.00 0.45 0.00 0.00 54.58 53.58 1r0x n ASN 396 Cb 0.46 -3.54 -0.03 0.00 1.23 0.00 0.00 39.78 37.90 1r0x n ASN 396 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 177.26 173.52 1r0x s VAL 397 N -3.45 4.61 -0.04 3.44 1.01 -0.41 -3.51 120.40 122.05 1r0x s VAL 397 Ca 0.49 1.88 0.03 0.00 0.00 0.00 0.00 61.98 64.38 1r0x s VAL 397 Cb -0.25 -4.21 0.00 0.00 0.00 0.00 0.00 36.38 31.92 1r0x s VAL 397 CO 0.86 0.08 -0.14 -0.89 0.00 0.00 0.00 175.10 175.00 1r0x s THR 398 N 1.54 1.21 -0.04 3.92 2.01 -0.57 -0.82 115.64 122.90 1r0x s THR 398 Ca 0.53 -0.58 0.03 0.00 0.31 0.00 0.00 61.69 61.97 1r0x s THR 398 Cb -0.22 -1.06 0.00 0.00 0.01 0.00 0.00 72.50 71.23 1r0x s THR 398 CO 0.24 0.36 -0.12 0.00 -0.69 0.00 0.00 174.62 174.41 1r0x s ALA 399 N 0.21 1.10 0.16 7.40 0.00 0.64 -0.67 121.76 130.59 1r0x s ALA 399 Ca -0.06 -0.43 0.04 0.00 0.00 0.00 0.00 51.96 51.51 1r0x s ALA 399 Cb -0.12 -0.41 -0.04 0.00 0.00 0.00 0.00 23.12 22.55 1r0x s ALA 399 CO 0.02 0.17 0.18 -0.06 0.00 0.00 0.00 175.76 176.07 1r0x s PHE 400 N 0.25 3.26 0.20 0.00 0.08 -1.26 -0.88 117.98 119.62 1r0x s PHE 400 Ca -0.05 0.03 -0.32 0.00 0.12 0.00 0.00 56.93 56.71 1r0x s PHE 400 Cb -0.11 -1.57 -0.12 0.00 -0.57 0.00 0.00 43.02 40.66 1r0x s PHE 400 CO 0.01 0.52 1.71 -1.58 -0.10 0.00 0.00 175.22 175.78 1r0x s TRP 401 N -1.73 2.90 0.06 0.36 0.52 0.25 -4.68 118.94 116.62 1r0x s TRP 401 Ca 0.32 0.37 0.02 0.00 0.02 0.00 0.00 56.10 56.83 1r0x s TRP 401 Cb -0.10 -4.11 -0.03 0.00 -1.15 0.00 0.00 33.47 28.07 1r0x s TRP 401 CO 0.25 -4.22 -0.07 -1.21 0.02 0.00 0.00 176.95 171.72 1r0x s GLU 402 N 1.23 0.65 0.30 4.98 0.41 -1.26 -4.61 118.70 120.40 1r0x s GLU 402 Ca 0.74 -1.00 -0.30 0.00 -0.41 0.00 0.00 54.97 54.00 1r0x s GLU 402 Cb -0.49 -0.23 -0.11 0.00 -1.78 0.00 0.00 34.13 31.52 1r0x s GLU 402 CO 0.32 0.01 1.57 -1.21 -0.49 0.00 0.00 175.26 175.46 1r0x s GLU 403 N -2.57 4.13 0.00 1.61 2.02 -1.26 -1.95 118.70 120.68 1r0x s GLU 403 Ca -0.01 2.55 0.00 0.00 0.02 0.00 0.00 54.97 57.53 1r0x s GLU 403 Cb -0.03 -3.02 0.00 0.00 0.10 0.00 0.00 34.13 31.17 1r0x s GLU 403 CO -0.02 -0.60 0.00 0.41 0.02 0.00 0.00 175.26 175.07 1r0x n GLY 404 N 1.95 3.01 0.20 -1.39 0.00 -1.26 -4.90 105.19 102.80 1r0x n GLY 404 Ca 0.07 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.00 1r0x n GLY 404 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1r0x h PHE 405 N 0.00 0.65 -0.96 1.61 3.04 -1.77 -0.01 116.94 119.50 1r0x h PHE 405 Ca 0.00 -0.06 0.05 0.00 3.98 0.00 0.00 57.97 61.94 1r0x h PHE 405 Cb 0.00 -0.19 -0.06 0.00 2.56 0.00 0.00 35.95 38.26 1r0x h PHE 405 CO 0.00 0.60 0.63 0.78 -2.02 0.00 0.00 178.31 178.30 1r0x h GLY 406 N 0.52 1.42 0.92 2.40 0.00 -1.91 -0.79 103.07 105.62 1r0x h GLY 406 Ca 0.13 -0.46 -0.00 0.00 0.00 0.00 0.00 47.33 47.00 1r0x h GLY 406 CO -0.01 0.37 0.02 0.83 0.00 0.00 0.00 176.54 177.75 1r0x h GLU 407 N 1.16 0.04 -0.46 4.80 4.39 -1.81 -0.84 114.58 121.87 1r0x h GLU 407 Ca 0.40 -0.00 0.09 0.00 0.34 0.00 0.00 59.36 60.19 1r0x h GLU 407 Cb 0.10 -0.01 -0.10 0.00 -0.10 0.00 0.00 28.75 28.64 1r0x h GLU 407 CO -0.14 0.11 -0.22 1.25 -1.16 0.00 0.00 179.01 178.86 1r0x h LEU 408 N -0.04 -0.74 -1.43 1.33 7.12 -0.54 -1.46 115.31 119.54 1r0x h LEU 408 Ca 0.01 0.17 -0.04 0.00 0.13 0.00 0.00 57.88 58.15 1r0x h LEU 408 Cb 0.09 0.40 -0.01 0.00 -0.53 0.00 0.00 40.66 40.61 1r0x h LEU 408 CO -0.00 -0.24 -0.08 -0.07 -0.13 0.00 0.00 178.44 177.92 1r0x h LEU 409 N -0.12 0.26 -0.19 2.25 3.38 -0.95 -2.51 115.31 117.42 1r0x h LEU 409 Ca 0.22 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.14 1r0x h LEU 409 Cb 0.46 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.14 1r0x h LEU 409 CO -0.53 0.37 0.00 1.21 0.09 0.00 0.00 178.44 179.58 1r0x n GLU 410 N -4.31 0.05 0.00 1.13 2.13 -0.34 -5.10 120.64 114.20 1r0x n GLU 410 Ca -0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 1r0x n GLU 410 Cb 0.24 -1.01 0.00 0.00 0.27 0.00 0.00 31.44 30.94 1r0x n GLU 410 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 1r0x n LYS 411 N -0.31 -0.03 0.00 5.31 5.02 -0.95 -5.08 118.16 122.12 1r0x n LYS 411 Ca 0.00 -0.09 0.00 0.00 -2.02 0.00 0.00 58.31 56.20 1r0x n LYS 411 Cb 0.00 -0.54 0.00 0.00 -0.02 0.00 0.00 35.03 34.47 1r0x n LYS 411 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 1r0x n PHE 430 N -0.02 0.00 -0.21 2.13 3.72 -1.26 -4.82 117.46 117.00 1r0x n PHE 430 Ca 0.00 0.00 0.01 0.00 -0.05 0.00 0.00 57.45 57.41 1r0x n PHE 430 Cb 0.18 0.00 0.12 0.00 -0.94 0.00 0.00 39.48 38.84 1r0x n PHE 430 CO 0.00 0.00 0.00 0.77 -0.05 0.00 0.00 176.76 177.48 1r0x h SER 431 N 0.89 0.21 0.12 4.37 0.02 -1.98 0.42 113.55 117.59 1r0x h SER 431 Ca 0.00 0.09 0.01 0.00 -0.84 0.00 0.00 61.79 61.04 1r0x h SER 431 Cb 0.00 0.07 -0.02 0.00 0.14 0.00 0.00 62.40 62.59 1r0x h SER 431 CO 0.00 0.12 -0.15 0.45 -1.14 0.00 0.00 176.83 176.11 1r0x h HIS 432 N 0.40 -0.39 -0.97 3.45 3.86 -2.04 0.41 115.15 119.87 1r0x h HIS 432 Ca 0.32 0.00 0.13 0.00 -1.16 0.00 0.00 60.37 59.67 1r0x h HIS 432 Cb 0.42 0.16 -0.09 0.00 1.06 0.00 0.00 27.41 28.95 1r0x h HIS 432 CO -0.18 -0.23 0.60 -0.07 0.86 0.00 0.00 177.93 178.91 1r0x h LEU 433 N -0.31 0.84 -0.69 2.43 3.38 -1.79 0.80 115.31 119.97 1r0x h LEU 433 Ca 0.01 0.06 -0.14 0.00 0.09 0.00 0.00 57.88 57.90 1r0x h LEU 433 Cb 0.31 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 1r0x h LEU 433 CO -0.06 0.42 -0.62 0.00 0.09 0.00 0.00 178.44 178.27 1r0x h LEU 435 N 0.11 0.56 0.00 0.00 5.85 0.16 -3.19 115.31 118.80 1r0x h LEU 435 Ca -0.01 -0.65 0.00 0.00 0.84 0.00 0.00 57.88 58.06 1r0x h LEU 435 Cb 1.11 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 41.97 1r0x h LEU 435 CO 0.09 1.12 0.00 0.52 -0.34 0.00 0.00 178.44 179.83 1r0x n VAL 436 N -4.28 0.00 -3.25 1.05 0.31 0.10 -4.92 118.33 107.35 1r0x n VAL 436 Ca -0.08 0.00 -0.16 0.00 -0.01 0.00 0.00 64.34 64.09 1r0x n VAL 436 Cb 0.58 -0.52 0.07 0.00 -0.91 0.00 0.00 33.84 33.06 1r0x n VAL 436 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1r0x n GLY 437 N 0.81 -0.19 3.82 2.92 0.00 -1.08 -4.99 105.19 106.48 1r0x n GLY 437 Ca 0.21 0.01 -0.38 0.00 0.00 0.00 0.00 46.02 45.86 1r0x n GLY 437 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1r0x s ASN 438 N -3.58 6.95 0.26 1.61 0.01 -1.03 -4.89 114.94 114.27 1r0x s ASN 438 Ca 0.27 1.13 -0.29 0.00 -0.71 0.00 0.00 52.86 53.25 1r0x s ASN 438 Cb -0.12 -2.31 -0.09 0.00 0.41 0.00 0.00 41.25 39.14 1r0x s ASN 438 CO 0.56 0.29 1.22 -2.16 -1.51 0.00 0.00 177.10 175.50 1r0x s PRO 439 N -1.03 4.48 0.07 -0.60 0.04 -1.26 -0.58 135.00 136.12 1r0x s PRO 439 Ca 0.27 1.98 -0.06 0.00 0.04 0.00 0.00 61.00 63.23 1r0x s PRO 439 Cb -0.18 -3.17 -0.28 0.00 0.04 0.00 0.00 34.50 30.91 1r0x s PRO 439 CO 0.16 -0.05 1.13 -0.24 0.04 0.00 0.00 177.00 178.04 1r0x h VAL 440 N 3.35 1.46 -3.51 -0.36 3.04 -1.29 -3.45 116.25 115.49 1r0x h VAL 440 Ca -0.46 -2.95 -0.22 0.00 -1.01 0.00 0.00 66.70 62.05 1r0x h VAL 440 Cb 1.22 2.92 -0.28 0.00 -2.01 0.00 0.00 31.29 33.13 1r0x h VAL 440 CO 0.70 0.87 -0.63 -0.76 -1.01 0.00 0.00 177.57 176.74 1r0x s LEU 441 N -7.28 1.57 -0.08 3.16 1.43 -1.04 -4.24 118.68 112.20 1r0x s LEU 441 Ca -0.05 0.16 -0.01 0.00 -1.03 0.00 0.00 54.13 53.21 1r0x s LEU 441 Cb 0.07 0.25 0.03 0.00 0.03 0.00 0.00 46.19 46.57 1r0x s LEU 441 CO 0.89 -0.05 -0.04 -0.75 0.23 0.00 0.00 176.35 176.64 1r0x s LYS 442 N 0.22 0.99 -1.11 1.70 2.20 0.09 -0.26 119.74 123.56 1r0x s LYS 442 Ca -0.01 -0.06 -0.08 0.00 -0.36 0.00 0.00 55.97 55.45 1r0x s LYS 442 Cb -0.02 -1.18 -0.04 0.00 -1.51 0.00 0.00 37.83 35.08 1r0x s LYS 442 CO -0.01 -0.25 0.87 0.09 -0.36 0.00 0.00 175.35 175.70 1r0x n ASN 443 N 4.87 -5.25 -4.68 1.43 3.02 -0.00 -4.39 115.26 110.25 1r0x n ASN 443 Ca -0.12 -0.79 -0.39 0.00 -0.03 0.00 0.00 54.58 53.26 1r0x n ASN 443 Cb 0.50 -4.64 -0.07 0.00 -0.61 0.00 0.00 39.78 34.97 1r0x n ASN 443 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1r0x s ILE 444 N -3.44 5.15 -0.05 2.41 -1.09 -0.21 -4.65 121.20 119.32 1r0x s ILE 444 Ca 0.37 0.93 0.04 0.00 -2.23 0.00 0.00 60.65 59.76 1r0x s ILE 444 Cb -0.07 -3.82 -0.00 0.00 -1.58 0.00 0.00 42.46 36.98 1r0x s ILE 444 CO 0.78 0.24 -0.18 0.20 -1.23 0.00 0.00 174.94 174.75 1r0x s ASN 445 N 0.95 2.24 -0.03 3.58 0.01 -1.26 -1.29 114.94 119.14 1r0x s ASN 445 Ca 0.24 -0.37 -0.30 0.00 -0.71 0.00 0.00 52.86 51.72 1r0x s ASN 445 Cb -0.15 -0.65 0.07 0.00 0.41 0.00 0.00 41.25 40.93 1r0x s ASN 445 CO 0.10 0.16 0.69 -1.48 -1.51 0.00 0.00 177.10 175.06 1r0x s LEU 446 N 0.06 -0.62 -0.29 0.60 0.05 -0.38 -4.96 118.68 113.14 1r0x s LEU 446 Ca -0.05 0.59 0.00 0.00 0.05 0.00 0.00 54.13 54.72 1r0x s LEU 446 Cb -0.12 2.49 0.14 0.00 -2.05 0.00 0.00 46.19 46.65 1r0x s LEU 446 CO 0.03 -0.64 0.32 0.21 -0.55 0.00 0.00 176.35 175.72 1r0x s ASN 447 N -1.42 1.34 -0.15 1.48 3.04 -1.26 -0.65 114.94 117.32 1r0x s ASN 447 Ca -0.08 -0.66 -0.03 0.00 0.04 0.00 0.00 52.86 52.13 1r0x s ASN 447 Cb -0.00 0.66 -0.02 0.00 -1.54 0.00 0.00 41.25 40.35 1r0x s ASN 447 CO 0.06 -0.38 -0.06 -0.63 -3.04 0.00 0.00 177.10 173.04 1r0x s ILE 448 N 2.41 3.61 0.39 -5.21 -1.09 0.10 -4.98 121.20 116.43 1r0x s ILE 448 Ca 0.09 -0.45 -0.08 0.00 -2.23 0.00 0.00 60.65 57.98 1r0x s ILE 448 Cb -0.13 -2.57 -0.06 0.00 -1.58 0.00 0.00 42.46 38.12 1r0x s ILE 448 CO -0.32 0.50 0.73 -1.61 -1.23 0.00 0.00 174.94 173.00 1r0x s GLU 449 N 0.44 3.70 -0.14 2.79 0.41 -1.26 -0.92 118.70 123.71 1r0x s GLU 449 Ca -0.05 0.31 -0.40 0.00 -0.41 0.00 0.00 54.97 54.41 1r0x s GLU 449 Cb -0.15 -2.44 -0.18 0.00 -1.78 0.00 0.00 34.13 29.58 1r0x s GLU 449 CO 0.03 -0.01 1.46 1.63 -0.49 0.00 0.00 175.26 177.88 1r0x n LYS 450 N -1.41 0.74 -0.80 1.61 5.02 -1.26 -0.95 118.16 121.11 1r0x n LYS 450 Ca 0.01 0.27 0.00 0.00 -2.02 0.00 0.00 58.31 56.57 1r0x n LYS 450 Cb 0.54 -1.88 0.00 0.00 -0.02 0.00 0.00 35.03 33.68 1r0x n LYS 450 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1r0x n GLY 451 N 3.11 1.09 3.86 0.72 0.00 -1.26 -4.88 105.19 107.84 1r0x n GLY 451 Ca 0.23 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.94 1r0x n GLY 451 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1r0x s GLU 452 N -0.12 3.73 -0.23 1.61 2.02 -0.12 -4.55 118.70 121.03 1r0x s GLU 452 Ca 0.00 0.74 -0.08 0.00 0.02 0.00 0.00 54.97 55.65 1r0x s GLU 452 Cb 0.00 -2.16 -0.04 0.00 0.10 0.00 0.00 34.13 32.04 1r0x s GLU 452 CO 0.00 -0.38 0.09 1.41 0.02 0.00 0.00 175.26 176.40 1r0x s MET 453 N -4.64 3.82 -0.23 1.61 -2.45 -1.26 -1.43 119.30 114.70 1r0x s MET 453 Ca 0.55 -0.40 -0.13 0.00 -1.25 0.00 0.00 55.69 54.46 1r0x s MET 453 Cb -0.10 -3.36 -0.05 0.00 1.25 0.00 0.00 34.83 32.57 1r0x s MET 453 CO 0.43 -0.04 0.26 -1.17 1.05 0.00 0.00 175.02 175.55 1r0x s LEU 454 N 1.25 4.11 -0.29 4.11 0.20 0.75 -1.22 118.68 127.59 1r0x s LEU 454 Ca 0.05 0.25 -0.17 0.00 0.69 0.00 0.00 54.13 54.95 1r0x s LEU 454 Cb -0.14 -2.27 -0.02 0.00 -0.43 0.00 0.00 46.19 43.32 1r0x s LEU 454 CO 0.04 -0.01 0.48 0.00 -0.29 0.00 0.00 176.35 176.57 1r0x s ALA 455 N 1.30 3.55 -0.23 5.97 0.00 0.41 -0.90 121.76 131.86 1r0x s ALA 455 Ca 0.12 -0.78 -0.09 0.00 0.00 0.00 0.00 51.96 51.21 1r0x s ALA 455 Cb -0.14 -2.88 -0.04 0.00 0.00 0.00 0.00 23.12 20.05 1r0x s ALA 455 CO 0.07 -0.86 0.13 0.42 0.00 0.00 0.00 175.76 175.52 1r0x s ILE 456 N 2.27 5.07 0.10 0.00 1.01 0.61 -0.91 121.20 129.36 1r0x s ILE 456 Ca 0.19 0.08 0.02 0.00 0.00 0.00 0.00 60.65 60.94 1r0x s ILE 456 Cb -0.16 -3.36 -0.01 0.00 0.01 0.00 0.00 42.46 38.95 1r0x s ILE 456 CO 0.11 0.36 0.07 1.07 0.00 0.00 0.00 174.94 176.55 1r0x n THR 457 N 4.31 0.00 -2.91 2.92 5.66 -0.33 -0.67 114.28 123.26 1r0x n THR 457 Ca -0.15 -0.70 0.00 0.00 -3.05 0.00 0.00 64.05 60.15 1r0x n THR 457 Cb 0.52 0.33 0.00 0.00 -1.55 0.00 0.00 70.33 69.63 1r0x n THR 457 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1r0x n GLY 458 N 0.19 -0.41 3.92 1.09 0.00 -1.26 -0.55 105.19 108.17 1r0x n GLY 458 Ca 0.01 -1.37 -0.27 0.00 0.00 0.00 0.00 46.02 44.40 1r0x n GLY 458 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1r0x s SER 459 N -4.00 5.17 0.36 1.61 1.04 -1.02 -4.65 113.70 112.22 1r0x s SER 459 Ca 0.00 0.63 -0.28 0.00 0.48 0.00 0.00 55.95 56.78 1r0x s SER 459 Cb 0.00 -1.42 -0.10 0.00 0.10 0.00 0.00 66.02 64.60 1r0x s SER 459 CO 0.00 -1.37 1.31 0.28 0.98 0.00 0.00 173.24 174.44 1r0x s THR 460 N -3.16 2.68 -1.96 2.02 -1.32 -1.26 -2.35 115.64 110.28 1r0x s THR 460 Ca 0.57 0.65 0.00 0.00 -1.21 0.00 0.00 61.69 61.70 1r0x s THR 460 Cb -0.11 -3.40 0.00 0.00 -1.51 0.00 0.00 72.50 67.48 1r0x s THR 460 CO 0.46 0.13 0.00 0.61 -2.21 0.00 0.00 174.62 173.61 1r0x n GLY 461 N 0.73 0.44 0.00 6.08 0.00 -1.26 -4.89 105.19 106.30 1r0x n GLY 461 Ca 0.01 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.16 1r0x n GLY 461 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1r0x n SER 462 N -1.78 0.00 0.00 1.61 3.41 -0.99 -4.72 113.62 111.15 1r0x n SER 462 Ca -0.23 -0.03 0.00 0.00 -0.26 0.00 0.00 58.87 58.35 1r0x n SER 462 Cb 0.69 -0.31 0.00 0.00 -0.26 0.00 0.00 64.21 64.33 1r0x n SER 462 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1r0x n GLY 463 N 0.97 1.19 0.45 5.00 0.00 -1.26 -1.13 105.19 110.42 1r0x n GLY 463 Ca 0.12 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.96 1r0x n GLY 463 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1r0x h LYS 464 N 2.18 -1.07 -1.00 1.61 1.57 -1.92 -0.80 116.57 117.16 1r0x h LYS 464 Ca 0.00 0.07 0.18 0.00 -1.87 0.00 0.00 60.65 59.03 1r0x h LYS 464 Cb 0.00 0.24 -0.10 0.00 0.08 0.00 0.00 32.23 32.45 1r0x h LYS 464 CO 0.00 -0.71 0.61 1.15 -0.57 0.00 0.00 179.45 179.92 1r0x h THR 465 N -1.11 0.75 -0.13 -0.16 2.02 -2.00 -1.70 112.91 110.58 1r0x h THR 465 Ca -0.11 -0.27 -0.05 0.00 0.77 0.00 0.00 66.41 66.75 1r0x h THR 465 Cb 0.87 -0.13 -0.01 0.00 -1.74 0.00 0.00 68.15 67.14 1r0x h THR 465 CO 0.15 0.15 -0.13 0.28 0.37 0.00 0.00 175.52 176.33 1r0x h SER 466 N 0.80 0.18 -0.45 4.18 0.02 -1.92 -0.61 113.55 115.75 1r0x h SER 466 Ca 0.56 -0.04 -0.03 0.00 -0.84 0.00 0.00 61.79 61.45 1r0x h SER 466 Cb 0.81 -0.05 -0.02 0.00 0.14 0.00 0.00 62.40 63.28 1r0x h SER 466 CO -0.36 0.34 0.18 0.25 -1.14 0.00 0.00 176.83 176.10 1r0x h LEU 467 N 0.19 0.63 -1.07 5.07 5.85 -0.19 -1.94 115.31 123.84 1r0x h LEU 467 Ca 0.04 -0.17 -0.00 0.00 0.84 0.00 0.00 57.88 58.58 1r0x h LEU 467 Cb 0.35 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 41.18 1r0x h LEU 467 CO 0.02 0.63 0.52 -0.07 -0.34 0.00 0.00 178.44 179.20 1r0x h LEU 468 N 0.59 1.02 -1.31 2.25 4.07 -1.26 -2.13 115.31 118.54 1r0x h LEU 468 Ca 0.15 -0.06 -0.02 0.00 0.08 0.00 0.00 57.88 58.04 1r0x h LEU 468 Cb 0.20 -0.26 -0.03 0.00 1.08 0.00 0.00 40.66 41.66 1r0x h LEU 468 CO -0.01 0.78 0.26 0.24 -1.08 0.00 0.00 178.44 178.63 1r0x h MET 469 N 1.18 0.73 -0.35 1.13 2.86 -0.74 -0.13 114.93 119.61 1r0x h MET 469 Ca 0.31 -0.08 -0.08 0.00 -2.06 0.00 0.00 59.70 57.78 1r0x h MET 469 Cb -0.06 -0.14 -0.01 0.00 0.06 0.00 0.00 31.60 31.45 1r0x h MET 469 CO -0.06 0.56 -0.10 1.25 1.06 0.00 0.00 176.91 179.62 1r0x h LEU 470 N 0.73 0.69 -0.90 1.22 5.85 -0.91 0.22 115.31 122.21 1r0x h LEU 470 Ca 0.18 -0.37 0.06 0.00 0.84 0.00 0.00 57.88 58.59 1r0x h LEU 470 Cb 0.07 -0.19 -0.06 0.00 0.37 0.00 0.00 40.66 40.85 1r0x h LEU 470 CO -0.03 0.90 0.57 0.40 -0.34 0.00 0.00 178.44 179.95 1r0x h ILE 471 N 0.47 1.07 0.00 4.05 2.04 -0.91 -1.61 117.51 122.62 1r0x h ILE 471 Ca 0.09 -0.36 0.00 0.00 1.00 0.00 0.00 64.86 65.59 1r0x h ILE 471 Cb 0.61 -0.07 0.00 0.00 -0.74 0.00 0.00 36.82 36.62 1r0x h ILE 471 CO 0.04 0.19 0.00 0.18 0.00 0.00 0.00 178.15 178.56 1r0x n LEU 472 N -4.57 0.00 0.00 1.44 4.77 -0.10 -4.88 117.00 113.65 1r0x n LEU 472 Ca 0.13 0.44 0.00 0.00 -0.03 0.00 0.00 56.01 56.55 1r0x n LEU 472 Cb 0.16 -0.44 0.00 0.00 -2.33 0.00 0.00 43.42 40.81 1r0x n LEU 472 CO 0.32 -0.15 0.00 0.61 -1.33 0.00 0.00 177.39 176.84 1r0x n GLY 473 N 0.47 0.55 0.09 -0.72 0.00 -0.55 -4.90 105.19 100.13 1r0x n GLY 473 Ca 0.06 -0.24 0.11 0.00 0.00 0.00 0.00 46.02 45.96 1r0x n GLY 473 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1r0x n GLU 474 N -2.85 0.61 -4.71 1.61 -0.58 0.66 -4.73 120.64 110.65 1r0x n GLU 474 Ca 0.00 0.05 -0.33 0.00 -0.42 0.00 0.00 57.16 56.46 1r0x n GLU 474 Cb 0.00 -1.75 -0.13 0.00 -0.57 0.00 0.00 31.44 28.99 1r0x n GLU 474 CO 0.00 0.00 0.00 -1.17 -0.48 0.00 0.00 177.13 175.48 1r0x s LEU 475 N -5.13 2.91 -0.21 -4.62 2.96 -0.98 -4.94 118.68 108.67 1r0x s LEU 475 Ca -0.02 -0.19 -0.23 0.00 -0.22 0.00 0.00 54.13 53.47 1r0x s LEU 475 Cb 0.11 -1.64 -0.01 0.00 0.50 0.00 0.00 46.19 45.14 1r0x s LEU 475 CO 0.82 0.26 0.74 -1.83 -1.32 0.00 0.00 176.35 175.02 1r0x s GLU 476 N -0.20 4.21 0.07 1.98 1.03 -1.26 -4.37 118.70 120.15 1r0x s GLU 476 Ca 0.01 0.81 -0.30 0.00 0.03 0.00 0.00 54.97 55.52 1r0x s GLU 476 Cb -0.13 -3.61 -0.05 0.00 -0.80 0.00 0.00 34.13 29.54 1r0x s GLU 476 CO 0.03 -0.38 1.11 0.00 -1.33 0.00 0.00 175.26 174.69 1r0x s ALA 477 N 2.37 3.32 -0.20 -0.84 0.00 -1.26 -4.28 121.76 120.86 1r0x s ALA 477 Ca 0.33 0.74 0.11 0.00 0.00 0.00 0.00 51.96 53.14 1r0x s ALA 477 Cb -0.16 -3.39 -0.20 0.00 0.00 0.00 0.00 23.12 19.37 1r0x s ALA 477 CO 0.10 -0.32 -0.04 0.43 0.00 0.00 0.00 175.76 175.93 1r0x n SER 478 N 3.58 1.04 -4.35 0.00 7.64 0.15 -4.93 113.62 116.74 1r0x n SER 478 Ca 0.07 -0.05 -0.23 0.00 1.01 0.00 0.00 58.87 59.67 1r0x n SER 478 Cb 0.48 0.47 -0.11 0.00 -1.01 0.00 0.00 64.21 64.03 1r0x n SER 478 