#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r0x n GLY 391 N 0.00 1.49 2.87 3.41 0.00 -1.26 -4.60 105.19 107.10 1r0x n GLY 391 Ca 0.00 -1.43 -0.14 0.00 0.00 0.00 0.00 46.02 44.45 1r0x n GLY 391 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1r0x s ILE 392 N 3.48 0.09 -0.05 -0.61 2.07 0.41 -4.48 121.20 122.12 1r0x s ILE 392 Ca 0.00 -0.01 0.02 0.00 -1.41 0.00 0.00 60.65 59.25 1r0x s ILE 392 Cb 0.00 -0.11 0.01 0.00 0.13 0.00 0.00 42.46 42.49 1r0x s ILE 392 CO 0.00 0.05 -0.11 -0.63 -1.91 0.00 0.00 174.94 172.34 1r0x s ILE 393 N 0.21 0.96 -0.06 2.00 1.01 -0.61 0.34 121.20 125.05 1r0x s ILE 393 Ca -0.02 -0.41 0.05 0.00 0.00 0.00 0.00 60.65 60.27 1r0x s ILE 393 Cb -0.03 -0.87 -0.00 0.00 0.01 0.00 0.00 42.46 41.56 1r0x s ILE 393 CO -0.01 0.31 -0.21 -0.04 0.00 0.00 0.00 174.94 174.99 1r0x s MET 394 N 0.48 2.29 -0.13 2.79 -1.94 0.27 -1.03 119.30 122.04 1r0x s MET 394 Ca -0.09 -0.74 0.01 0.00 -1.71 0.00 0.00 55.69 53.15 1r0x s MET 394 Cb -0.13 -1.90 0.02 0.00 2.01 0.00 0.00 34.83 34.84 1r0x s MET 394 CO 0.02 0.25 -0.14 -1.21 -0.01 0.00 0.00 175.02 173.93 1r0x s GLU 395 N 0.10 2.22 -0.51 2.03 2.02 -1.08 -1.03 118.70 122.45 1r0x s GLU 395 Ca -0.08 -0.54 -0.14 0.00 0.02 0.00 0.00 54.97 54.23 1r0x s GLU 395 Cb -0.14 -2.01 0.02 0.00 0.10 0.00 0.00 34.13 32.10 1r0x s GLU 395 CO 0.04 -0.19 0.27 0.09 0.02 0.00 0.00 175.26 175.49 1r0x n ASN 396 N 4.63 -1.60 -4.71 -0.19 3.02 -1.06 -3.16 115.26 112.18 1r0x n ASN 396 Ca -0.17 -0.54 -0.40 0.00 -0.03 0.00 0.00 54.58 53.44 1r0x n ASN 396 Cb 0.50 -0.65 -0.04 0.00 -0.61 0.00 0.00 39.78 38.98 1r0x n ASN 396 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1r0x s VAL 397 N -4.37 5.01 -0.08 2.41 1.01 -0.40 -2.30 120.40 121.68 1r0x s VAL 397 Ca 0.20 1.51 0.02 0.00 0.00 0.00 0.00 61.98 63.70 1r0x s VAL 397 Cb -0.11 -4.07 0.01 0.00 0.00 0.00 0.00 36.38 32.21 1r0x s VAL 397 CO 0.40 0.20 -0.13 -0.89 0.00 0.00 0.00 175.10 174.69 1r0x s THR 398 N 1.07 1.23 -0.03 3.92 2.01 -1.19 0.12 115.64 122.78 1r0x s THR 398 Ca 0.38 -0.51 0.05 0.00 0.31 0.00 0.00 61.69 61.92 1r0x s THR 398 Cb -0.18 -1.13 -0.01 0.00 0.01 0.00 0.00 72.50 71.19 1r0x s THR 398 CO 0.18 0.38 -0.18 0.00 -0.69 0.00 0.00 174.62 174.31 1r0x s ALA 399 N 0.82 1.49 0.17 7.40 0.00 0.84 0.39 121.76 132.87 1r0x s ALA 399 Ca -0.11 -0.74 0.06 0.00 0.00 0.00 0.00 51.96 51.17 1r0x s ALA 399 Cb -0.15 -0.43 -0.04 0.00 0.00 0.00 0.00 23.12 22.50 1r0x s ALA 399 CO 0.02 0.33 0.09 -0.06 0.00 0.00 0.00 175.76 176.13 1r0x s PHE 400 N -0.24 3.03 0.03 0.00 0.08 -1.26 0.71 117.98 120.33 1r0x s PHE 400 Ca 0.03 -0.07 -0.30 0.00 0.12 0.00 0.00 56.93 56.71 1r0x s PHE 400 Cb -0.09 -1.45 -0.08 0.00 -0.57 0.00 0.00 43.02 40.83 1r0x s PHE 400 CO 0.00 0.52 1.83 -1.58 -0.10 0.00 0.00 175.22 175.89 1r0x s TRP 401 N -1.77 1.73 0.20 0.36 0.52 0.52 -4.56 118.94 115.92 1r0x s TRP 401 Ca 0.30 -0.13 0.04 0.00 0.02 0.00 0.00 56.10 56.33 1r0x s TRP 401 Cb -0.10 -4.11 -0.05 0.00 -1.15 0.00 0.00 33.47 28.06 1r0x s TRP 401 CO 0.22 -4.81 -0.06 -1.21 0.02 0.00 0.00 176.95 171.11 1r0x s GLU 402 N 3.88 1.23 0.44 4.98 0.41 -1.26 -4.55 118.70 123.82 1r0x s GLU 402 Ca 0.82 -1.58 -0.25 0.00 -0.41 0.00 0.00 54.97 53.54 1r0x s GLU 402 Cb -0.40 -0.69 -0.09 0.00 -1.78 0.00 0.00 34.13 31.17 1r0x s GLU 402 CO 0.36 0.01 1.35 0.39 -0.49 0.00 0.00 175.26 176.88 1r0x n GLU 403 N -0.33 2.09 -0.31 1.61 1.02 -1.26 -3.05 120.64 120.42 1r0x n GLU 403 Ca -0.07 0.74 0.00 0.00 -0.02 0.00 0.00 57.16 57.81 1r0x n GLU 403 Cb 0.62 -2.51 0.00 0.00 -0.02 0.00 0.00 31.44 29.53 1r0x n GLU 403 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1r0x n GLY 404 N 0.69 2.29 0.14 0.62 0.00 -1.26 -4.83 105.19 102.85 1r0x n GLY 404 Ca 0.06 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.86 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 0.76 -0.34 1.61 3.04 -1.94 -2.81 116.94 117.27 1r0x h PHE 405 Ca 0.00 -0.56 -0.05 0.00 3.98 0.00 0.00 57.97 61.35 1r0x h PHE 405 Cb 0.00 -0.03 -0.02 0.00 2.56 0.00 0.00 35.95 38.46 1r0x h PHE 405 CO 0.00 1.56 0.01 0.78 -2.02 0.00 0.00 178.31 178.64 1r0x h GLY 406 N 0.72 0.56 2.00 2.40 0.00 -1.88 0.13 103.07 106.99 1r0x h GLY 406 Ca -0.28 -0.32 -0.17 0.00 0.00 0.00 0.00 47.33 46.55 1r0x h GLY 406 CO 0.22 0.30 -0.82 1.05 0.00 0.00 0.00 176.54 177.29 1r0x h GLU 407 N 0.50 0.00 -0.04 4.80 4.11 -1.95 -1.63 114.58 120.36 1r0x h GLU 407 Ca 0.11 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.53 