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 1r0x s GLU 479 N -2.46 1.32 0.30 1.43 2.02 -0.79 -5.00 118.70 115.52 1r0x s GLU 479 Ca -0.18 -1.41 0.00 0.00 0.02 0.00 0.00 54.97 53.41 1r0x s GLU 479 Cb 0.07 -1.47 0.00 0.00 0.10 0.00 0.00 34.13 32.83 1r0x s GLU 479 CO 0.69 0.31 0.00 0.41 0.02 0.00 0.00 175.26 176.69 1r0x n GLY 480 N 0.38 -2.13 2.91 -1.39 0.00 -1.23 -1.51 105.19 102.23 1r0x n GLY 480 Ca -0.14 -1.85 -0.22 0.00 0.00 0.00 0.00 46.02 43.81 1r0x n GLY 480 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1r0x s ILE 481 N -0.17 0.71 -0.17 -0.61 1.09 -0.89 -4.95 121.20 116.21 1r0x s ILE 481 Ca 0.00 -0.20 -0.03 0.00 -1.10 0.00 0.00 60.65 59.32 1r0x s ILE 481 Cb 0.00 -0.72 -0.02 0.00 -1.06 0.00 0.00 42.46 40.66 1r0x s ILE 481 CO 0.00 0.27 -0.05 -0.63 -0.10 0.00 0.00 174.94 174.43 1r0x s ILE 482 N 1.05 3.64 -0.11 2.92 1.01 -1.26 -1.04 121.20 127.41 1r0x s ILE 482 Ca -0.09 -0.44 0.01 0.00 0.00 0.00 0.00 60.65 60.14 1r0x s ILE 482 Cb -0.14 -2.60 0.02 0.00 0.01 0.00 0.00 42.46 39.74 1r0x s ILE 482 CO -0.00 0.47 -0.13 -0.54 0.00 0.00 0.00 174.94 174.74 1r0x s LYS 483 N 0.68 2.01 -0.03 2.79 1.02 -0.27 -5.00 119.74 120.94 1r0x s LYS 483 Ca -0.03 -0.47 -0.30 0.00 0.02 0.00 0.00 55.97 55.19 1r0x s LYS 483 Cb -0.15 -1.80 0.11 0.00 -0.52 0.00 0.00 37.83 35.47 1r0x s LYS 483 CO 0.02 -0.13 1.02 -3.38 -0.92 0.00 0.00 175.35 171.96 1r0x s HIS 484 N 1.19 -0.23 0.21 3.18 -3.43 -1.26 -0.67 115.29 114.28 1r0x s HIS 484 Ca -0.03 0.10 -0.07 0.00 -0.80 0.00 0.00 55.06 54.26 1r0x s HIS 484 Cb -0.14 0.55 -0.02 0.00 -1.43 0.00 0.00 32.58 31.54 1r0x s HIS 484 CO -0.04 -0.48 0.28 -1.54 -2.00 0.00 0.00 174.74 170.97 1r0x s SER 485 N -2.52 0.05 0.00 7.38 1.04 -1.26 -5.10 113.70 113.29 1r0x s SER 485 Ca 0.08 -1.14 0.00 0.00 0.48 0.00 0.00 55.95 55.37 1r0x s SER 485 Cb -0.01 0.47 0.00 0.00 0.10 0.00 0.00 66.02 66.58 1r0x s SER 485 CO -0.06 -0.96 0.00 0.61 0.98 0.00 0.00 173.24 173.81 1r0x n GLY 486 N -0.30 -1.75 3.83 7.32 0.00 -1.26 -4.63 105.19 108.40 1r0x n GLY 486 Ca -0.01 -1.53 -0.35 0.00 0.00 0.00 0.00 46.02 44.13 1r0x n GLY 486 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1r0x s ARG 487 N 0.00 4.12 -0.01 1.61 0.52 -1.26 -4.91 118.95 119.02 1r0x s ARG 487 Ca 0.00 0.70 0.05 0.00 -0.52 0.00 0.00 55.73 55.96 1r0x s ARG 487 Cb 0.00 -2.85 -0.03 0.00 0.52 0.00 0.00 34.95 32.59 1r0x s ARG 487 CO 0.00 0.40 -0.17 0.54 0.02 0.00 0.00 175.30 176.09 1r0x s VAL 488 N -1.55 2.84 -0.13 3.52 0.11 -1.26 -1.37 120.40 122.55 1r0x s VAL 488 Ca 0.42 -0.94 0.01 0.00 -2.93 0.00 0.00 61.98 58.54 1r0x s VAL 488 Cb -0.15 -2.13 -0.01 0.00 -1.53 0.00 0.00 36.38 32.56 1r0x s VAL 488 CO 0.20 0.49 -0.16 -0.55 -3.33 0.00 0.00 175.10 171.76 1r0x s SER 489 N -0.99 3.74 -0.14 3.54 0.15 -0.08 -4.96 113.70 114.96 1r0x s SER 489 Ca 0.13 -0.41 0.01 0.00 0.70 0.00 0.00 55.95 56.37 1r0x s SER 489 Cb -0.10 -1.56 -0.00 0.00 -1.71 0.00 0.00 66.02 62.64 1r0x s SER 489 CO 0.02 0.14 -0.16 0.12 1.20 0.00 0.00 173.24 174.56 1r0x s PHE 490 N 0.51 2.76 -0.42 3.44 5.36 -1.26 -0.22 117.98 128.15 1r0x s PHE 490 Ca -0.10 -0.98 -0.07 0.00 -0.96 0.00 0.00 56.93 54.81 1r0x s PHE 490 Cb -0.16 -1.86 0.09 0.00 -0.34 0.00 0.00 43.02 40.75 1r0x s PHE 490 CO 0.04 -0.43 0.24 0.00 -1.46 0.00 0.00 175.22 173.62 1r0x s SER 492 N 2.10 5.24 0.32 0.00 1.04 -1.26 -1.36 113.70 119.78 1r0x s SER 492 Ca 0.04 2.00 0.07 0.00 0.48 0.00 0.00 55.95 58.54 1r0x s SER 492 Cb -0.23 -2.55 0.78 0.00 0.10 0.00 0.00 66.02 64.11 1r0x s SER 492 CO -0.00 -1.54 1.81 -0.61 0.98 0.00 0.00 173.24 173.87 1r0x h GLN 493 N 0.18 0.72 -5.63 4.02 4.15 -1.86 -3.38 115.11 113.31 1r0x h GLN 493 Ca -0.47 -0.04 -0.59 0.00 0.77 0.00 0.00 58.65 58.31 1r0x h GLN 493 Cb 1.24 -0.16 -0.10 0.00 0.21 0.00 0.00 27.48 28.68 1r0x h GLN 493 CO 0.55 0.47 0.03 0.12 -1.93 0.00 0.00 178.83 178.07 1r0x s PHE 494 N -5.79 3.39 -0.68 3.99 5.36 -1.26 -4.95 117.98 118.04 1r0x s PHE 494 Ca -0.11 0.87 -0.26 0.00 -0.96 0.00 0.00 56.93 56.47 1r0x s PHE 494 Cb 0.24 -2.72 0.04 0.00 -0.34 0.00 0.00 43.02 40.23 1r0x s PHE 494 CO 0.80 -0.11 1.19 -1.12 -1.46 0.00 0.00 175.22 174.53 1r0x s SER 495 N 1.12 6.23 0.18 6.13 0.01 -1.26 -5.03 113.70 121.08 1r0x s SER 495 Ca 0.27 -0.41 -0.11 0.00 1.31 0.00 0.00 55.95 57.01 1r0x s SER 495 Cb -0.16 -2.53 -0.07 0.00 0.21 0.00 0.00 66.02 63.48 1r0x s SER 495 CO 0.10 -1.67 0.52 -1.66 0.41 0.00 0.00 173.24 170.95 1r0x s TRP 496 N 5.22 3.50 -0.09 2.43 1.48 -1.26 -4.96 118.94 125.26 1r0x s TRP 496 Ca 0.34 0.91 -0.01 0.00 -1.06 0.00 0.00 56.10 56.28 1r0x s TRP 496 Cb -0.09 -2.27 0.03 0.00 -1.16 0.00 0.00 33.47 29.97 1r0x s TRP 496 CO 0.17 0.36 -0.04 0.42 -4.06 0.00 0.00 176.95 173.79 1r0x s ILE 497 N -1.65 0.76 0.35 0.66 -1.09 -1.26 -4.80 121.20 114.17 1r0x s ILE 497 Ca 0.42 -0.12 -0.04 0.00 -2.23 0.00 0.00 60.65 58.68 1r0x s ILE 497 Cb -0.13 -0.83 -0.04 0.00 -1.58 0.00 0.00 42.46 39.88 1r0x s ILE 497 CO 0.20 0.32 0.61 -0.04 -1.23 0.00 0.00 174.94 174.81 1r0x s MET 498 N 1.79 3.58 0.21 2.79 -1.94 -1.26 -2.03 119.30 122.44 1r0x s MET 498 Ca 0.04 -0.02 -0.32 0.00 -1.71 0.00 0.00 55.69 53.68 1r0x s MET 498 Cb -0.12 -2.58 -0.13 0.00 2.01 0.00 0.00 34.83 34.01 1r0x s MET 498 CO -0.07 0.10 1.61 -2.30 -0.01 0.00 0.00 175.02 174.35 1r0x n PRO 499 N -1.46 2.46 0.00 2.03 -0.02 -1.26 -4.65 135.00 132.10 1r0x n PRO 499 Ca -0.02 0.88 0.00 0.00 -2.02 0.00 0.00 63.50 62.35 1r0x n PRO 499 Cb 0.55 -2.67 0.00 0.00 -0.02 0.00 0.00 33.50 31.36 1r0x n PRO 499 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1r0x n GLY 500 N 3.23 0.92 3.88 -1.23 0.00 -1.10 -4.98 105.19 105.91 1r0x n GLY 500 Ca 0.14 -1.89 -0.30 0.00 0.00 0.00 0.00 46.02 43.98 1r0x n GLY 500 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1r0x s THR 501 N -1.12 1.96 0.09 2.61 -4.23 -1.26 -0.71 115.64 112.98 1r0x s THR 501 Ca 0.00 0.00 -0.18 0.00 -1.18 0.00 0.00 61.69 60.33 1r0x s THR 501 Cb 0.00 -2.93 -0.08 0.00 1.34 0.00 0.00 72.50 70.83 1r0x s THR 501 CO 0.00 0.00 1.51 0.40 -0.54 0.00 0.00 174.62 175.99 1r0x h ILE 502 N -1.63 1.26 -0.41 2.99 2.04 -1.12 -1.90 117.51 118.74 1r0x h ILE 502 Ca -0.45 -0.96 0.04 0.00 1.00 0.00 0.00 64.86 64.48 1r0x h ILE 502 Cb 1.26 1.36 -0.04 0.00 -0.74 0.00 0.00 36.82 38.66 1r0x h ILE 502 CO 0.44 0.31 0.19 0.50 0.00 0.00 0.00 178.15 179.58 1r0x h LYS 503 N 0.26 0.37 -0.35 2.37 3.64 -1.23 -1.82 116.57 119.81 1r0x h LYS 503 Ca 0.07 -0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.43 1r0x h LYS 503 Cb 0.45 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 32.17 1r0x h LYS 503 CO 0.02 0.24 0.21 0.93 -2.27 0.00 0.00 179.45 178.58 1r0x h GLU 504 N 0.38 0.47 -0.30 1.90 5.08 -1.79 -1.75 114.58 118.57 1r0x h GLU 504 Ca 0.18 -0.04 -0.10 0.00 -1.00 0.00 0.00 59.36 58.40 1r0x h GLU 504 Cb 0.12 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.25 1r0x h GLU 504 CO -0.15 0.34 -0.25 -0.91 -1.00 0.00 0.00 179.01 177.04 1r0x h ASN 505 N 0.48 0.59 -0.03 1.42 2.35 -0.53 -2.16 115.58 117.69 1r0x h ASN 505 Ca 0.13 -0.21 -0.19 0.00 -0.55 0.00 0.00 56.30 55.49 1r0x h ASN 505 Cb -0.01 -0.16 0.01 0.00 0.05 0.00 0.00 38.32 38.22 1r0x h ASN 505 CO -0.02 0.82 -0.70 0.40 -1.65 0.00 0.00 177.43 176.28 1r0x h ILE 506 N 0.51 1.37 -0.37 2.81 2.04 -0.78 -3.22 117.51 119.86 1r0x h ILE 506 Ca 0.07 -2.06 0.00 0.00 1.00 0.00 0.00 64.86 63.87 1r0x h ILE 506 Cb 0.70 2.42 0.00 0.00 -0.74 0.00 0.00 36.82 39.21 1r0x h ILE 506 CO 0.05 0.62 0.00 2.30 0.00 0.00 0.00 178.15 181.12 1r0x n ILE 507 N -4.11 0.78 -1.50 -0.67 -5.35 -0.72 -4.25 119.36 103.53 1r0x n ILE 507 Ca -0.10 -0.58 -0.35 0.00 -0.27 0.00 0.00 62.75 61.45 1r0x n ILE 507 Cb 0.72 0.08 -0.17 0.00 -1.74 0.00 0.00 39.64 38.53 1r0x n ILE 507 CO 0.00 0.00 0.00 0.33 -1.76 0.00 0.00 176.55 175.12 1r0x n PHE 508 N 0.56 0.39 -1.75 4.28 7.35 -0.82 -1.47 117.46 126.00 1r0x n PHE 508 Ca 0.13 0.26 0.00 0.00 -0.76 0.00 0.00 57.45 57.08 1r0x n PHE 508 Cb 0.44 -1.79 0.00 0.00 0.35 0.00 0.00 39.48 38.49 1r0x n PHE 508 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1r0x n GLY 509 N 6.18 0.47 3.04 7.13 0.00 -1.26 -5.05 105.19 115.71 1r0x n GLY 509 Ca 0.66 -0.86 -0.11 0.00 0.00 0.00 0.00 46.02 45.72 1r0x n GLY 509 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1r0x s VAL 510 N -2.00 0.38 0.33 1.61 1.01 -0.54 -5.12 120.40 116.08 1r0x s VAL 510 Ca 0.00 -1.13 -0.29 0.00 0.00 0.00 0.00 61.98 60.55 1r0x s VAL 510 Cb 0.00 -0.63 -0.11 0.00 0.00 0.00 0.00 36.38 35.64 1r0x s VAL 510 CO 0.00 -0.50 1.55 -0.94 0.00 0.00 0.00 175.10 175.21 1r0x s SER 511 N -1.74 6.34 0.36 3.32 1.04 -1.26 -4.94 113.70 116.82 1r0x s SER 511 Ca -0.09 3.02 -0.26 0.00 0.48 0.00 0.00 55.95 59.09 1r0x s SER 511 Cb -0.08 -2.65 -0.09 0.00 