1r0x h GLU 407 Cb 0.31 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.56 1r0x h GLU 407 CO 0.01 0.82 0.00 1.25 0.07 0.00 0.00 179.01 181.16 1r0x h LEU 408 N 0.00 0.07 -1.82 3.06 6.46 -1.13 -2.71 115.31 119.25 1r0x h LEU 408 Ca -0.01 -0.29 -0.01 0.00 -0.12 0.00 0.00 57.88 57.46 1r0x h LEU 408 Cb 1.63 -0.02 -0.01 0.00 -0.73 0.00 0.00 40.66 41.53 1r0x h LEU 408 CO 0.11 0.34 0.02 -0.07 -0.62 0.00 0.00 178.44 178.22 1r0x h LEU 409 N -0.20 0.11 0.00 2.25 3.38 -0.81 0.10 115.31 120.16 1r0x h LEU 409 Ca 0.01 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1r0x h LEU 409 Cb 0.30 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.02 1r0x h LEU 409 CO 0.00 0.12 0.00 1.21 0.09 0.00 0.00 178.44 179.87 1r0x n GLU 410 N -4.48 0.07 0.00 1.13 4.07 -0.62 -5.09 120.64 115.73 1r0x n GLU 410 Ca -0.02 0.21 0.00 0.00 -0.06 0.00 0.00 57.16 57.29 1r0x n GLU 410 Cb 0.12 -1.50 0.00 0.00 -0.06 0.00 0.00 31.44 30.00 1r0x n GLU 410 CO 0.00 0.00 0.00 1.63 -0.06 0.00 0.00 177.13 178.70 1r0x n LYS 411 N -1.24 3.27 0.00 5.31 5.02 0.35 -5.05 118.16 125.82 1r0x n LYS 411 Ca 0.02 -0.11 0.00 0.00 -2.02 0.00 0.00 58.31 56.20 1r0x n LYS 411 Cb 0.03 -0.52 0.00 0.00 -0.02 0.00 0.00 35.03 34.52 1r0x n LYS 411 CO 0.00 0.00 0.00 1.97 -0.52 0.00 0.00 177.40 178.85 1r0x n PHE 430 N -0.50 0.00 0.25 2.13 -1.74 -1.26 -4.88 117.46 111.46 1r0x n PHE 430 Ca 0.00 0.00 0.14 0.00 -0.56 0.00 0.00 57.45 57.03 1r0x n PHE 430 Cb 0.02 0.00 0.52 0.00 1.52 0.00 0.00 39.48 41.54 1r0x n PHE 430 CO 0.00 0.00 0.00 0.77 -0.56 0.00 0.00 176.76 176.97 1r0x h SER 431 N 0.00 0.00 -0.41 5.98 0.02 -1.99 -3.02 113.55 114.13 1r0x h SER 431 Ca 0.00 0.00 -0.14 0.00 -0.84 0.00 0.00 61.79 60.81 1r0x h SER 431 Cb 0.00 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.53 1r0x h SER 431 CO 0.00 0.10 -0.29 0.45 -1.14 0.00 0.00 176.83 175.94 1r0x h HIS 432 N 0.00 1.08 0.00 3.45 3.86 -2.03 0.50 115.15 122.01 1r0x h HIS 432 Ca -0.00 -0.30 -0.09 0.00 -1.16 0.00 0.00 60.37 58.83 1r0x h HIS 432 Cb 0.69 -0.24 -0.01 0.00 1.06 0.00 0.00 27.41 28.91 1r0x h HIS 432 CO 0.00 1.11 -0.41 -0.07 0.86 0.00 0.00 177.93 179.42 1r0x h LEU 433 N 0.74 0.00 0.38 2.43 3.38 -1.93 0.14 115.31 120.44 1r0x h LEU 433 Ca 0.08 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.03 1r0x h LEU 433 Cb 0.88 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.63 1r0x h LEU 433 CO 0.08 0.41 -0.18 0.00 0.09 0.00 0.00 178.44 178.84 1r0x h LEU 435 N -1.05 -0.92 -1.13 0.00 7.12 0.12 0.13 115.31 119.58 1r0x h LEU 435 Ca -0.05 0.24 0.00 0.00 0.13 0.00 0.00 57.88 58.20 1r0x h LEU 435 Cb 0.49 0.54 0.00 0.00 -0.53 0.00 0.00 40.66 41.16 1r0x h LEU 435 CO 0.08 -0.28 0.00 0.52 -0.13 0.00 0.00 178.44 178.64 1r0x n VAL 436 N -5.49 0.47 -3.57 1.05 0.31 0.47 -4.95 118.33 106.62 1r0x n VAL 436 Ca 0.09 -0.35 -0.18 0.00 -0.01 0.00 0.00 64.34 63.89 1r0x n VAL 436 Cb 0.39 -0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.32 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 0.69 -1.23 3.30 2.92 0.00 0.44 -5.00 105.19 106.31 1r0x n GLY 437 Ca 0.08 0.61 -0.29 0.00 0.00 0.00 0.00 46.02 46.42 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 -2.92 2.90 0.13 1.61 0.01 -0.83 -5.01 114.94 110.84 1r0x s ASN 438 Ca 0.02 -0.50 -0.30 0.00 -0.71 0.00 0.00 52.86 51.37 1r0x s ASN 438 Cb -0.00 -0.29 -0.07 0.00 0.41 0.00 0.00 41.25 41.29 1r0x s ASN 438 CO 0.85 0.27 1.22 -2.16 -1.51 0.00 0.00 177.10 175.77 1r0x s PRO 439 N -0.88 4.45 0.14 -0.60 0.04 -1.26 -0.36 135.00 136.53 1r0x s PRO 439 Ca 0.10 1.86 -0.11 0.00 0.04 0.00 0.00 61.00 62.89 1r0x s PRO 439 Cb -0.09 -3.28 -0.03 0.00 0.04 0.00 0.00 34.50 31.13 1r0x s PRO 439 CO 0.00 -0.20 1.49 -0.24 0.04 0.00 0.00 177.00 178.10 1r0x h VAL 440 N 4.10 1.27 -4.11 -0.36 3.04 0.04 -3.45 116.25 116.78 1r0x h VAL 440 Ca -0.43 -1.51 -0.44 0.00 -1.01 0.00 0.00 66.70 63.31 1r0x h VAL 440 Cb 1.21 1.32 -0.28 0.00 -2.01 0.00 0.00 31.29 31.53 1r0x h VAL 440 CO 0.79 0.51 -0.79 -0.76 -1.01 0.00 0.00 177.57 176.30 1r0x s LEU 441 N -8.94 2.04 -0.14 3.16 1.43 -0.60 -3.92 118.68 111.70 1r0x s LEU 441 Ca -0.11 -0.24 0.01 0.00 -1.03 0.00 0.00 54.13 52.76 1r0x s LEU 441 Cb 0.11 -0.59 0.02 0.00 0.03 0.00 0.00 46.19 45.76 1r0x s LEU 441 CO 0.88 0.13 -0.14 -0.75 0.23 0.00 0.00 176.35 176.69 1r0x s LYS 442 N -0.37 2.27 -1.10 1.70 2.20 0.12 -0.11 119.74 124.44 1r0x s LYS 442 Ca 0.04 -0.55 -0.24 0.00 -0.36 0.00 0.00 55.97 54.86 1r0x s LYS 442 Cb -0.05 -2.06 0.03 0.00 -1.51 0.00 0.00 37.83 34.25 1r0x s LYS 442 CO -0.00 -0.21 0.67 0.09 -0.36 0.00 0.00 175.35 175.54 1r0x n ASN 443 N 4.68 -4.48 -4.70 1.43 3.02 -0.35 -4.38 115.26 110.49 1r0x n ASN 443 Ca -0.17 -1.18 -0.40 0.00 -0.03 0.00 0.00 54.58 52.80 1r0x n ASN 443 Cb 0.50 -1.84 -0.04 0.00 -0.61 0.00 0.00 39.78 37.78 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 -3.37 4.98 -0.12 2.41 -1.09 0.33 -4.63 121.20 119.71 1r0x s ILE 444 Ca 0.36 1.53 0.02 0.00 -2.23 0.00 0.00 60.65 60.32 1r0x s ILE 444 Cb -0.19 -4.08 0.01 0.00 -1.58 0.00 0.00 42.46 36.62 1r0x s ILE 444 CO 0.94 0.17 -0.19 0.20 -1.23 0.00 0.00 174.94 174.83 1r0x s ASN 445 N 0.95 2.75 -0.00 3.58 0.01 -1.26 -1.28 114.94 119.69 1r0x s ASN 445 Ca 0.38 -0.51 -0.13 0.00 -0.71 0.00 0.00 52.86 51.89 1r0x s ASN 445 Cb -0.17 -1.26 0.02 0.00 0.41 0.00 0.00 41.25 40.25 1r0x s ASN 445 CO 0.17 0.06 0.27 -1.48 -1.51 0.00 0.00 177.10 174.60 1r0x s LEU 446 N 0.84 1.03 -0.27 0.60 0.05 -0.20 -4.93 118.68 115.80 1r0x s LEU 446 Ca -0.08 -0.02 -0.03 0.00 0.05 0.00 0.00 54.13 54.05 1r0x s LEU 446 Cb -0.15 1.13 0.09 0.00 -2.05 0.00 0.00 46.19 45.20 1r0x s LEU 446 CO -0.00 -0.45 0.09 0.21 -0.55 0.00 0.00 176.35 175.65 1r0x s ASN 447 N -1.43 3.47 -0.16 1.48 2.47 -1.26 0.96 114.94 120.47 1r0x s ASN 447 Ca -0.13 -1.25 -0.00 0.00 0.42 0.00 0.00 52.86 51.90 1r0x s ASN 447 Cb -0.05 -0.58 -0.01 0.00 -1.45 0.00 0.00 41.25 39.17 1r0x s ASN 447 CO 0.03 -0.39 -0.13 -0.63 -3.72 0.00 0.00 177.10 172.25 1r0x s ILE 448 N 1.88 2.84 0.14 -5.21 -1.09 0.15 -5.00 121.20 114.92 1r0x s ILE 448 Ca 0.06 -0.71 -0.25 0.00 -2.23 0.00 0.00 60.65 57.53 1r0x s ILE 448 Cb -0.17 -2.21 -0.07 0.00 -1.58 0.00 0.00 42.46 38.43 1r0x s ILE 448 CO -0.24 0.51 0.76 -1.61 -1.23 0.00 0.00 174.94 173.12 1r0x s GLU 449 N 0.79 4.52 -0.18 2.79 2.02 -1.26 -0.44 118.70 126.94 1r0x s GLU 449 Ca -0.05 1.11 -0.35 0.00 0.02 0.00 0.00 54.97 55.70 1r0x s GLU 449 Cb -0.15 -3.27 -0.16 0.00 0.10 0.00 0.00 34.13 30.64 1r0x s GLU 449 CO 0.01 0.54 1.05 1.17 0.02 0.00 0.00 175.26 178.05 1r0x n LYS 450 N 1.77 0.00 -0.65 1.61 4.81 -1.26 -0.64 118.16 123.80 1r0x n LYS 450 Ca -0.06 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.38 1r0x n LYS 450 Cb 0.49 -1.21 0.00 0.00 0.02 0.00 0.00 35.03 34.33 1r0x n LYS 450 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1r0x n GLY 451 N 2.11 0.79 3.98 3.14 0.00 -1.26 -4.92 105.19 109.03 1r0x n GLY 451 Ca 0.20 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.02 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 -0.35 3.22 -0.15 1.61 2.02 0.18 -4.41 118.70 120.82 1r0x s GLU 452 Ca 0.00 -0.93 -0.01 0.00 0.02 0.00 0.00 54.97 54.05 1r0x s GLU 452 Cb 0.00 -2.84 -0.01 0.00 0.10 0.00 0.00 34.13 31.38 1r0x s GLU 452 CO 0.00 0.19 -0.11 1.41 0.02 0.00 0.00 175.26 176.77 1r0x s MET 453 N -4.10 3.40 -0.26 1.61 -2.45 -1.26 -1.78 119.30 114.45 1r0x s MET 453 Ca 0.41 -0.67 -0.13 0.00 -1.25 0.00 0.00 55.69 54.05 1r0x s MET 453 Cb -0.09 -2.71 -0.04 0.00 1.25 0.00 0.00 34.83 33.23 1r0x s MET 453 CO 0.30 0.14 0.27 -1.17 1.05 0.00 0.00 175.02 175.62 1r0x s LEU 454 N 0.55 4.06 -0.13 4.11 0.20 -0.66 -1.61 118.68 125.19 1r0x s LEU 454 Ca -0.07 0.18 -0.18 0.00 0.69 0.00 0.00 54.13 54.75 1r0x s LEU 454 Cb -0.15 -2.27 -0.04 0.00 -0.43 0.00 0.00 46.19 43.29 1r0x s LEU 454 CO 0.03 -0.08 0.46 0.00 -0.29 0.00 0.00 176.35 176.47 1r0x s ALA 455 N 1.70 3.50 -0.24 5.97 0.00 -0.20 -1.06 121.76 131.42 1r0x s ALA 455 Ca 0.11 -0.25 -0.02 0.00 0.00 0.00 0.00 51.96 51.81 1r0x s ALA 455 Cb -0.15 -2.64 0.02 0.00 0.00 0.00 0.00 23.12 20.34 1r0x s ALA 455 CO 0.09 -0.05 -0.07 0.42 0.00 0.00 0.00 175.76 176.15 1r0x s ILE 456 N 0.75 2.90 0.36 0.00 1.01 -0.30 -0.32 121.20 125.59 1r0x s ILE 456 Ca 0.25 -0.91 0.02 0.00 0.00 0.00 0.00 60.65 60.01 1r0x s ILE 456 Cb -0.15 -2.42 -0.01 0.00 0.01 0.00 0.00 42.46 39.89 1r0x s ILE 456 CO 0.09 0.27 0.08 1.07 0.00 0.00 0.00 174.94 176.46 1r0x n THR 457 N 4.69 0.00 -3.66 2.92 5.66 0.57 -1.79 114.28 122.67 1r0x n THR 457 Ca -0.17 -1.96 0.00 0.00 -3.05 0.00 0.00 64.05 58.87 1r0x n THR 457 Cb 0.48 0.61 0.00 0.00 -1.55 0.00 0.00 70.33 69.87 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 -0.15 -0.51 3.96 1.09 0.00 -1.26 -0.76 105.19 107.56 1r0x n GLY 458 Ca -0.09 -1.01 -0.25 0.00 0.00 0.00 0.00 46.02 44.68 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 4.37 0.30 1.61 1.04 -1.04 -4.64 113.70 111.34 1r0x s SER 459 Ca 0.00 0.05 -0.23 0.00 0.48 0.00 0.00 55.95 56.26 1r0x s SER 459 Cb 0.00 -0.52 -0.09 0.00 0.10 0.00 0.00 66.02 65.51 1r0x s SER 459 CO 0.00 -1.86 0.87 0.42 0.98 0.00 0.00 173.24 173.65 1r0x s THR 460 N -3.27 4.37 -1.57 2.02 -4.23 -1.26 -3.35 115.64 108.34 1r0x s THR 460 Ca 0.65 1.57 -0.03 0.00 -1.18 0.00 0.00 61.69 62.70 1r0x s THR 460 Cb -0.07 -3.90 0.00 0.00 1.34 0.00 0.00 72.50 69.87 1r0x s THR 460 CO 0.45 0.09 0.36 0.61 -0.54 0.00 0.00 174.62 175.60 1r0x n GLY 461 N 0.42 -0.46 0.83 3.99 0.00 -1.26 -4.89 105.19 103.82 1r0x n GLY 461 Ca 0.01 0.04 0.11 0.00 0.00 0.00 0.00 46.02 46.18 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 -2.13 2.49 0.00 1.61 3.41 -1.21 -4.64 113.62 113.15 1r0x n SER 462 Ca -0.16 -1.84 0.00 0.00 -0.26 0.00 0.00 58.87 56.61 1r0x n SER 462 Cb 0.64 -0.15 0.00 0.00 -0.26 0.00 0.00 64.21 64.44 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 1.30 0.79 0.26 5.00 0.00 -1.26 -1.30 105.19 109.99 1r0x n GLY 463 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 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 4.38 0.60 -0.16 1.61 1.57 -1.92 0.82 116.57 123.47 1r0x h LYS 464 Ca 0.00 -0.04 -0.14 0.00 -1.87 0.00 0.00 60.65 58.60 1r0x h LYS 464 Cb 0.00 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.18 1r0x h LYS 464 CO 0.00 0.39 -0.45 1.15 -0.57 0.00 0.00 179.45 179.98 1r0x h THR 465 N 0.61 1.34 -0.82 -0.16 2.02 -2.00 -3.19 112.91 110.71 1r0x h THR 465 Ca 0.33 -1.70 0.13 0.00 0.77 0.00 0.00 66.41 65.93 1r0x h THR 465 Cb 0.30 1.98 -0.06 0.00 -1.74 0.00 0.00 68.15 68.63 1r0x h THR 465 CO -0.24 0.52 0.54 0.28 0.37 0.00 0.00 175.52 176.99 1r0x h SER 466 N 0.25 0.60 -0.73 4.18 0.02 -1.74 0.12 113.55 116.26 1r0x h SER 466 Ca -0.01 0.03 -0.03 0.00 -0.84 0.00 0.00 61.79 60.94 1r0x h SER 466 Cb 1.06 -0.09 -0.03 0.00 0.14 0.00 0.00 62.40 63.47 1r0x h SER 466 CO 0.10 0.33 0.35 0.25 -1.14 0.00 0.00 176.83 176.71 1r0x h LEU 467 N 0.65 0.97 -0.17 5.07 5.85 -0.86 0.23 115.31 127.05 1r0x h LEU 467 Ca 0.40 -0.11 -0.22 0.00 0.84 0.00 0.00 57.88 58.79 1r0x h LEU 467 Cb 0.64 -0.25 0.01 0.00 0.37 0.00 0.00 40.66 41.43 1r0x h LEU 467 CO -0.16 0.82 -0.78 -0.07 -0.34 0.00 0.00 178.44 177.91 1r0x h LEU 468 N 1.06 0.92 -1.38 2.25 4.07 -0.93 -2.51 115.31 118.80 1r0x h LEU 468 Ca 0.26 -0.61 0.17 0.00 0.08 0.00 0.00 57.88 57.78 1r0x h LEU 468 Cb 0.12 -0.27 -0.07 0.00 1.08 0.00 0.00 40.66 41.51 1r0x h LEU 468 CO -0.03 1.41 0.58 0.24 -1.08 0.00 0.00 178.44 179.55 1r0x h MET 469 N 0.53 0.54 -0.55 1.13 2.86 -0.32 0.16 114.93 119.28 1r0x h MET 469 Ca -0.05 -0.03 -0.03 0.00 -2.06 0.00 0.00 59.70 57.52 1r0x h MET 469 Cb 1.41 -0.12 -0.03 0.00 0.06 0.00 0.00 31.60 32.92 1r0x h MET 469 CO 0.16 0.36 0.21 1.25 1.06 0.00 0.00 176.91 179.95 1r0x h LEU 470 N 0.56 0.73 -0.08 1.22 5.85 -0.53 0.16 115.31 123.22 1r0x h LEU 470 Ca 0.46 -0.09 -0.21 0.00 0.84 0.00 0.00 57.88 58.88 1r0x h LEU 470 Cb 0.93 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.75 1r0x h LEU 470 CO -0.20 0.67 -0.99 0.40 -0.34 0.00 0.00 178.44 177.97 1r0x h ILE 471 N 0.79 1.63 0.00 4.05 2.04 -0.79 -3.08 117.51 122.16 1r0x h ILE 471 Ca 0.19 -3.16 0.00 0.00 1.00 0.00 0.00 64.86 62.89 1r0x h ILE 471 Cb 0.17 2.76 0.00 0.00 -0.74 0.00 0.00 36.82 39.01 1r0x h ILE 471 CO -0.02 0.91 0.00 0.18 0.00 0.00 0.00 178.15 179.22 1r0x n LEU 472 N -3.46 0.00 0.00 1.44 4.77 0.38 -4.85 117.00 115.29 1r0x n LEU 472 Ca -0.02 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.96 1r0x n LEU 472 Cb 0.91 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 42.00 1r0x n LEU 472 CO 0.48 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.15 1r0x n GLY 473 N 0.73 0.39 0.12 -0.72 0.00 -0.88 -4.86 105.19 99.97 1r0x n GLY 473 Ca 0.13 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.28 1r0x n GLY 473 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1r0x h GLU 474 N 1.03 0.00 -5.77 1.61 4.39 -0.96 -3.44 114.58 111.44 1r0x h GLU 474 Ca 0.00 0.00 -0.55 0.00 0.34 0.00 0.00 59.36 59.15 1r0x h GLU 474 Cb 0.25 0.00 -0.29 0.00 -0.10 0.00 0.00 28.75 28.62 1r0x h GLU 474 CO 0.00 0.00 -0.84 -1.17 -1.16 0.00 0.00 179.01 175.84 1r0x s LEU 475 N -4.65 2.06 -0.09 1.33 2.96 -1.01 -4.95 118.68 114.34 1r0x s LEU 475 Ca 0.10 -0.37 -0.22 0.00 -0.22 0.00 0.00 54.13 53.42 1r0x s LEU 475 Cb 0.12 -0.92 -0.04 0.00 0.50 0.00 