0.10 0.00 0.00 66.02 63.30 1r0x s SER 511 CO -0.01 -0.91 1.14 -0.47 0.98 0.00 0.00 173.24 173.97 1r0x s TYR 512 N -0.52 3.23 -0.26 5.02 5.04 -1.26 -5.01 117.35 123.58 1r0x s TYR 512 Ca 0.59 1.60 -0.01 0.00 -2.44 0.00 0.00 57.07 56.80 1r0x s TYR 512 Cb -0.48 -3.34 0.14 0.00 0.35 0.00 0.00 41.96 38.63 1r0x s TYR 512 CO 0.55 -1.04 0.37 0.34 -1.34 0.00 0.00 175.55 174.44 1r0x s ASP 513 N -1.10 0.49 0.22 4.32 -1.08 -1.26 -5.06 116.67 113.20 1r0x s ASP 513 Ca 0.53 -0.08 -0.08 0.00 -0.52 0.00 0.00 52.55 52.40 1r0x s ASP 513 Cb -0.30 1.02 0.34 0.00 -1.46 0.00 0.00 42.92 42.51 1r0x s ASP 513 CO 0.38 -0.33 1.74 -0.08 0.52 0.00 0.00 175.17 177.40 1r0x h GLU 514 N 8.19 0.41 -0.12 4.34 4.57 -1.99 -0.26 114.58 129.73 1r0x h GLU 514 Ca -0.15 -0.02 -0.06 0.00 -1.18 0.00 0.00 59.36 57.94 1r0x h GLU 514 Cb 1.14 -0.09 -0.00 0.00 -0.16 0.00 0.00 28.75 29.63 1r0x h GLU 514 CO 0.28 0.27 -0.15 -0.92 -1.18 0.00 0.00 179.01 177.30 1r0x h TYR 515 N 0.42 0.38 -0.40 0.92 3.20 -2.00 -2.23 116.97 117.26 1r0x h TYR 515 Ca 0.34 -0.12 0.01 0.00 3.14 0.00 0.00 58.73 62.10 1r0x h TYR 515 Cb 0.46 -0.08 -0.02 0.00 1.54 0.00 0.00 36.73 38.64 1r0x h TYR 515 CO -0.17 0.75 0.26 -0.09 -1.64 0.00 0.00 178.16 177.27 1r0x h ARG 516 N -0.10 0.52 -0.01 1.82 2.43 -1.91 -2.34 114.38 114.78 1r0x h ARG 516 Ca 0.01 -0.03 0.02 0.00 -0.81 0.00 0.00 59.98 59.17 1r0x h ARG 516 Cb 0.70 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 30.11 1r0x h ARG 516 CO 0.04 0.35 -0.10 -0.92 -1.51 0.00 0.00 179.97 177.82 1r0x h TYR 517 N 0.54 -0.25 -0.87 2.20 3.20 -1.03 -1.02 116.97 119.74 1r0x h TYR 517 Ca 0.15 0.01 -0.03 0.00 3.14 0.00 0.00 58.73 62.00 1r0x h TYR 517 Cb -0.06 0.11 -0.04 0.00 1.54 0.00 0.00 36.73 38.29 1r0x h TYR 517 CO -0.05 -0.15 0.43 0.87 -1.64 0.00 0.00 178.16 177.62 1r0x h LYS 518 N -0.17 1.24 -0.38 1.82 1.57 -1.35 -1.26 116.57 118.04 1r0x h LYS 518 Ca 0.04 -0.17 -0.12 0.00 -1.87 0.00 0.00 60.65 58.52 1r0x h LYS 518 Cb 0.22 -0.23 -0.01 0.00 0.08 0.00 0.00 32.23 32.29 1r0x h LYS 518 CO -0.11 0.94 -0.26 0.66 -0.57 0.00 0.00 179.45 180.11 1r0x h SER 519 N 1.23 0.81 -0.19 0.86 4.64 -1.10 -1.35 113.55 118.46 1r0x h SER 519 Ca 0.30 -0.31 -0.04 0.00 -0.47 0.00 0.00 61.79 61.27 1r0x h SER 519 Cb 0.10 -0.22 -0.01 0.00 -0.31 0.00 0.00 62.40 61.96 1r0x h SER 519 CO -0.04 1.03 -0.03 0.58 -0.87 0.00 0.00 176.83 177.51 1r0x h VAL 520 N 0.68 1.27 -0.80 0.95 2.07 -0.90 -0.01 116.25 119.51 1r0x h VAL 520 Ca 0.09 -0.96 -0.03 0.00 0.82 0.00 0.00 66.70 66.61 1r0x h VAL 520 Cb 0.79 1.53 -0.04 0.00 -1.52 0.00 0.00 31.29 32.05 1r0x h VAL 520 CO 0.07 0.29 0.38 0.58 0.02 0.00 0.00 177.57 178.91 1r0x h VAL 521 N 0.08 1.25 -0.21 2.57 2.07 -1.16 0.73 116.25 121.58 1r0x h VAL 521 Ca 0.05 -0.71 -0.06 0.00 0.82 0.00 0.00 66.70 66.80 1r0x h VAL 521 Cb 0.45 0.24 -0.01 0.00 -1.52 0.00 0.00 31.29 30.45 1r0x h VAL 521 CO 0.02 0.30 -0.11 0.50 0.02 0.00 0.00 177.57 178.30 1r0x h LYS 522 N 1.14 0.44 -0.11 1.57 3.64 -1.21 -0.71 116.57 121.33 1r0x h LYS 522 Ca 0.28 -0.20 -0.13 0.00 -1.27 0.00 0.00 60.65 59.32 1r0x h LYS 522 Cb 0.12 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 31.92 1r0x h LYS 522 CO -0.03 0.74 -0.52 0.00 -2.27 0.00 0.00 179.45 177.36 1r0x h ALA 523 N 0.70 0.92 0.00 5.00 0.00 -0.48 -2.04 119.26 123.35 1r0x h ALA 523 Ca 0.04 -0.49 0.00 0.00 0.00 0.00 0.00 54.91 54.47 1r0x h ALA 523 Cb 0.61 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1r0x h ALA 523 CO 0.03 0.67 0.00 0.00 0.00 0.00 0.00 179.25 179.95 1r0x n GLN 525 N -0.65 -3.65 0.07 0.00 1.13 -0.77 -4.91 117.38 108.61 1r0x n GLN 525 Ca 0.07 0.79 0.12 0.00 -1.94 0.00 0.00 57.00 56.03 1r0x n GLN 525 Cb 0.03 -5.34 0.08 0.00 0.11 0.00 0.00 30.24 25.12 1r0x n GLN 525 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 1r0x n LEU 526 N -3.28 0.73 -0.24 1.08 4.77 -0.28 -4.10 117.00 115.68 1r0x n LEU 526 Ca -0.12 0.21 -0.03 0.00 -0.03 0.00 0.00 56.01 56.05 1r0x n LEU 526 Cb 0.61 -0.12 0.16 0.00 -2.33 0.00 0.00 43.42 41.74 1r0x n LEU 526 CO 0.37 -0.08 1.13 -0.61 -1.33 0.00 0.00 177.39 176.87 1r0x h GLN 527 N 0.00 1.06 0.00 3.23 5.75 -1.88 0.24 115.11 123.51 1r0x h GLN 527 Ca 0.00 -0.14 -0.03 0.00 -0.15 0.00 0.00 58.65 58.33 1r0x h GLN 527 Cb 0.83 -0.20 -0.00 0.00 1.07 0.00 0.00 27.48 29.18 1r0x h GLN 527 CO 0.00 0.81 -0.16 1.96 -2.65 0.00 0.00 178.83 178.79 1r0x h GLN 528 N 1.06 0.00 0.04 1.69 7.50 -1.93 -0.92 115.11 122.55 1r0x h GLN 528 Ca 0.26 0.00 -0.00 0.00 0.50 0.00 0.00 58.65 59.41 1r0x h GLN 528 Cb 0.08 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.61 1r0x h GLN 528 CO -0.04 0.16 -0.02 -0.44 -1.50 0.00 0.00 178.83 177.00 1r0x h ASP 529 N 0.00 -0.04 0.30 1.46 3.32 -1.07 -3.37 116.42 117.01 1r0x h ASP 529 Ca -0.00 -0.64 -0.08 0.00 0.02 0.00 0.00 57.03 56.32 1r0x h ASP 529 Cb 0.29 0.01 -0.01 0.00 0.22 0.00 0.00 39.33 39.84 1r0x h ASP 529 CO 0.02 0.72 -0.36 0.16 -1.72 0.00 0.00 179.24 178.06 1r0x h ILE 530 N -0.91 1.28 0.00 0.35 3.07 -0.54 -1.64 117.51 119.11 1r0x h ILE 530 Ca -0.00 -1.32 0.00 0.00 1.55 0.00 0.00 64.86 65.09 1r0x h ILE 530 Cb 0.68 1.65 0.00 0.00 -0.27 0.00 0.00 36.82 38.88 1r0x h ILE 530 CO 0.01 0.39 0.15 0.00 -1.05 0.00 0.00 178.15 177.64 1r0x h THR 531 N 0.09 0.00 -0.00 0.16 1.03 -1.33 -1.52 112.91 111.33 1r0x h THR 531 Ca 0.01 0.00 0.00 0.00 -0.01 0.00 0.00 66.41 66.41 1r0x h THR 531 Cb 0.69 0.64 0.00 0.00 -1.07 0.00 0.00 68.15 68.40 1r0x h THR 531 CO 0.05 0.00 -0.23 0.29 -0.01 0.00 0.00 175.52 175.62 1r0x n LYS 532 N -2.61 0.57 -3.98 0.00 5.02 -0.62 -4.86 118.16 111.69 1r0x n LYS 532 Ca -0.02 -0.27 -0.36 0.00 -2.02 0.00 0.00 58.31 55.64 1r0x n LYS 532 Cb 0.19 -1.49 -0.08 0.00 -0.02 0.00 0.00 35.03 33.63 1r0x n LYS 532 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 1r0x s PHE 533 N -2.62 3.40 0.24 2.13 2.99 -0.57 -5.03 117.98 118.52 1r0x s PHE 533 Ca 0.23 0.32 -0.09 0.00 0.00 0.00 0.00 56.93 57.39 1r0x s PHE 533 Cb 0.19 -1.98 0.38 0.00 0.00 0.00 0.00 43.02 41.61 1r0x s PHE 533 CO 0.54 0.47 1.64 0.00 -0.00 0.00 0.00 175.22 177.87 1r0x h ALA 534 N 5.70 0.69 -0.58 5.36 0.00 -1.89 -1.88 119.26 126.67 1r0x h ALA 534 Ca -0.48 0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1r0x h ALA 534 Cb 1.19 0.43 0.00 0.00 0.00 0.00 0.00 17.79 19.41 1r0x h ALA 534 CO 0.63 -0.42 0.00 0.39 0.00 0.00 0.00 179.25 179.86 1r0x n GLU 535 N -5.36 2.39 0.00 0.00 -0.58 -1.26 -5.05 120.64 110.78 1r0x n GLU 535 Ca 0.12 -2.15 0.00 0.00 -0.42 0.00 0.00 57.16 54.71 1r0x n GLU 535 Cb 0.43 -1.47 0.00 0.00 -0.57 0.00 0.00 31.44 29.83 1r0x n GLU 535 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 1r0x n GLN 536 N 1.26 0.00 0.00 3.49 6.02 -0.71 -0.64 117.38 126.80 1r0x n GLN 536 Ca 0.20 0.00 0.08 0.00 -0.01 0.00 0.00 57.00 57.27 1r0x n GLN 536 Cb 0.51 0.00 0.48 0.00 1.02 0.00 0.00 30.24 32.25 1r0x n GLN 536 CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 177.06 175.65 1r0x n ASP 537 N 1.84 0.00 -0.70 1.08 5.75 -1.26 -1.43 116.55 121.83 1r0x n ASP 537 Ca 0.00 -0.33 0.09 0.00 -0.01 0.00 0.00 54.79 54.54 1r0x n ASP 537 Cb 0.00 -0.10 0.27 0.00 -1.03 0.00 0.00 41.12 40.26 1r0x n ASP 537 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 1r0x n ASN 538 N -1.10 2.05 -4.75 -1.12 5.03 0.19 -0.73 115.26 114.84 1r0x n ASN 538 Ca 0.11 -1.87 -0.42 0.00 0.87 0.00 0.00 54.58 53.28 1r0x n ASN 538 Cb 0.08 -0.20 -0.02 0.00 -1.02 0.00 0.00 39.78 38.63 1r0x n ASN 538 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.26 174.54 1r0x s THR 539 N -1.61 2.07 -0.10 3.41 2.01 -0.52 -4.78 115.64 116.12 1r0x s THR 539 Ca 0.30 0.06 -0.24 0.00 0.31 0.00 0.00 61.69 62.12 1r0x s THR 539 Cb 0.16 -3.04 -0.03 0.00 0.01 0.00 0.00 72.50 69.61 1r0x s THR 539 CO 0.23 0.01 0.76 -0.69 -0.69 0.00 0.00 174.62 174.23 1r0x s VAL 540 N 0.17 4.98 -0.10 3.82 1.01 -1.26 -1.70 120.40 127.33 1r0x s VAL 540 Ca 0.65 1.53 -0.02 0.00 0.00 0.00 0.00 61.98 64.13 1r0x s VAL 540 Cb -0.48 -4.08 -0.03 0.00 0.00 0.00 0.00 36.38 31.78 1r0x s VAL 540 CO 0.46 0.17 0.00 -0.76 0.00 0.00 0.00 175.10 174.96 1r0x s LEU 541 N 1.29 3.55 0.67 3.92 1.43 0.11 -4.96 118.68 124.69 1r0x s LEU 541 Ca 0.38 0.11 -0.11 0.00 -1.03 0.00 0.00 54.13 53.48 1r0x s LEU 541 Cb -0.18 -1.82 -0.01 0.00 0.03 0.00 0.00 46.19 44.22 1r0x s LEU 541 CO 0.17 0.34 1.05 -0.83 0.23 0.00 0.00 176.35 177.31 1r0x s GLY 542 N -0.66 1.72 0.11 -3.19 0.00 -1.26 -2.70 107.32 101.34 1r0x s GLY 542 Ca 0.11 0.09 -0.34 0.00 0.00 0.00 0.00 44.72 44.57 1r0x s GLY 542 CO 0.02 0.39 0.91 -2.21 0.00 0.00 0.00 173.10 172.21 1r0x n GLU 543 N -2.91 0.30 0.00 2.90 4.07 -1.26 0.97 120.64 124.71 1r0x n GLU 543 Ca 0.07 0.11 0.00 0.00 -0.06 0.00 0.00 57.16 57.28 1r0x n GLU 543 Cb 0.54 -1.44 0.00 0.00 -0.06 0.00 0.00 31.44 30.48 1r0x n GLU 543 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1r0x n GLY 544 N 1.80 2.82 3.87 8.31 0.00 -0.86 -4.34 105.19 116.79 1r0x n GLY 544 Ca 0.18 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.87 1r0x n GLY 544 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1r0x n GLY 545 N -2.00 -0.87 0.13 -0.02 0.00 0.27 -4.78 105.19 97.93 1r0x n GLY 545 Ca 0.00 0.37 0.01 0.00 0.00 0.00 0.00 46.02 46.40 1r0x n GLY 545 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1r0x h VAL 546 N -1.12 1.05 -0.01 1.61 3.04 -1.78 -2.83 116.25 116.21 1r0x h VAL 546 Ca -0.59 -2.44 0.00 0.00 -1.01 0.00 0.00 66.70 62.67 1r0x h VAL 546 Cb 1.19 2.49 0.00 0.00 -2.01 0.00 0.00 31.29 32.96 1r0x h VAL 546 CO 0.39 0.59 -0.05 0.35 -1.01 0.00 0.00 177.57 177.84 1r0x n THR 547 N -3.27 0.00 -1.87 3.17 -2.24 -1.26 -4.88 114.28 103.93 1r0x n THR 547 Ca 0.01 -0.14 -0.30 0.00 -2.27 0.00 0.00 64.05 61.36 1r0x n THR 547 Cb 0.77 0.14 0.07 0.00 -2.10 0.00 0.00 70.33 69.21 1r0x n THR 547 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1r0x s LEU 548 N -2.15 2.68 0.71 3.22 1.02 -1.07 -5.08 118.68 118.02 1r0x s LEU 548 Ca 0.37 0.98 -0.11 0.00 0.02 0.00 0.00 54.13 55.39 1r0x s LEU 548 Cb 0.21 -3.61 0.02 0.00 0.02 0.00 0.00 46.19 42.82 1r0x s LEU 548 CO 0.39 -1.65 1.09 -0.94 0.02 0.00 0.00 176.35 175.26 1r0x s SER 549 N -4.43 5.37 0.28 2.29 1.04 -1.26 -4.91 113.70 112.07 1r0x s SER 549 Ca 0.60 1.06 -0.03 0.00 0.48 0.00 0.00 55.95 58.06 1r0x s SER 549 Cb -0.11 -1.85 0.38 0.00 0.10 0.00 0.00 66.02 64.54 1r0x s SER 549 CO 0.51 -1.37 1.94 1.23 0.98 0.00 0.00 173.24 176.52 1r0x h GLY 550 N -0.66 1.32 1.02 7.32 0.00 -1.97 -1.29 103.07 108.81 1r0x h GLY 550 Ca -0.45 -0.47 -0.10 0.00 0.00 0.00 0.00 47.33 46.30 1r0x h GLY 550 CO 0.64 0.44 -0.14 -1.33 0.00 0.00 0.00 176.54 176.15 1r0x h GLY 551 N 1.22 0.91 0.97 4.60 0.00 -1.97 0.84 103.07 109.63 1r0x h GLY 551 Ca 0.35 -0.77 0.01 0.00 0.00 0.00 0.00 47.33 46.92 1r0x h GLY 551 CO -0.09 0.71 0.18 1.46 0.00 0.00 0.00 176.54 178.79 1r0x h GLN 552 N 0.66 0.35 -0.77 4.80 4.20 -1.86 0.17 115.11 122.66 1r0x h GLN 552 Ca 0.10 -0.02 -0.03 0.00 0.06 0.00 0.00 58.65 58.76 1r0x h GLN 552 Cb 0.68 -0.08 -0.04 0.00 0.30 0.00 0.00 27.48 28.35 1r0x h GLN 552 CO 0.05 0.23 0.37 0.00 -0.67 0.00 0.00 178.83 178.82 1r0x h ARG 553 N 0.37 1.11 -0.56 1.46 3.08 -1.14 -1.43 114.38 117.26 1r0x h ARG 553 Ca 0.11 -0.16 -0.07 0.00 0.07 0.00 0.00 59.98 59.92 1r0x h ARG 553 Cb -0.02 -0.20 -0.02 0.00 0.08 0.00 0.00 29.97 29.80 1r0x h ARG 553 CO -0.04 0.86 0.05 0.00 -1.07 0.00 0.00 179.97 179.77 1r0x h ALA 554 N 1.19 1.03 -0.25 0.04 0.00 -0.30 -0.98 119.26 119.99 1r0x h ALA 554 Ca 0.27 -0.27 -0.19 0.00 0.00 0.00 0.00 54.91 54.73 1r0x h ALA 554 Cb 0.11 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.69 1r0x h ALA 554 CO -0.03 0.61 -0.58 0.00 0.00 0.00 0.00 179.25 179.25 1r0x h ARG 555 N 0.86 0.79 -0.52 0.00 3.08 -0.26 -0.39 114.38 117.95 1r0x h ARG 555 Ca 0.17 -0.52 -0.01 0.00 0.07 0.00 0.00 59.98 59.69 1r0x h ARG 555 Cb 0.44 0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.54 1r0x h ARG 555 CO 0.02 1.15 0.29 0.82 -1.07 0.00 0.00 179.97 181.17 1r0x h ILE 556 N 0.60 1.17 -0.18 2.04 2.04 -1.19 0.48 117.51 122.48 1r0x h ILE 556 Ca 0.00 -0.43 -0.11 0.00 1.00 0.00 0.00 64.86 65.33 1r0x h ILE 556 Cb 1.18 0.52 -0.01 0.00 -0.74 0.00 0.00 36.82 37.76 1r0x h ILE 556 CO 0.12 0.18 -0.36 -1.28 0.00 0.00 0.00 178.15 176.81 1r0x h SER 557 N 0.69 0.39 -0.32 1.72 0.87 -1.06 -1.32 113.55 114.52 1r0x h SER 557 Ca 0.18 -0.15 -0.05 0.00 -1.23 0.00 0.00 61.79 60.54 1r0x h SER 557 Cb 0.04 -0.11 -0.01 0.00 -0.44 0.00 0.00 62.40 61.88 1r0x h SER 557 CO -0.03 0.72 0.01 0.25 -0.53 0.00 0.00 176.83 177.25 1r0x h LEU 558 N 0.32 0.54 -0.96 2.23 6.46 -0.92 -2.82 115.31 120.15 1r0x h LEU 558 Ca 0.04 -0.30 0.01 0.00 -0.12 0.00 0.00 57.88 57.50 1r0x h LEU 558 Cb 0.79 -0.14 -0.05 0.00 -0.73 0.00 0.00 40.66 40.52 1r0x h LEU 558 CO 0.06 0.71 0.62 0.00 -0.62 0.00 0.00 178.44 179.21 1r0x h ALA 559 N 0.85 1.22 -0.28 1.25 0.00 -0.37 -0.76 119.26 121.19 1r0x h ALA 559 Ca 0.09 -0.08 0.04 0.00 0.00 0.00 0.00 54.91 54.96 1r0x h ALA 559 Cb 0.42 -0.39 -0.04 0.00 0.00 0.00 0.00 17.79 17.78 1r0x h ALA 559 CO 0.01 0.64 0.03 -0.09 0.00 0.00 0.00 179.25 179.84 1r0x h ARG 560 N 1.31 0.12 -0.43 0.00 2.43 -1.25 0.19 114.38 116.75 1r0x h ARG 560 Ca 0.35 -0.01 -0.07 0.00 -0.81 0.00 0.00 59.98 59.44 1r0x h ARG 560 Cb -0.12 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.38 1r0x h ARG 560 CO -0.07 0.08 -0.03 0.00 -1.51 0.00 0.00 179.97 178.43 1r0x h ALA 561 N 1.22 1.14 0.13 2.80 0.00 -1.11 -2.97 119.26 120.46 1r0x h ALA 561 Ca 0.13 -0.26 -0.28 0.00 0.00 0.00 0.00 54.91 54.50 1r0x h ALA 561 Cb 0.15 -0.18 0.01 0.00 0.00 0.00 0.00 17.79 17.77 1r0x h ALA 561 CO -0.19 0.55 -1.24 0.28 0.00 0.00 0.00 179.25 178.65 1r0x h VAL 562 N 0.66 1.46 -0.66 0.00 2.07 -0.89 -3.23 116.25 115.66 1r0x h VAL 562 Ca 0.13 -2.94 0.01 0.00 0.82 0.00 0.00 66.70 64.72 1r0x h VAL 562 Cb 0.46 2.90 -0.03 0.00 -1.52 0.00 0.00 31.29 33.09 1r0x h VAL 562 CO 0.02 0.86 0.43 0.22 0.02 0.00 0.00 177.57 179.13 1r0x h TYR 563 N 0.10 0.82 -2.16 1.57 3.20 -0.58 -3.42 116.97 116.50 1r0x h TYR 563 Ca -0.14 0.02 -0.60 0.00 3.14 0.00 0.00 58.73 61.15 1r0x h TYR 563 Cb 1.95 -0.28 0.05 0.00 1.54 0.00 0.00 36.73 39.99 1r0x h TYR 563 CO 0.07 0.51 0.82 1.17 -1.64 0.00 0.00 178.16 179.09 1r0x n LYS 564 N -4.64 2.04 -2.33 1.82 4.81 -1.13 -4.89 118.16 113.84 1r0x n LYS 564 Ca 0.05 0.74 -0.42 0.00 -0.87 0.00 0.00 58.31 57.81 1r0x n LYS 564 Cb 0.02 -2.50 -0.02 0.00 0.02 0.00 0.00 35.03 32.55 1r0x n LYS 564 CO 0.00 0.00 0.00 0.34 1.17 0.00 0.00 177.40 178.91 1r0x s ASP 565 N 1.44 6.16 0.22 3.14 3.68 -1.26 -4.99 116.67 125.06 1r0x s ASP 565 Ca 0.82 0.58 0.02 0.00 2.13 0.00 0.00 52.55 56.10 1r0x s ASP 565 Cb -0.72 -2.54 -0.05 0.00 -1.45 0.00 0.00 42.92 38.16 1r0x s ASP 565 CO 0.42 -1.63 0.03 0.00 0.13 0.00 0.00 175.17 174.12 1r0x s ALA 566 N 6.01 1.65 -0.03 3.66 0.00 -1.26 -4.95 121.76 126.84 1r0x s ALA 566 Ca 0.59 -1.76 0.14 0.00 0.00 0.00 0.00 51.96 50.93 1r0x s ALA 566 Cb -0.13 0.70 0.13 0.00 0.00 0.00 0.00 23.12 23.82 1r0x s ALA 566 CO 0.29 -0.35 1.47 -0.44 0.00 0.00 0.00 175.76 176.73 1r0x h ASP 567 N 2.50 0.00 -3.04 0.00 3.32 -1.38 -3.45 116.42 114.37 1r0x h ASP 567 Ca -0.38 0.00 -0.18 0.00 0.02 0.00 0.00 57.03 56.49 1r0x h ASP 567 Cb 1.23 0.00 -0.30 0.00 0.22 0.00 0.00 39.33 40.48 1r0x h ASP 567 CO 0.63 0.59 -0.46 -0.22 -1.72 0.00 0.00 179.24 178.06 1r0x s LEU 568 N -6.65 -0.08 -0.20 1.55 2.96 -0.75 -3.05 118.68 112.46 1r0x s LEU 568 Ca 0.02 0.66 -0.06 0.00 -0.22 0.00 0.00 54.13 54.54 1r0x s LEU 568 Cb 0.09 0.89 -0.03 0.00 0.50 0.00 0.00 46.19 47.64 1r0x s LEU 568 CO 0.75 -0.21 0.02 -0.31 -1.32 0.00 0.00 176.35 175.28 1r0x s TYR 569 N 1.90 3.08 -0.26 5.38 1.51 -0.87 -0.90 117.35 127.20 1r0x s TYR 569 Ca -0.04 -0.34 -0.03 0.00 -1.01 0.00 0.00 57.07 55.64 1r0x s TYR 569 Cb -0.11 -2.09 0.02 0.00 -0.11 0.00 0.00 41.96 39.67 1r0x s TYR 569 CO -0.10 -0.17 -0.03 -0.51 -1.11 0.00 0.00 175.55 173.64 1r0x s LEU 570 N 0.91 3.30 -0.38 -1.29 1.43 0.69 -0.71 118.68 122.63 1r0x s LEU 570 Ca 0.02 -0.77 0.03 0.00 -1.03 0.00 0.00 54.13 52.38 1r0x s LEU 570 Cb -0.14 -1.73 0.11 0.00 0.03 0.00 0.00 46.19 44.46 1r0x s LEU 570 CO 0.02 -0.13 0.11 -0.76 0.23 0.00 0.00 176.35 175.82 1r0x s LEU 571 N 1.39 4.73 -0.79 1.79 1.02 0.79 0.01 118.68 127.61 1r0x s LEU 571 Ca 0.02 -2.32 -0.21 0.00 0.02 0.00 0.00 54.13 51.63 1r0x s LEU 571 Cb -0.16 -1.65 0.09 0.00 0.02 0.00 0.00 46.19 44.49 1r0x s LEU 571 CO -0.03 -0.36 1.07 -0.62 0.02 0.00 0.00 176.35 176.43 1r0x s ASP 572 N 0.74 6.37 -1.29 2.29 -1.08 -0.47 -0.72 116.67 122.52 1r0x s ASP 572 Ca 0.12 -1.43 -0.00 0.00 -0.52 0.00 0.00 52.55 50.72 1r0x s ASP 572 Cb -0.21 -2.42 -0.00 0.00 -1.46 0.00 0.00 42.92 38.83 1r0x s ASP 572 CO -0.06 -1.31 0.74 -1.20 0.52 0.00 0.00 175.17 173.86 1r0x n SER 573 N 7.38 -1.31 0.23 -0.34 7.64 -0.87 -2.79 113.62 123.57 1r0x n SER 573 Ca 0.10 -0.80 0.10 0.00 1.01 0.00 0.00 58.87 59.29 1r0x n SER 573 Cb 0.47 -4.19 0.50 0.00 -1.01 0.00 0.00 64.21 59.98 1r0x n SER 573 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 1r0x h PRO 574 N -1.87 0.00 -3.03 1.43 0.13 -1.82 -3.36 132.00 123.48 1r0x h PRO 574 Ca -0.61 0.00 -0.77 0.00 -0.87 0.00 0.00 66.00 63.75 1r0x h PRO 574 Cb 1.36 0.00 -0.30 0.00 0.13 0.00 0.00 31.00 32.18 1r0x h PRO 574 CO 0.55 0.21 0.45 1.19 -0.23 0.00 0.00 178.00 180.18 1r0x n PHE 575 N -3.42 3.36 -0.79 1.56 3.72 -1.26 -4.67 117.46 115.96 1r0x n PHE 575 Ca -0.00 -3.25 0.03 0.00 -0.05 0.00 0.00 