0.00 46.19 45.85 1r0x s LEU 475 CO 0.59 0.20 0.64 -1.83 -1.32 0.00 0.00 176.35 174.63 1r0x s GLU 476 N -0.59 4.40 0.44 1.98 1.03 -1.26 -4.49 118.70 120.22 1r0x s GLU 476 Ca 0.07 0.76 -0.22 0.00 0.03 0.00 0.00 54.97 55.60 1r0x s GLU 476 Cb -0.07 -3.45 -0.09 0.00 -0.80 0.00 0.00 34.13 29.71 1r0x s GLU 476 CO -0.00 0.06 1.04 0.00 -1.33 0.00 0.00 175.26 175.03 1r0x s ALA 477 N 0.85 2.98 -0.00 -0.84 0.00 -1.26 -4.24 121.76 119.24 1r0x s ALA 477 Ca 0.34 0.65 -0.03 0.00 0.00 0.00 0.00 51.96 52.91 1r0x s ALA 477 Cb -0.17 -3.26 -0.02 0.00 0.00 0.00 0.00 23.12 19.67 1r0x s ALA 477 CO 0.16 -0.25 -0.08 0.43 0.00 0.00 0.00 175.76 176.02 1r0x n SER 478 N -0.52 0.91 -4.95 0.00 7.64 0.16 -4.97 113.62 111.90 1r0x n SER 478 Ca 0.07 0.13 -0.21 0.00 1.01 0.00 0.00 58.87 59.88 1r0x n SER 478 Cb 0.51 -0.32 0.04 0.00 -1.01 0.00 0.00 64.21 63.44 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 -2.16 2.47 0.21 1.43 8.01 -1.08 -4.94 118.70 122.64 1r0x s GLU 479 Ca -0.07 -0.93 0.00 0.00 0.01 0.00 0.00 54.97 53.98 1r0x s GLU 479 Cb 0.02 -2.52 0.00 0.00 -4.31 0.00 0.00 34.13 27.32 1r0x s GLU 479 CO 0.10 -0.74 0.00 0.41 0.01 0.00 0.00 175.26 175.04 1r0x n GLY 480 N -2.32 -2.43 3.14 -1.39 0.00 -0.97 -3.14 105.19 98.07 1r0x n GLY 480 Ca 0.09 -1.33 -0.26 0.00 0.00 0.00 0.00 46.02 44.53 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 -2.80 1.42 -0.27 -0.61 1.01 -1.19 -4.90 121.20 113.85 1r0x s ILE 481 Ca 0.00 -0.72 -0.11 0.00 0.00 0.00 0.00 60.65 59.83 1r0x s ILE 481 Cb 0.00 -1.21 -0.05 0.00 0.01 0.00 0.00 42.46 41.21 1r0x s ILE 481 CO 0.00 0.41 0.18 -0.51 0.00 0.00 0.00 174.94 175.01 1r0x s ILE 482 N -0.03 5.22 -0.44 2.92 -1.16 -1.26 -2.63 121.20 123.82 1r0x s ILE 482 Ca -0.02 0.14 -0.11 0.00 -0.51 0.00 0.00 60.65 60.15 1r0x s ILE 482 Cb -0.11 -3.48 0.08 0.00 0.61 0.00 0.00 42.46 39.57 1r0x s ILE 482 CO 0.02 0.27 0.30 -0.54 -2.81 0.00 0.00 174.94 172.18 1r0x s LYS 483 N 1.68 2.71 -0.09 3.50 1.02 -0.19 -5.00 119.74 123.36 1r0x s LYS 483 Ca 0.07 -1.44 -0.10 0.00 0.02 0.00 0.00 55.97 54.51 1r0x s LYS 483 Cb -0.16 -3.89 0.03 0.00 -0.52 0.00 0.00 37.83 33.29 1r0x s LYS 483 CO 0.10 -0.99 0.28 -3.38 -0.92 0.00 0.00 175.35 170.44 1r0x s HIS 484 N 1.48 -0.28 -0.07 3.18 -3.43 -1.26 -1.57 115.29 113.33 1r0x s HIS 484 Ca 0.03 0.67 0.02 0.00 -0.80 0.00 0.00 55.06 54.99 1r0x s HIS 484 Cb -0.24 0.10 0.02 0.00 -1.43 0.00 0.00 32.58 31.03 1r0x s HIS 484 CO 0.03 -0.18 -0.11 -1.12 -2.00 0.00 0.00 174.74 171.35 1r0x s SER 485 N -0.08 1.83 0.00 7.38 0.01 -1.26 -5.04 113.70 116.53 1r0x s SER 485 Ca -0.02 -0.30 0.00 0.00 1.31 0.00 0.00 55.95 56.94 1r0x s SER 485 Cb -0.03 -0.83 0.00 0.00 0.21 0.00 0.00 66.02 65.38 1r0x s SER 485 CO 0.01 0.01 0.00 0.61 0.41 0.00 0.00 173.24 174.28 1r0x n GLY 486 N 3.99 0.32 3.77 3.44 0.00 -1.26 -4.31 105.19 111.14 1r0x n GLY 486 Ca -0.21 -2.29 -0.40 0.00 0.00 0.00 0.00 46.02 43.12 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 -0.09 4.54 0.01 1.61 0.52 -1.26 -4.91 118.95 119.37 1r0x s ARG 487 Ca 0.00 1.13 0.06 0.00 -0.52 0.00 0.00 55.73 56.40 1r0x s ARG 487 Cb 0.00 -3.29 -0.03 0.00 0.52 0.00 0.00 34.95 32.15 1r0x s ARG 487 CO 0.00 0.49 -0.18 0.14 0.02 0.00 0.00 175.30 175.77 1r0x s VAL 488 N -0.82 2.79 -0.08 3.52 -7.23 -1.26 -0.28 120.40 117.04 1r0x s VAL 488 Ca 0.37 -1.03 0.02 0.00 -1.81 0.00 0.00 61.98 59.52 1r0x s VAL 488 Cb -0.22 -2.12 -0.02 0.00 0.56 0.00 0.00 36.38 34.57 1r0x s VAL 488 CO 0.25 0.44 -0.13 -0.55 -0.31 0.00 0.00 175.10 174.81 1r0x s SER 489 N -1.12 4.08 -0.07 4.85 0.15 0.35 -4.96 113.70 116.98 1r0x s SER 489 Ca 0.13 -0.23 0.02 0.00 0.70 0.00 0.00 55.95 56.58 1r0x s SER 489 Cb -0.10 -1.15 0.01 0.00 -1.71 0.00 0.00 66.02 63.07 1r0x s SER 489 CO 0.03 0.28 -0.13 0.12 1.20 0.00 0.00 173.24 174.74 1r0x s PHE 490 N -0.35 1.58 -0.33 3.44 5.36 -1.26 -0.64 117.98 125.77 1r0x s PHE 490 Ca 0.04 -0.61 -0.04 0.00 -0.96 0.00 0.00 56.93 55.35 1r0x s PHE 490 Cb -0.12 -1.15 0.05 0.00 -0.34 0.00 0.00 43.02 41.45 1r0x s PHE 490 CO 0.02 -0.32 0.07 0.00 -1.46 0.00 0.00 175.22 173.54 1r0x s SER 492 N 1.39 5.85 0.12 0.00 1.04 -1.26 -1.13 113.70 119.71 1r0x s SER 492 Ca -0.02 1.46 -0.21 0.00 0.48 0.00 0.00 55.95 57.66 1r0x s SER 492 Cb -0.20 -2.43 -0.05 0.00 0.10 0.00 0.00 66.02 63.44 1r0x s SER 492 CO 0.01 -1.12 1.71 1.56 0.98 0.00 0.00 173.24 176.37 1r0x h GLN 493 N -0.49 -0.03 -6.32 4.02 4.20 -1.90 -3.36 115.11 111.22 1r0x h GLN 493 Ca -0.44 0.00 -0.57 0.00 0.06 0.00 0.00 58.65 57.70 1r0x h GLN 493 Cb 1.20 0.01 -0.07 0.00 0.30 0.00 0.00 27.48 28.92 1r0x h GLN 493 CO 0.60 -0.02 0.81 0.12 -0.67 0.00 0.00 178.83 179.67 1r0x s PHE 494 N -6.19 3.09 -0.21 2.96 5.36 -1.26 -4.92 117.98 116.80 1r0x s PHE 494 Ca -0.13 1.04 -0.29 0.00 -0.96 0.00 0.00 56.93 56.59 1r0x s PHE 494 Cb 0.09 -3.79 -0.03 0.00 -0.34 0.00 0.00 43.02 38.96 1r0x s PHE 494 CO 0.68 -0.85 1.58 -1.12 -1.46 0.00 0.00 175.22 174.05 1r0x s SER 495 N 1.82 6.45 0.00 6.13 0.01 -1.26 -5.02 113.70 121.82 1r0x s SER 495 Ca 0.44 1.65 -0.01 0.00 1.31 0.00 0.00 55.95 59.34 1r0x s SER 495 Cb -0.11 -2.53 -0.04 0.00 0.21 0.00 0.00 66.02 63.54 1r0x s SER 495 CO 0.18 -1.20 0.14 -1.66 0.41 0.00 0.00 173.24 171.12 1r0x s TRP 496 N 4.98 3.43 -0.08 2.43 1.48 -1.26 -4.99 118.94 124.92 1r0x s TRP 496 Ca 0.70 0.28 0.02 0.00 -1.06 0.00 0.00 56.10 56.03 1r0x s TRP 496 Cb -0.25 -1.78 0.02 0.00 -1.16 0.00 0.00 33.47 30.30 1r0x s TRP 496 CO 0.28 0.60 -0.12 0.42 -4.06 0.00 0.00 176.95 174.08 1r0x s ILE 497 N -1.29 1.15 0.17 0.66 -1.09 -1.26 -4.85 121.20 114.69 1r0x s ILE 497 Ca 0.26 -0.46 -0.04 0.00 -2.23 0.00 0.00 60.65 58.18 1r0x s ILE 497 Cb -0.12 -1.08 -0.05 0.00 -1.58 0.00 0.00 42.46 39.63 1r0x s ILE 497 CO 0.18 0.37 0.40 -0.04 -1.23 0.00 0.00 174.94 174.61 1r0x s MET 498 N 0.91 3.61 0.31 2.79 -1.94 -1.26 -0.59 119.30 123.13 1r0x s MET 498 Ca -0.10 -0.11 -0.30 0.00 -1.71 0.00 0.00 55.69 53.48 1r0x s MET 498 Cb -0.15 -2.82 -0.12 0.00 2.01 0.00 0.00 34.83 33.75 1r0x s MET 498 CO 0.01 0.43 1.53 -2.30 -0.01 0.00 0.00 175.02 174.68 1r0x n PRO 499 N -0.15 2.59 0.00 2.03 -0.02 -1.26 -4.62 135.00 133.56 1r0x n PRO 499 Ca -0.03 0.92 0.00 0.00 -2.02 0.00 0.00 63.50 62.37 1r0x n PRO 499 Cb 0.52 -2.66 0.00 0.00 -0.02 0.00 0.00 33.50 31.34 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 1.71 0.92 3.92 -1.23 0.00 -0.67 -4.97 105.19 104.87 1r0x n GLY 500 Ca 0.07 -1.99 -0.27 0.00 0.00 0.00 0.00 46.02 43.83 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 -1.41 2.93 0.14 2.61 -4.23 -1.26 0.25 115.64 114.67 1r0x s THR 501 Ca 0.00 -0.08 -0.20 0.00 -1.18 0.00 0.00 61.69 60.24 1r0x s THR 501 Cb 0.00 -3.23 -0.00 0.00 1.34 0.00 0.00 72.50 70.61 1r0x s THR 501 CO 0.00 -0.25 1.69 0.40 -0.54 0.00 0.00 174.62 175.93 1r0x h ILE 502 N -0.45 0.74 -0.53 2.99 2.04 -1.28 0.13 117.51 121.15 1r0x h ILE 502 Ca -0.45 0.00 0.02 0.00 1.00 0.00 0.00 64.86 65.43 1r0x h ILE 502 Cb 1.29 0.74 -0.03 0.00 -0.74 0.00 0.00 36.82 38.07 1r0x h ILE 502 CO 0.61 0.00 0.32 0.50 0.00 0.00 0.00 178.15 179.58 1r0x h LYS 503 N -0.02 0.62 -0.46 2.37 3.64 -1.71 -0.68 116.57 120.32 1r0x h LYS 503 Ca 0.12 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.44 1r0x h LYS 503 Cb 0.19 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 31.85 1r0x h LYS 503 CO -0.25 0.41 0.22 0.93 -2.27 0.00 0.00 179.45 178.49 1r0x h GLU 504 N 0.64 0.65 -0.29 1.90 5.08 -1.70 -1.61 114.58 119.25 1r0x h GLU 504 Ca 0.21 -0.07 -0.10 0.00 -1.00 0.00 0.00 59.36 58.40 1r0x h GLU 504 Cb 0.01 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.12 1r0x h GLU 504 CO -0.09 0.51 -0.23 -0.91 -1.00 0.00 0.00 179.01 177.28 1r0x h ASN 505 N 0.65 0.55 -0.05 1.42 2.35 0.40 0.28 115.58 121.18 1r0x h ASN 505 Ca 0.16 -0.19 -0.14 0.00 -0.55 0.00 0.00 56.30 55.59 1r0x h ASN 505 Cb 0.08 -0.15 0.01 0.00 0.05 0.00 0.00 38.32 38.31 1r0x h ASN 505 CO -0.02 0.78 -0.52 0.40 -1.65 0.00 0.00 177.43 176.42 1r0x h ILE 506 N 0.49 1.40 0.12 2.81 2.04 -0.59 -3.34 117.51 120.44 1r0x h ILE 506 Ca 0.07 -1.93 -0.28 0.00 1.00 0.00 0.00 64.86 63.72 1r0x h ILE 506 Cb 0.67 2.39 0.00 0.00 -0.74 0.00 0.00 36.82 39.14 1r0x h ILE 506 CO 0.05 0.57 -1.33 0.40 0.00 0.00 0.00 178.15 177.83 1r0x h ILE 507 N -0.02 1.39 -6.45 -0.67 2.04 -1.31 -3.35 117.51 109.14 1r0x h ILE 507 Ca -0.05 -2.98 -0.42 0.00 1.00 0.00 0.00 64.86 62.41 1r0x h ILE 507 Cb 1.20 2.88 0.02 0.00 -0.74 0.00 0.00 36.82 40.18 1r0x h ILE 507 CO 0.11 0.87 -0.88 0.33 0.00 0.00 0.00 178.15 178.58 1r0x n PHE 508 N -3.50 -2.04 -1.33 1.37 7.35 0.98 -1.12 117.46 119.17 1r0x n PHE 508 Ca -0.11 0.65 -0.11 0.00 -0.76 0.00 0.00 57.45 57.12 1r0x n PHE 508 Cb 1.03 -3.13 -0.05 0.00 0.35 0.00 0.00 39.48 37.68 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 -1.76 1.17 3.86 7.13 0.00 -1.26 -5.01 105.19 109.32 1r0x n GLY 509 Ca -0.18 -0.15 -0.21 0.00 0.00 0.00 0.00 46.02 45.47 