57.45 54.18 1r0x n PHE 575 Cb 0.40 -1.27 0.04 0.00 -0.94 0.00 0.00 39.48 37.71 1r0x n PHE 575 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1r0x n GLY 576 N 1.70 2.21 3.17 1.37 0.00 -1.26 -4.79 105.19 107.58 1r0x n GLY 576 Ca 0.25 -0.36 -0.24 0.00 0.00 0.00 0.00 46.02 45.68 1r0x n GLY 576 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1r0x n TYR 577 N -0.64 -0.21 0.15 1.61 4.01 -1.26 -4.41 117.16 116.41 1r0x n TYR 577 Ca 0.05 -2.01 0.03 0.00 -0.16 0.00 0.00 57.90 55.81 1r0x n TYR 577 Cb 0.48 -0.35 0.11 0.00 -0.31 0.00 0.00 39.34 39.27 1r0x n TYR 577 CO 0.00 0.00 0.00 -0.07 -0.46 0.00 0.00 176.86 176.33 1r0x h LEU 578 N 0.00 0.00 -6.39 7.72 3.38 -1.99 -3.38 115.31 114.64 1r0x h LEU 578 Ca -0.31 0.00 -0.74 0.00 0.09 0.00 0.00 57.88 56.92 1r0x h LEU 578 Cb 1.08 0.00 -0.11 0.00 0.09 0.00 0.00 40.66 41.71 1r0x h LEU 578 CO 0.50 0.49 2.37 -0.90 0.09 0.00 0.00 178.44 180.99 1r0x n ASP 579 N -3.31 4.69 0.03 -0.43 3.85 -1.26 -4.77 116.55 115.35 1r0x n ASP 579 Ca 0.01 -3.01 -0.00 0.00 -0.71 0.00 0.00 54.79 51.08 1r0x n ASP 579 Cb 0.68 -1.55 0.30 0.00 -1.35 0.00 0.00 41.12 39.19 1r0x n ASP 579 CO 0.00 0.00 0.00 1.62 -1.01 0.00 0.00 177.20 177.81 1r0x h VAL 580 N 3.91 1.21 -0.22 2.12 3.04 -1.98 -2.66 116.25 121.68 1r0x h VAL 580 Ca 0.45 -0.89 -0.20 0.00 -1.01 0.00 0.00 66.70 65.04 1r0x h VAL 580 Cb 0.65 1.09 0.00 0.00 -2.01 0.00 0.00 31.29 31.03 1r0x h VAL 580 CO 1.69 0.29 -0.66 -0.26 -1.01 0.00 0.00 177.57 177.63 1r0x h PHE 581 N 0.42 1.07 -0.63 3.17 -1.00 -1.97 -1.10 116.94 116.91 1r0x h PHE 581 Ca 0.08 -0.43 0.08 0.00 2.81 0.00 0.00 57.97 60.52 1r0x h PHE 581 Cb 0.42 -0.18 -0.06 0.00 3.61 0.00 0.00 35.95 39.73 1r0x h PHE 581 CO 0.01 1.25 0.29 1.15 -1.61 0.00 0.00 178.31 179.41 1r0x h THR 582 N 0.60 0.86 -0.75 -1.55 2.02 -1.92 -2.53 112.91 109.64 1r0x h THR 582 Ca -0.02 -0.18 -0.00 0.00 0.77 0.00 0.00 66.41 66.98 1r0x h THR 582 Cb 1.27 0.28 -0.04 0.00 -1.74 0.00 0.00 68.15 67.93 1r0x h THR 582 CO 0.14 0.10 0.47 -0.33 0.37 0.00 0.00 175.52 176.26 1r0x h GLU 583 N 0.53 1.01 -0.49 6.66 5.08 -1.19 -0.31 114.58 125.87 1r0x h GLU 583 Ca 0.30 -0.08 0.05 0.00 -1.00 0.00 0.00 59.36 58.63 1r0x h GLU 583 Cb 0.30 -0.22 -0.04 0.00 0.50 0.00 0.00 28.75 29.29 1r0x h GLU 583 CO -0.25 0.70 0.24 0.93 -1.00 0.00 0.00 179.01 179.63 1r0x h GLU 584 N 1.03 0.45 -0.43 2.33 5.08 -0.80 -0.87 114.58 121.37 1r0x h GLU 584 Ca 0.27 -0.03 -0.09 0.00 -1.00 0.00 0.00 59.36 58.52 1r0x h GLU 584 Cb -0.06 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.07 1r0x h GLU 584 CO -0.05 0.30 -0.08 1.96 -1.00 0.00 0.00 179.01 180.14 1r0x h GLN 585 N 0.46 0.82 -0.18 2.33 4.20 -1.04 -2.58 115.11 119.13 1r0x h GLN 585 Ca 0.22 -0.30 -0.01 0.00 0.06 0.00 0.00 58.65 58.62 1r0x h GLN 585 Cb 0.15 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 27.87 1r0x h GLN 585 CO -0.17 0.92 0.07 0.28 -0.67 0.00 0.00 178.83 179.26 1r0x h VAL 586 N 0.65 1.15 -0.77 -0.54 2.07 -1.04 0.16 116.25 117.92 1r0x h VAL 586 Ca 0.11 -0.46 0.12 0.00 0.82 0.00 0.00 66.70 67.29 1r0x h VAL 586 Cb 0.60 1.14 -0.08 0.00 -1.52 0.00 0.00 31.29 31.42 1r0x h VAL 586 CO 0.04 0.15 0.37 0.15 0.02 0.00 0.00 177.57 178.30 1r0x h PHE 587 N 0.13 0.66 0.23 1.57 3.04 -1.06 0.18 116.94 121.69 1r0x h PHE 587 Ca 0.06 0.03 -0.01 0.00 3.98 0.00 0.00 57.97 62.03 1r0x h PHE 587 Cb 0.17 -0.18 0.00 0.00 2.56 0.00 0.00 35.95 38.50 1r0x h PHE 587 CO -0.01 0.18 -0.11 1.49 -2.02 0.00 0.00 178.31 177.84 1r0x h GLU 588 N 0.58 -0.30 -0.21 1.11 4.81 -1.25 0.44 114.58 119.76 1r0x h GLU 588 Ca 0.40 0.02 -0.18 0.00 -0.13 0.00 0.00 59.36 59.48 1r0x h GLU 588 Cb 0.52 0.07 0.00 0.00 0.63 0.00 0.00 28.75 29.97 1r0x h GLU 588 CO -0.33 0.07 -0.57 0.77 -0.73 0.00 0.00 179.01 178.22 1r0x h SER 589 N -0.88 0.87 0.00 1.04 0.02 -0.91 -1.37 113.55 112.31 1r0x h SER 589 Ca -0.03 -0.57 0.00 0.00 -0.84 0.00 0.00 61.79 60.34 1r0x h SER 589 Cb 0.51 -0.25 0.00 0.00 0.14 0.00 0.00 62.40 62.79 1r0x h SER 589 CO 0.05 1.29 -0.34 0.00 -1.14 0.00 0.00 176.83 176.69 1r0x h VAL 591 N -0.88 1.39 0.04 0.00 2.07 -1.23 -2.29 116.25 115.35 1r0x h VAL 591 Ca 0.00 -1.44 -0.19 0.00 0.82 0.00 0.00 66.70 65.88 1r0x h VAL 591 Cb 0.34 2.08 0.02 0.00 -1.52 0.00 0.00 31.29 32.21 1r0x h VAL 591 CO 0.00 0.41 -0.79 0.00 0.02 0.00 0.00 177.57 177.22 1r0x n LYS 593 N -4.10 0.17 -0.20 0.00 5.02 -0.53 -3.39 118.16 115.14 1r0x n LYS 593 Ca -0.11 0.19 0.16 0.00 -2.02 0.00 0.00 58.31 56.53 1r0x n LYS 593 Cb 0.77 -0.93 0.49 0.00 -0.02 0.00 0.00 35.03 35.34 1r0x n LYS 593 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 1r0x h LEU 594 N -0.33 0.43 -3.04 -0.35 5.85 -1.03 -2.33 115.31 114.50 1r0x h LEU 594 Ca 0.00 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.75 1r0x h LEU 594 Cb 0.26 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.23 1r0x h LEU 594 CO 0.00 0.21 0.00 0.23 -0.34 0.00 0.00 178.44 178.54 1r0x n MET 595 N -4.49 3.18 -0.49 1.25 2.81 -0.87 -4.68 117.12 113.84 1r0x n MET 595 Ca 0.16 -2.57 0.43 0.00 -1.81 0.00 0.00 57.70 53.91 1r0x n MET 595 Cb 0.56 -1.64 0.78 0.00 -0.71 0.00 0.00 33.22 32.22 1r0x n MET 595 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1r0x h ALA 596 N 2.90 3.45 -0.29 3.04 0.00 -1.43 0.16 119.26 127.09 1r0x h ALA 596 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1r0x h ALA 596 Cb 1.16 0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.06 1r0x h ALA 596 CO 0.13 -1.88 0.00 0.09 0.00 0.00 0.00 179.25 177.59 1r0x n ASN 597 N -4.07 3.17 -4.77 0.00 3.02 -1.26 -4.80 115.26 106.54 1r0x n ASN 597 Ca 0.34 -1.93 -0.36 0.00 -0.03 0.00 0.00 54.58 52.60 1r0x n ASN 597 Cb 1.57 -0.19 -0.07 0.00 -0.61 0.00 0.00 39.78 40.49 1r0x n ASN 597 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1r0x s LYS 598 N -1.43 3.99 0.19 3.52 -0.14 0.56 -4.14 119.74 122.29 1r0x s LYS 598 Ca 0.33 -0.15 -0.33 0.00 -1.36 0.00 0.00 55.97 54.46 1r0x s LYS 598 Cb 0.20 -3.35 -0.13 0.00 -1.68 0.00 0.00 37.83 32.86 1r0x s LYS 598 CO 0.28 0.43 1.63 2.41 -0.76 0.00 0.00 175.35 179.34 1r0x n THR 599 N 3.07 0.05 -3.79 2.17 -1.04 -1.26 -4.50 114.28 108.98 1r0x n THR 599 Ca -0.17 -0.01 -0.13 0.00 -2.04 0.00 0.00 64.05 61.71 1r0x n THR 599 Cb 0.53 -1.73 -0.13 0.00 -1.82 0.00 0.00 70.33 67.19 1r0x n THR 599 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1r0x s ARG 600 N 0.95 0.20 -0.22 -2.82 1.70 -0.52 -2.04 118.95 116.20 1r0x s ARG 600 Ca 0.77 0.31 -0.02 0.00 -0.47 0.00 0.00 55.73 56.31 1r0x s ARG 600 Cb -0.60 0.05 0.01 0.00 -0.57 0.00 0.00 34.95 33.83 1r0x s ARG 600 CO 0.36 -0.06 -0.07 0.42 -1.08 0.00 0.00 175.30 174.87 1r0x s ILE 601 N 0.37 3.02 -0.21 4.99 1.01 0.11 -0.18 121.20 130.32 1r0x s ILE 601 Ca -0.02 -0.72 -0.02 0.00 0.00 0.00 0.00 60.65 59.89 1r0x s ILE 601 Cb -0.04 -2.40 -0.00 0.00 0.01 0.00 0.00 42.46 40.03 1r0x s ILE 601 CO -0.02 0.38 -0.09 -0.22 0.00 0.00 0.00 174.94 175.00 1r0x s LEU 602 N 1.41 2.69 -0.07 2.97 2.96 -0.08 -0.15 118.68 128.41 1r0x s LEU 602 Ca 0.04 -0.46 -0.24 0.00 -0.22 0.00 0.00 54.13 53.26 1r0x s LEU 602 Cb -0.15 -1.67 -0.04 0.00 0.50 0.00 0.00 46.19 44.84 1r0x s LEU 602 CO -0.05 -0.01 0.71 -0.69 -1.32 0.00 0.00 176.35 174.99 1r0x s VAL 603 N 1.40 5.04 0.10 1.68 1.01 0.10 -0.28 120.40 129.43 1r0x s VAL 603 Ca 0.05 1.47 -0.15 0.00 0.00 0.00 0.00 61.98 63.34 1r0x s VAL 603 Cb -0.14 -4.05 0.03 0.00 0.00 0.00 0.00 36.38 32.22 1r0x s VAL 603 CO -0.06 0.24 0.37 0.28 0.00 0.00 0.00 175.10 175.93 1r0x s THR 604 N 0.87 0.08 -0.17 3.92 -1.32 0.15 -2.04 115.64 117.13 1r0x s THR 604 Ca 0.38 -0.65 0.16 0.00 -1.21 0.00 0.00 61.69 60.37 1r0x s THR 604 Cb -0.18 -1.13 0.38 0.00 -1.51 0.00 0.00 72.50 70.05 1r0x s THR 604 CO 0.18 -0.36 1.24 -1.54 -2.21 0.00 0.00 174.62 171.93 1r0x n SER 605 N -0.01 2.49 -4.46 8.08 3.41 -1.26 -4.30 113.62 117.57 1r0x n SER 605 Ca -0.17 -3.30 -0.33 0.00 -0.26 0.00 0.00 58.87 54.81 1r0x n SER 605 Cb 0.63 -0.49 -0.13 0.00 -0.26 0.00 0.00 64.21 63.96 1r0x n SER 605 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1r0x s LYS 606 N -2.98 3.57 0.29 4.33 1.02 -1.26 -4.86 119.74 119.85 1r0x s LYS 606 Ca 0.36 -0.57 0.10 0.00 0.02 0.00 0.00 55.97 55.88 1r0x s LYS 606 Cb 0.32 -2.82 0.42 0.00 -0.52 0.00 0.00 37.83 35.23 1r0x s LYS 606 CO 0.02 0.24 1.65 0.52 -0.92 0.00 0.00 175.35 176.86 1r0x h MET 607 N 6.67 0.05 -0.94 1.68 2.86 -1.96 -2.33 114.93 120.96 1r0x h MET 607 Ca -0.30 -0.03 0.13 0.00 -2.06 0.00 0.00 59.70 57.45 1r0x h MET 607 Cb 1.20 0.00 -0.08 0.00 0.06 0.00 0.00 31.60 32.78 1r0x h MET 607 CO 0.60 0.59 0.60 1.49 1.06 0.00 0.00 176.91 181.25 1r0x h GLU 608 N 0.04 0.82 -0.24 1.72 4.57 -1.98 -0.01 114.58 119.50 1r0x h GLU 608 Ca -0.00 -0.05 -0.11 0.00 -1.18 0.00 0.00 