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 -2.17 4.09 0.15 1.61 1.01 -0.28 -5.07 120.40 119.74 1r0x s VAL 510 Ca 0.00 -1.34 -0.30 0.00 0.00 0.00 0.00 61.98 60.34 1r0x s VAL 510 Cb 0.00 -3.34 -0.07 0.00 0.00 0.00 0.00 36.38 32.97 1r0x s VAL 510 CO 0.00 -0.26 1.11 -0.94 0.00 0.00 0.00 175.10 175.01 1r0x s SER 511 N -3.94 7.24 0.43 3.32 1.04 -1.26 -4.97 113.70 115.57 1r0x s SER 511 Ca 0.37 2.06 -0.25 0.00 0.48 0.00 0.00 55.95 58.61 1r0x s SER 511 Cb -0.07 -2.60 -0.08 0.00 0.10 0.00 0.00 66.02 63.37 1r0x s SER 511 CO 0.26 -0.26 1.25 -0.47 0.98 0.00 0.00 173.24 175.01 1r0x s TYR 512 N 0.01 2.81 -0.25 5.02 5.04 -1.26 -5.03 117.35 123.69 1r0x s TYR 512 Ca 0.51 1.46 -0.02 0.00 -2.44 0.00 0.00 57.07 56.58 1r0x s TYR 512 Cb -0.29 -3.57 0.13 0.00 0.35 0.00 0.00 41.96 38.58 1r0x s TYR 512 CO 0.34 -1.92 0.37 0.34 -1.34 0.00 0.00 175.55 173.34 1r0x s ASP 513 N -0.98 0.36 0.12 4.32 -1.08 -1.26 -5.07 116.67 113.08 1r0x s ASP 513 Ca 0.60 0.12 -0.21 0.00 -0.52 0.00 0.00 52.55 52.54 1r0x s ASP 513 Cb -0.35 1.06 -0.05 0.00 -1.46 0.00 0.00 42.92 42.12 1r0x s ASP 513 CO 0.44 -0.31 1.70 -0.08 0.52 0.00 0.00 175.17 177.44 1r0x h GLU 514 N 8.19 -0.05 -0.18 4.34 4.57 -1.99 -1.27 114.58 128.18 1r0x h GLU 514 Ca -0.18 0.00 -0.15 0.00 -1.18 0.00 0.00 59.36 57.85 1r0x h GLU 514 Cb 1.15 0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 29.74 1r0x h GLU 514 CO 0.27 -0.04 -0.51 1.88 -1.18 0.00 0.00 179.01 179.44 1r0x h TYR 515 N -0.06 0.61 -0.21 0.92 0.99 -1.99 -1.18 116.97 116.05 1r0x h TYR 515 Ca 0.07 -0.20 -0.03 0.00 2.00 0.00 0.00 58.73 60.57 1r0x h TYR 515 Cb 0.17 -0.12 -0.01 0.00 1.00 0.00 0.00 36.73 37.77 1r0x h TYR 515 CO -0.20 0.90 0.02 -0.09 -0.00 0.00 0.00 178.16 178.79 1r0x h ARG 516 N 0.39 0.36 0.06 4.88 2.43 -1.94 -2.07 114.38 118.48 1r0x h ARG 516 Ca 0.02 -0.10 0.01 0.00 -0.81 0.00 0.00 59.98 59.09 1r0x h ARG 516 Cb 1.02 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 30.52 1r0x h ARG 516 CO 0.09 0.52 -0.07 -0.92 -1.51 0.00 0.00 179.97 178.08 1r0x h TYR 517 N 0.14 -0.19 -1.00 2.20 3.20 -1.09 0.21 116.97 120.44 1r0x h TYR 517 Ca 0.06 0.00 0.04 0.00 3.14 0.00 0.00 58.73 61.98 1r0x h TYR 517 Cb 0.35 0.08 -0.06 0.00 1.54 0.00 0.00 36.73 38.64 1r0x h TYR 517 CO 0.03 -0.12 0.65 0.87 -1.64 0.00 0.00 178.16 177.95 1r0x h LYS 518 N -0.16 1.20 0.03 1.82 1.57 -1.20 -0.05 116.57 119.79 1r0x h LYS 518 Ca 0.01 -0.07 -0.25 0.00 -1.87 0.00 0.00 60.65 58.47 1r0x h LYS 518 Cb 0.16 -0.27 0.01 0.00 0.08 0.00 0.00 32.23 32.21 1r0x h LYS 518 CO -0.04 0.80 -1.03 1.03 -0.57 0.00 0.00 179.45 179.64 1r0x h SER 519 N 1.24 0.62 -0.37 0.86 0.87 -0.84 -2.05 113.55 113.88 1r0x h SER 519 Ca 0.41 -0.52 -0.08 0.00 -1.23 0.00 0.00 61.79 60.36 1r0x h SER 519 Cb 0.04 -0.19 -0.01 0.00 -0.44 0.00 0.00 62.40 61.80 1r0x h SER 519 CO -0.14 1.33 -0.09 0.58 -0.53 0.00 0.00 176.83 177.99 1r0x h VAL 520 N 0.24 1.28 -0.76 2.23 2.07 -0.68 -2.24 116.25 118.39 1r0x h VAL 520 Ca -0.11 -1.17 0.06 0.00 0.82 0.00 0.00 66.70 66.30 1r0x h VAL 520 Cb 1.69 1.27 -0.06 0.00 -1.52 0.00 0.00 31.29 32.67 1r0x h VAL 520 CO 0.18 0.39 0.45 0.58 0.02 0.00 0.00 177.57 179.19 1r0x h VAL 521 N 0.52 1.01 -0.10 2.57 2.07 -1.01 -0.92 116.25 120.38 1r0x h VAL 521 Ca 0.09 -0.28 -0.07 0.00 0.82 0.00 0.00 66.70 67.27 1r0x h VAL 521 Cb 0.60 0.11 0.00 0.00 -1.52 0.00 0.00 31.29 30.49 1r0x h VAL 521 CO 0.04 0.15 -0.19 0.50 0.02 0.00 0.00 177.57 178.08 1r0x h LYS 522 N 0.82 0.32 -0.53 1.57 3.64 -1.31 -1.30 116.57 119.77 1r0x h LYS 522 Ca 0.33 -0.20 -0.01 0.00 -1.27 0.00 0.00 60.65 59.50 1r0x h LYS 522 Cb 0.17 0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 31.99 1r0x h LYS 522 CO -0.17 0.79 0.30 0.00 -2.27 0.00 0.00 179.45 178.09 1r0x h ALA 523 N 0.52 1.52 0.00 5.00 0.00 -1.33 -1.61 119.26 123.36 1r0x h ALA 523 Ca 0.01 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1r0x h ALA 523 Cb 0.77 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.35 1r0x h ALA 523 CO 0.04 0.40 0.00 0.00 0.00 0.00 0.00 179.25 179.70 1r0x n GLN 525 N -0.66 -4.47 0.08 0.00 1.13 -0.61 -4.89 117.38 107.95 1r0x n GLN 525 Ca 0.07 0.81 0.12 0.00 -1.94 0.00 0.00 57.00 56.06 1r0x n GLN 525 Cb 0.03 -5.63 0.11 0.00 0.11 0.00 0.00 30.24 24.86 1r0x n GLN 525 CO 0.00 0.00 0.00 -0.07 -1.44 0.00 0.00 177.06 175.55 1r0x h LEU 526 N -1.25 0.00 -0.71 1.08 3.38 -1.44 -3.36 115.31 113.01 1r0x h LEU 526 Ca -0.50 -0.16 -0.06 0.00 