59.36 58.01 1r0x h GLU 608 Cb 0.99 -0.19 -0.01 0.00 -0.16 0.00 0.00 28.75 29.38 1r0x h GLU 608 CO 0.07 0.54 -0.34 0.45 -1.18 0.00 0.00 179.01 178.56 1r0x h HIS 609 N 0.84 0.58 -0.25 0.92 3.86 -1.84 -0.91 115.15 118.35 1r0x h HIS 609 Ca 0.47 -0.15 -0.08 0.00 -1.16 0.00 0.00 60.37 59.45 1r0x h HIS 609 Cb 0.60 -0.13 -0.01 0.00 1.06 0.00 0.00 27.41 28.93 1r0x h HIS 609 CO -0.00 0.78 -0.16 -0.07 0.86 0.00 0.00 177.93 179.33 1r0x h LEU 610 N 0.43 0.58 -1.30 2.43 4.07 -1.35 -2.25 115.31 117.92 1r0x h LEU 610 Ca 0.05 -0.43 0.11 0.00 0.08 0.00 0.00 57.88 57.69 1r0x h LEU 610 Cb 0.80 -0.16 -0.06 0.00 1.08 0.00 0.00 40.66 42.31 1r0x h LEU 610 CO 0.06 0.89 0.55 -0.09 -1.08 0.00 0.00 178.44 178.77 1r0x h ARG 611 N 0.28 0.72 -0.01 1.13 2.43 -0.72 -2.70 114.38 115.51 1r0x h ARG 611 Ca 0.05 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.18 1r0x h ARG 611 Cb 0.69 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 30.08 1r0x h ARG 611 CO 0.05 0.48 -0.47 1.63 -1.51 0.00 0.00 179.97 180.14 1r0x n LYS 612 N -4.53 0.60 -1.62 0.20 4.76 -0.37 -4.95 118.16 112.25 1r0x n LYS 612 Ca 0.15 -0.42 -0.31 0.00 -2.87 0.00 0.00 58.31 54.86 1r0x n LYS 612 Cb 0.37 -1.49 0.05 0.00 -1.84 0.00 0.00 35.03 32.12 1r0x n LYS 612 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1r0x s ALA 613 N -2.69 2.65 0.07 7.82 0.00 -0.85 -4.96 121.76 123.81 1r0x s ALA 613 Ca 0.18 0.15 0.03 0.00 0.00 0.00 0.00 51.96 52.32 1r0x s ALA 613 Cb 0.18 -3.19 -0.24 0.00 0.00 0.00 0.00 23.12 19.86 1r0x s ALA 613 CO 0.63 -1.20 1.11 -0.44 0.00 0.00 0.00 175.76 175.85 1r0x h ASP 614 N -0.56 0.18 -5.17 0.00 3.32 -1.49 -3.45 116.42 109.26 1r0x h ASP 614 Ca -0.44 -0.21 -0.11 0.00 0.02 0.00 0.00 57.03 56.29 1r0x h ASP 614 Cb 1.21 -0.06 -0.15 0.00 0.22 0.00 0.00 39.33 40.55 1r0x h ASP 614 CO 0.56 1.17 -0.53 -0.54 -1.72 0.00 0.00 179.24 178.19 1r0x s LYS 615 N -2.67 0.70 -0.03 3.56 -0.14 -0.99 -4.60 119.74 115.57 1r0x s LYS 615 Ca -0.03 -1.02 0.04 0.00 -1.36 0.00 0.00 55.97 53.61 1r0x s LYS 615 Cb 0.08 0.27 -0.01 0.00 -1.68 0.00 0.00 37.83 36.49 1r0x s LYS 615 CO 0.84 -0.18 -0.15 0.42 -0.76 0.00 0.00 175.35 175.53 1r0x s ILE 616 N -3.62 1.20 -0.13 2.17 1.01 0.23 -0.44 121.20 121.62 1r0x s ILE 616 Ca 0.04 -0.61 0.01 0.00 0.00 0.00 0.00 60.65 60.08 1r0x s ILE 616 Cb 0.05 -1.02 0.02 0.00 0.01 0.00 0.00 42.46 41.52 1r0x s ILE 616 CO -0.09 0.35 -0.15 -0.22 0.00 0.00 0.00 174.94 174.82 1r0x s LEU 617 N -0.11 1.72 -0.17 2.97 0.20 -0.09 -1.75 118.68 121.46 1r0x s LEU 617 Ca 0.01 -0.46 -0.03 0.00 0.69 0.00 0.00 54.13 54.34 1r0x s LEU 617 Cb -0.08 -1.14 -0.02 0.00 -0.43 0.00 0.00 46.19 44.51 1r0x s LEU 617 CO 0.01 -0.01 -0.05 -0.63 -0.29 0.00 0.00 176.35 175.38 1r0x s ILE 618 N 1.19 3.69 -0.06 6.68 1.01 0.74 -1.18 121.20 133.26 1r0x s ILE 618 Ca -0.02 -0.42 -0.01 0.00 0.00 0.00 0.00 60.65 60.20 1r0x s ILE 618 Cb -0.14 -2.62 -0.03 0.00 0.01 0.00 0.00 42.46 39.67 1r0x s ILE 618 CO -0.05 0.48 0.00 -0.76 0.00 0.00 0.00 174.94 174.61 1r0x s LEU 619 N 0.60 3.58 -0.05 2.97 1.02 0.29 -0.85 118.68 126.24 1r0x s LEU 619 Ca -0.03 0.11 -0.02 0.00 0.02 0.00 0.00 54.13 54.21 1r0x s LEU 619 Cb -0.15 -1.88 0.04 0.00 0.02 0.00 0.00 46.19 44.22 1r0x s LEU 619 CO 0.03 0.35 0.09 -2.28 0.02 0.00 0.00 176.35 174.56 1r0x s HIS 620 N -0.94 -0.03 -1.45 0.29 2.46 0.20 -2.42 115.29 113.40 1r0x s HIS 620 Ca 0.15 0.35 -0.09 0.00 0.47 0.00 0.00 55.06 55.94 1r0x s HIS 620 Cb -0.11 -0.33 0.05 0.00 -0.13 0.00 0.00 32.58 32.06 1r0x s HIS 620 CO 0.04 -0.19 0.94 1.04 -2.47 0.00 0.00 174.74 174.11 1r0x n GLN 621 N 4.97 -5.74 -0.96 2.88 3.00 -1.26 -1.26 117.38 119.02 1r0x n GLN 621 Ca -0.11 0.64 0.00 0.00 -0.01 0.00 0.00 57.00 57.52 1r0x n GLN 621 Cb 0.50 -5.48 0.00 0.00 0.00 0.00 0.00 30.24 25.27 1r0x n GLN 621 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1r0x n GLY 622 N -1.69 0.83 3.57 1.08 0.00 -0.28 -4.96 105.19 103.73 1r0x n GLY 622 Ca -0.06 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.73 1r0x n GLY 622 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1r0x s SER 623 N -2.75 4.14 -0.58 1.61 0.01 -0.39 -0.73 113.70 115.01 1r0x s SER 623 Ca 0.00 -0.82 -0.24 0.00 1.31 0.00 0.00 55.95 56.20 1r0x s SER 623 Cb 0.00 -0.61 0.05 0.00 0.21 0.00 0.00 66.02 65.67 1r0x s SER 623 CO 0.00 0.00 0.97 -0.55 0.41 0.00 0.00 173.24 174.07 1r0x s SER 624 N -3.61 6.30 0.22 2.44 0.15 -1.26 -0.63 113.70 117.30 1r0x s SER 624 Ca 0.31 -0.48 0.05 0.00 0.70 0.00 0.00 55.95 56.53 1r0x s SER 624 Cb -0.05 -2.44 0.19 0.00 -1.71 0.00 0.00 66.02 62.01 1r0x s SER 624 CO 0.18 -1.31 1.52 0.22 1.20 0.00 0.00 173.24 175.05 1r0x h TYR 625 N 9.41 0.24 -1.97 3.44 5.03 -1.32 -3.46 116.97 128.34 1r0x h TYR 625 Ca -0.27 -0.10 -0.00 0.00 2.58 0.00 0.00 58.73 60.94 1r0x h TYR 625 Cb 1.07 -0.04 -0.21 0.00 1.55 0.00 0.00 36.73 39.10 1r0x h TYR 625 CO 0.94 0.81 0.10 0.12 -1.32 0.00 0.00 178.16 178.80 1r0x s PHE 626 N -3.56 -0.90 -0.08 -3.82 2.19 -1.12 -4.97 117.98 105.71 1r0x s PHE 626 Ca -0.03 1.97 0.00 0.00 0.33 0.00 0.00 56.93 59.20 1r0x s PHE 626 Cb 0.12 0.45 0.02 0.00 -1.31 0.00 0.00 43.02 42.30 1r0x s PHE 626 CO 0.80 -0.44 -0.06 -0.47 1.83 0.00 0.00 175.22 176.88 1r0x s TYR 627 N 1.02 1.15 -3.25 10.12 5.04 -1.26 -0.19 117.35 129.98 1r0x s TYR 627 Ca -0.05 -0.48 0.00 0.00 -2.44 0.00 0.00 57.07 54.10 1r0x s TYR 627 Cb -0.05 -1.00 0.00 0.00 0.35 0.00 0.00 41.96 41.26 1r0x s TYR 627 CO -0.10 -0.38 0.00 0.41 -1.34 0.00 0.00 175.55 174.14 1r0x n GLY 628 N 4.66 -0.56 3.98 8.97 0.00 -0.72 -4.99 105.19 116.53 1r0x n GLY 628 Ca -0.15 -0.76 -0.22 0.00 0.00 0.00 0.00 46.02 44.89 1r0x n GLY 628 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1r0x s THR 629 N -3.51 2.53 0.37 2.61 -4.23 -1.26 0.74 115.64 112.89 1r0x s THR 629 Ca 0.00 -0.65 0.11 0.00 -1.18 0.00 0.00 61.69 59.97 1r0x s THR 629 Cb 0.00 -2.88 0.11 0.00 1.34 0.00 0.00 72.50 71.08 1r0x s THR 629 CO 0.00 0.00 1.85 0.15 -0.54 0.00 0.00 174.62 176.08 1r0x h PHE 630 N -0.07 0.12 0.01 3.99 3.57 -1.86 -1.57 116.94 121.12 1r0x h PHE 630 Ca -0.40 -0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.07 1r0x h PHE 630 Cb 1.29 -0.03 0.00 0.00 2.79 0.00 0.00 35.95 40.00 1r0x h PHE 630 CO 0.25 0.39 -0.01 0.66 -2.23 0.00 0.00 178.31 177.37 1r0x h SER 631 N 0.10 -0.01 -1.07 0.41 4.64 -1.96 -1.83 113.55 113.83 1r0x h SER 631 Ca 0.01 -0.79 0.41 0.00 -0.47 0.00 0.00 61.79 60.96 1r0x h SER 631 Cb 0.56 0.00 -0.17 0.00 -0.31 0.00 0.00 62.40 62.49 1r0x h SER 631 CO 0.04 0.84 0.61 -0.33 -0.87 0.00 0.00 176.83 177.12 1r0x h GLU 632 N -0.92 0.05 -0.35 4.77 5.08 -1.95 0.12 114.58 121.39 1r0x h GLU 632 Ca -0.00 -0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.34 1r0x h GLU 632 Cb 0.81 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 30.03 1r0x h GLU 632 CO 0.00 0.03 0.14 1.25 -1.00 0.00 0.00 179.01 179.43 1r0x h LEU 633 N 0.05 0.48 -1.29 1.33 5.85 -0.81 0.74 115.31 121.66 1r0x h LEU 633 Ca 0.84 -0.17 -0.07 0.00 0.84 0.00 0.00 57.88 59.32 1r0x h LEU 633 Cb 2.27 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 43.16 1r0x h LEU 633 CO -0.69 0.51 -0.35 1.56 -0.34 0.00 0.00 178.44 179.14 1r0x h GLN 634 N 0.41 0.00 0.00 1.25 4.20 0.04 -1.47 115.11 119.54 1r0x h GLN 634 Ca 0.12 -0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.82 1r0x h GLN 634 Cb 0.18 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.96 1r0x h GLN 634 CO -0.01 0.35 -1.78 -1.13 -0.67 0.00 0.00 178.83 175.60 1r0x n SER 635 N -4.12 0.43 -0.00 1.46 3.41 -0.65 -3.57 113.62 110.58 1r0x n SER 635 Ca -0.02 -0.15 0.05 0.00 -0.26 0.00 0.00 58.87 58.49 1r0x n SER 635 Cb 0.39 1.79 -0.07 0.00 -0.26 0.00 0.00 64.21 66.06 1r0x n SER 635 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1r0x n LEU 636 N -2.09 0.49 -2.99 1.04 4.77 0.24 -4.63 117.00 113.82 1r0x n LEU 636 Ca -0.03 -0.45 -0.18 0.00 -0.03 0.00 0.00 56.01 55.32 1r0x n LEU 636 Cb 0.50 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.57 1r0x n LEU 636 CO 0.42 0.12 -0.12 0.54 -1.33 0.00 0.00 177.39 177.03 1r0x n ARG 637 N -1.33 1.52 0.26 3.23 5.12 -0.55 -4.97 116.66 119.94 1r0x n ARG 637 Ca 0.02 -3.66 0.10 0.00 -1.93 0.00 0.00 57.85 52.38 1r0x n ARG 637 Cb 0.19 -1.73 0.70 0.00 -1.16 0.00 0.00 32.46 30.47 1r0x n ARG 637 CO 0.00 0.00 0.00 -1.00 -1.93 0.00 0.00 177.63 174.70 1r0x h PRO 638 N 2.97 0.00 0.02 5.56 0.13 -1.70 -0.96 132.00 138.03 1r0x h PRO 638 Ca 0.07 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 65.15 1r0x h PRO 638 Cb 0.94 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.07 1r0x h PRO 638 CO 0.57 0.00 -0.24 -0.44 -0.23 0.00 0.00 178.00 177.66 1r0x h ASP 639 N 0.00 0.18 -0.26 1.44 3.45 -1.92 -1.60 116.42 117.70 1r0x h ASP 639 Ca 0.01 -0.87 0.06 0.00 0.43 0.00 0.00 57.03 56.66 1r0x h ASP 639 Cb 0.03 -0.06 -0.06 0.00 -0.56 0.00 0.00 39.33 38.68 1r0x h ASP 639 CO -0.00 1.03 -0.16 0.15 -1.57 0.00 0.00 179.24 178.69 1r0x h PHE 640 N -0.65 -0.39 -0.23 4.55 3.04 -1.89 -2.64 116.94 118.73 1r0x h PHE 640 Ca -0.04 0.03 0.01 0.00 3.98 0.00 0.00 57.97 61.96 1r0x h PHE 640 Cb 1.08 0.21 -0.02 0.00 2.56 0.00 0.00 35.95 39.79 1r0x h PHE 640 CO 0.21 -0.23 0.13 0.77 -2.02 0.00 0.00 178.31 177.17 1r0x h SER 641 N -0.14 0.20 -0.57 0.41 0.02 -1.20 -1.94 113.55 110.33 1r0x h SER 641 Ca 0.14 0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 61.05 1r0x h SER 641 Cb 0.35 -0.04 -0.03 0.00 0.14 0.00 0.00 62.40 62.82 1r0x h SER 641 CO -0.35 0.15 0.18 -1.28 -1.14 0.00 0.00 176.83 174.39 1r0x h SER 642 N 0.27 0.87 -0.09 3.07 0.87 -1.22 -0.95 113.55 116.36 1r0x h SER 642 Ca 0.09 -0.15 -0.01 0.00 -1.23 0.00 0.00 61.79 60.49 1r0x h SER 642 Cb 0.00 -0.23 -0.00 0.00 -0.44 0.00 0.00 62.40 61.73 1r0x h SER 642 CO -0.05 0.82 0.01 0.50 -0.53 0.00 0.00 176.83 177.59 1r0x h LYS 643 N 0.90 0.15 0.00 2.24 1.63 -1.21 -2.39 116.57 117.88 1r0x h LYS 643 Ca 0.20 -0.04 -0.07 0.00 -0.85 0.00 0.00 60.65 59.89 1r0x h LYS 643 Cb 0.28 -0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 31.88 1r0x h LYS 643 CO -0.01 0.37 -0.35 -0.07 -3.45 0.00 0.00 179.45 175.94 1r0x h LEU 644 N -0.09 0.00 0.00 5.20 4.07 -1.03 -3.16 115.31 120.29 1r0x h LEU 644 Ca 0.03 0.00 -0.10 0.00 0.08 0.00 0.00 57.88 57.88 1r0x h LEU 644 Cb 0.29 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 42.02 1r0x h LEU 644 CO 0.00 0.35 -0.97 0.24 -1.08 0.00 0.00 178.44 176.99 1r0x h MET 645 N 0.00 0.00 0.00 1.13 2.86 -1.20 -3.34 114.93 114.38 1r0x h MET 645 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1r0x h MET 645 Cb 0.70 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.36 1r0x h MET 645 CO 0.05 0.27 0.00 0.41 1.06 0.00 0.00 176.91 178.70 1r0x n GLY 646 N 1.28 -0.44 3.88 8.32 0.00 -0.90 -4.58 105.19 112.75 1r0x n GLY 646 Ca -0.03 -0.08 -0.31 0.00 0.00 0.00 0.00 46.02 45.60 1r0x n GLY 646 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1r0x s TYR 647 N -2.00 3.44 0.03 1.61 1.51 -1.25 -5.00 117.35 115.68 1r0x s TYR 647 Ca 0.18 0.80 0.02 0.00 -1.01 0.00 0.00 57.07 57.06 1r0x s TYR 647 Cb 0.08 -2.21 -0.25 0.00 -0.11 0.00 0.00 41.96 39.47 1r0x s TYR 647 CO 0.14 0.26 0.95 -0.44 -1.11 0.00 0.00 175.55 175.34 1r0x h ASP 648 N 2.36 0.23 -1.43 2.29 3.32 -1.93 -3.40 116.42 117.85 1r0x h ASP 648 Ca -0.47 -0.31 -0.41 0.00 0.02 0.00 0.00 57.03 55.86 1r0x h ASP 648 Cb 1.17 -0.07 -0.38 0.00 0.22 0.00 0.00 39.33 40.27 1r0x h ASP 648 CO 0.69 1.25 -1.14 0.35 -1.72 0.00 0.00 179.24 178.67 1r0x n THR 649 N -3.36 0.34 -0.35 0.35 -2.24 -1.26 -4.93 114.28 102.82 1r0x n THR 649 Ca -0.12 -3.71 0.05 0.00 -2.27 0.00 0.00 64.05 58.00 1r0x n THR 649 Cb 1.02 0.24 0.23 0.00 -2.10 0.00 0.00 70.33 69.72 1r0x n THR 649 CO 0.00 0.00 0.00 0.15 -0.57 0.00 0.00 175.07 174.65 1r0x h PHE 650 N 2.97 1.14 0.00 4.78 3.57 -1.90 -1.75 116.94 125.74 1r0x h PHE 650 Ca -0.01 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.53 1r0x h PHE 650 Cb 1.08 -0.37 0.00 0.00 2.79 0.00 0.00 35.95 39.45 1r0x h PHE 650 CO 0.46 0.52 0.00 -0.25 -2.23 0.00 0.00 178.31 176.81 1r0x n ASP 651 N -4.56 0.08 -0.95 0.41 9.92 -1.26 -1.74 116.55 118.46 1r0x n ASP 651 Ca 0.17 0.53 0.11 0.00 -0.53 0.00 0.00 54.79 55.07 1r0x n ASP 651 Cb 0.28 -0.54 0.13 0.00 -0.64 0.00 0.00 41.12 40.35 1r0x n ASP 651 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1r0x n GLN 652 N -1.60 2.17 -1.33 -1.24 6.02 -0.66 -4.94 117.38 115.81 1r0x n GLN 652 Ca 0.02 -1.94 -0.30 0.00 -0.01 0.00 0.00 57.00 54.76 1r0x n GLN 652 Cb 0.11 -1.44 0.11 0.00 1.02 0.00 0.00 30.24 30.04 1r0x n GLN 652 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 1r0x s PHE 653 N -1.69 2.58 0.77 1.08 2.99 -0.71 -5.00 117.98 118.00 1r0x s PHE 653 Ca 0.29 1.34 -0.13 0.00 0.00 0.00 0.00 56.93 58.43 1r0x s PHE 653 Cb 0.19 -3.09 0.06 0.00 0.00 0.00 0.00 43.02 40.18 1r0x s PHE 653 CO 0.28 -1.98 1.17 0.95 -0.00 0.00 0.00 175.22 175.64 1r0x s THR 654 N -2.98 2.48 0.27 0.64 -4.23 -1.26 -4.73 115.64 105.82 1r0x s THR 654 Ca 0.62 0.20 -0.00 0.00 -1.18 0.00 0.00 61.69 61.33 1r0x s THR 654 Cb -0.17 -2.62 0.25 0.00 1.34 0.00 0.00 72.50 71.30 1r0x s THR 654 CO 0.56 -0.16 1.76 -0.08 -0.54 0.00 0.00 174.62 176.16 1r0x h GLU 655 N -0.74 0.60 -0.20 3.99 4.57 -1.88 -0.32 114.58 120.59 1r0x h GLU 655 Ca -0.46 -0.04 0.02 0.00 -1.18 0.00 0.00 59.36 57.70 1r0x h GLU 655 Cb 1.28 -0.13 -0.02 0.00 -0.16 0.00 0.00 28.75 29.71 1r0x h GLU 655 CO 0.48 0.39 0.08 1.49 -1.18 0.00 0.00 179.01 180.28 1r0x h GLU 656 N 0.61 0.18 -0.69 1.92 4.81 -1.90 -1.33 114.58 118.18 1r0x h GLU 656 Ca 0.48 -0.01 -0.06 0.00 -0.13 0.00 0.00 59.36 59.64 1r0x h GLU 656 Cb 0.71 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 30.02 1r0x h GLU 656 CO -0.38 0.12 0.20 -0.09 -0.73 0.00 0.00 179.01 178.13 1r0x h ARG 657 N 0.18 1.08 -0.27 1.92 9.65 -1.81 0.38 114.38 125.50 1r0x h ARG 657 Ca 0.09 -0.24 0.01 0.00 -1.10 0.00 0.00 59.98 58.73 1r0x h ARG 657 Cb 0.04 -0.15 -0.02 0.00 -1.39 0.00 0.00 29.97 28.45 1r0x h ARG 657 CO -0.08 0.94 0.16 0.00 2.80 0.00 0.00 179.97 183.79 1r0x h ARG 658 N 1.01 0.33 -0.29 0.20 3.08 -0.95 -0.78 114.38 116.98 1r0x h ARG 658 Ca 0.22 -0.02 -0.14 0.00 0.07 0.00 0.00 59.98 60.11 1r0x h ARG 658 Cb 0.32 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.29 1r0x h ARG 658 CO -0.00 0.22 -0.40 0.77 -1.07 0.00 0.00 179.97 179.49 1r0x h SER 659 N 0.34 0.75 -0.75 7.04 0.02 -1.04 -0.91 113.55 118.99 1r0x h SER 659 Ca 0.11 -0.34 -0.04 0.00 -0.84 0.00 0.00 61.79 60.68 1r0x h SER 659 Cb -0.01 -0.21 -0.03 0.00 0.14 0.00 0.00 62.40 62.28 1r0x h SER 659 CO -0.04 1.05 0.32 -1.28 -1.14 0.00 0.00 176.83 175.74 1r0x h SER 660 N 0.58 1.02 -0.48 3.07 0.87 -0.80 0.19 113.55 118.00 1r0x h SER 660 Ca 0.05 -0.16 -0.13 0.00 -1.23 0.00 0.00 61.79 60.31 1r0x h SER 660 Cb 0.93 -0.27 -0.01 0.00 -0.44 0.00 0.00 62.40 62.61 1r0x h SER 660 CO 0.08 0.91 -0.22 0.40 -0.53 0.00 0.00 176.83 177.47 1r0x h ILE 661 N 1.08 1.27 -0.63 2.23 2.04 -0.95 -1.52 117.51 121.02 1r0x h ILE 661 Ca 0.25 -1.39 -0.01 0.00 1.00 0.00 0.00 64.86 64.71 1r0x h ILE 661 Cb 0.19 1.14 -0.03 0.00 -0.74 0.00 0.00 36.82 37.38 1r0x h ILE 661 CO -0.02 0.48 0.36 -0.07 0.00 0.00 0.00 178.15 178.89 1r0x h LEU 662 N 0.85 0.77 -0.40 1.44 3.38 -0.91 -2.01 115.31 118.43 1r0x h LEU 662 Ca 0.11 -0.08 -0.00 0.00 0.09 0.00 0.00 57.88 57.99 1r0x h LEU 662 Cb 0.81 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.34 1r0x h LEU 662 CO 0.07 0.63 0.25 0.74 0.09 0.00 0.00 178.44 180.22 1r0x h THR 663 N 0.85 1.12 -0.69 0.22 2.02 -0.37 -1.77 112.91 114.30 1r0x h THR 663 Ca 0.22 -0.27 -0.05 0.00 0.77 0.00 0.00 66.41 67.08 1r0x h THR 663 Cb 0.02 0.59 -0.03 0.00 -1.74 0.00 0.00 68.15 66.98 1r0x h THR 663 CO -0.04 0.12 0.23 -0.33 0.37 0.00 0.00 175.52 175.88 1r0x h GLU 664 N 0.53 1.04 -0.30 6.66 3.07 -1.16 -1.84 114.58 122.59 1r0x h GLU 664 Ca 0.14 -0.20 -0.17 0.00 -0.50 0.00 0.00 59.36 58.63 1r0x h GLU 664 Cb -0.01 -0.16 -0.00 0.00 -0.84 0.00 0.00 28.75 27.73 1r0x h GLU 664 CO -0.03 0.88 -0.50 1.15 -1.40 0.00 0.00 179.01 179.10 1r0x h THR 665 N 1.01 1.28 -0.38 1.13 2.02 -1.16 -2.38 112.91 114.43 1r0x h THR 665 Ca 0.23 -1.69 -0.13 0.00 0.77 0.00 0.00 66.41 65.59 1r0x h THR 665 Cb 0.26 1.58 -0.01 0.00 -1.74 0.00 0.00 68.15 68.24 1r0x h THR 665 CO -0.01 0.55 -0.27 -0.07 0.37 0.00 0.00 175.52 176.09 1r0x h LEU 666 N 0.65 0.88 -0.41 2.58 4.07 -1.14 -2.07 115.31 119.87 1r0x h LEU 666 Ca 0.03 -0.44 0.04 0.00 0.08 0.00 0.00 57.88 57.59 1r0x h LEU 666 Cb 1.09 -0.25 -0.04 0.00 1.08 0.00 0.00 40.66 42.55 1r0x h LEU 666 CO 0.11 1.13 0.18 0.03 -1.08 0.00 0.00 178.44 178.81 1r0x h ARG 667 N 0.64 0.36 0.10 1.13 3.08 -1.26 -2.74 114.38 115.70 1r0x h ARG 667 Ca 0.07 -0.02 -0.00 0.00 0.07 0.00 0.00 59.98 60.10 1r0x h ARG 667 Cb 0.84 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.81 1r0x h ARG 667 CO 0.07 0.24 -0.05 0.00 -1.07 0.00 0.00 179.97 179.16 1r0x h ARG 668 N 0.37 -0.13 -1.26 0.04 3.08 -1.38 -2.93 114.38 112.17 1r0x h ARG 668 Ca 0.18 0.01 -0.31 0.00 0.07 0.00 0.00 59.98 59.93 1r0x h ARG 668 Cb 0.12 0.03 -0.16 0.00 0.08 0.00 0.00 29.97 30.04 1r0x h ARG 668 CO -0.15 -0.01 0.40 1.19 -1.07 0.00 0.00 179.97 180.33 1r0x n PHE 669 N -5.11 1.64 -0.64 3.04 3.72 -0.79 -5.12 117.46 114.21 1r0x n PHE 669 Ca -0.08 -1.66 0.00 0.00 -0.05 0.00 0.00 57.45 55.66 1r0x n PHE 669 Cb 0.11 -0.82 0.00 0.00 -0.94 0.00 0.00 39.48 37.84 1r0x n PHE 669 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58