0.09 0.00 0.00 57.88 57.24 1r0x h LEU 526 Cb 1.35 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 42.07 1r0x h LEU 526 CO 0.56 0.08 0.19 -0.61 0.09 0.00 0.00 178.44 178.75 1r0x h GLN 527 N 0.00 1.12 -0.21 1.13 5.75 -1.86 -0.10 115.11 120.94 1r0x h GLN 527 Ca 0.00 -0.26 0.06 0.00 -0.15 0.00 0.00 58.65 58.30 1r0x h GLN 527 Cb 0.83 -0.15 -0.01 0.00 1.07 0.00 0.00 27.48 29.22 1r0x h GLN 527 CO 0.00 0.98 0.18 1.96 -2.65 0.00 0.00 178.83 179.31 1r0x h GLN 528 N 1.06 0.00 0.00 1.69 7.50 -1.94 -2.37 115.11 121.05 1r0x h GLN 528 Ca 0.22 0.00 -0.06 0.00 0.50 0.00 0.00 58.65 59.32 1r0x h GLN 528 Cb 0.35 0.00 -0.01 0.00 0.05 0.00 0.00 27.48 27.87 1r0x h GLN 528 CO -0.00 0.00 -0.37 -0.44 -1.50 0.00 0.00 178.83 176.52 1r0x h ASP 529 N 0.00 0.00 0.10 1.46 3.32 -1.35 -3.37 116.42 116.58 1r0x h ASP 529 Ca 0.10 -0.58 -0.01 0.00 0.02 0.00 0.00 57.03 56.56 1r0x h ASP 529 Cb 0.47 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.01 1r0x h ASP 529 CO -0.00 1.00 -0.04 0.16 -1.72 0.00 0.00 179.24 178.64 1r0x h ILE 530 N -1.00 0.64 0.00 0.35 3.07 -0.89 -0.91 117.51 118.76 1r0x h ILE 530 Ca -0.09 -0.18 0.00 0.00 1.55 0.00 0.00 64.86 66.14 1r0x h ILE 530 Cb 0.84 1.11 0.00 0.00 -0.27 0.00 0.00 36.82 38.50 1r0x h ILE 530 CO -0.05 0.04 0.00 1.07 -1.05 0.00 0.00 178.15 178.16 1r0x n THR 531 N -3.91 0.65 0.49 0.16 5.66 -0.91 -1.84 114.28 114.58 1r0x n THR 531 Ca -0.03 -0.12 0.12 0.00 -3.05 0.00 0.00 64.05 60.98 1r0x n THR 531 Cb 0.13 -0.76 0.46 0.00 -1.55 0.00 0.00 70.33 68.61 1r0x n THR 531 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 1r0x n LYS 532 N -2.22 0.20 -4.43 1.09 5.02 -0.35 -4.84 118.16 112.64 1r0x n LYS 532 Ca 0.05 0.34 -0.34 0.00 -2.02 0.00 0.00 58.31 56.33 1r0x n LYS 532 Cb 0.36 -1.82 -0.10 0.00 -0.02 0.00 0.00 35.03 33.45 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 -3.23 3.08 0.27 2.13 2.99 -0.77 -5.03 117.98 117.43 1r0x s PHE 533 Ca 0.06 0.04 -0.01 0.00 0.00 0.00 0.00 56.93 57.02 1r0x s PHE 533 Cb 0.10 -1.82 0.48 0.00 0.00 0.00 0.00 43.02 41.78 1r0x s PHE 533 CO 0.45 0.31 1.86 0.00 -0.00 0.00 0.00 175.22 177.83 1r0x h ALA 534 N 5.59 1.45 -0.55 5.36 0.00 -1.88 -0.52 119.26 128.71 1r0x h ALA 534 Ca -0.45 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1r0x h ALA 534 Cb 1.19 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.72 1r0x h ALA 534 CO 0.56 0.34 0.00 0.39 0.00 0.00 0.00 179.25 180.54 1r0x n GLU 535 N -4.56 3.55 0.00 0.00 -0.58 -1.26 -5.04 120.64 112.75 1r0x n GLU 535 Ca 0.17 -2.78 0.00 0.00 -0.42 0.00 0.00 57.16 54.13 1r0x n GLU 535 Cb 0.27 -1.81 0.00 0.00 -0.57 0.00 0.00 31.44 29.32 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 0.81 0.00 -0.46 3.49 6.02 -0.20 -0.08 117.38 126.95 1r0x n GLN 536 Ca 0.23 0.00 0.38 0.00 -0.01 0.00 0.00 57.00 57.61 1r0x n GLN 536 Cb 0.84 0.00 0.68 0.00 1.02 0.00 0.00 30.24 32.78 1r0x n GLN 536 CO 0.00 0.00 0.00 0.22 -1.01 0.00 0.00 177.06 176.27 1r0x h ASP 537 N 0.00 0.18 -0.38 1.08 3.58 -1.90 0.27 116.42 119.25 1r0x h ASP 537 Ca 0.00 0.08 0.00 0.00 0.42 0.00 0.00 57.03 57.53 1r0x h ASP 537 Cb 0.00 0.07 0.00 0.00 1.72 0.00 0.00 39.33 41.12 1r0x h ASP 537 CO 0.00 -0.08 0.00 0.59 -2.88 0.00 0.00 179.24 176.87 1r0x n ASN 538 N -4.45 2.16 -4.72 2.28 5.03 0.89 -2.02 115.26 114.43 1r0x n ASN 538 Ca 0.35 -1.97 -0.42 0.00 0.87 0.00 0.00 54.58 53.42 1r0x n ASN 538 Cb 1.45 -0.25 -0.03 0.00 -1.02 0.00 0.00 39.78 39.93 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 -1.49 2.32 -0.11 3.41 2.01 0.08 -4.78 115.64 117.08 1r0x s THR 539 Ca 0.28 0.22 -0.25 0.00 0.31 0.00 0.00 61.69 62.26 1r0x s THR 539 Cb 0.15 -3.14 -0.03 0.00 0.01 0.00 0.00 72.50 69.49 1r0x s THR 539 CO 0.20 0.02 0.78 -0.69 -0.69 0.00 0.00 174.62 174.23 1r0x s VAL 540 N 1.18 4.96 -0.06 3.82 1.01 -1.26 -1.53 120.40 128.51 1r0x s VAL 540 Ca 0.73 1.57 -0.01 0.00 0.00 0.00 0.00 61.98 64.26 1r0x s VAL 540 Cb -0.47 -4.10 -0.03 0.00 0.00 0.00 0.00 36.38 31.78 1r0x s VAL 540 CO 0.32 0.14 0.02 -0.76 0.00 0.00 0.00 175.10 174.82 1r0x s LEU 541 N 1.44 3.65 0.73 3.92 1.43 0.14 -4.96 118.68 125.02 1r0x s LEU 541 Ca 0.39 0.12 -0.11 0.00 -1.03 0.00 0.00 54.13 53.50 1r0x s LEU 541 Cb -0.17 -1.94 0.03 0.00 0.03 0.00 0.00 46.19 44.13 1r0x s LEU 541 CO 0.16 0.34 1.09 -0.83 0.23 0.00 0.00 176.35 177.35 1r0x s GLY 542 N -1.17 1.63 0.34 -3.19 0.00 -1.26 -1.68 107.32 102.00 1r0x s GLY 542 Ca 0.16 -0.26 -0.28 0.00 0.00 0.00 0.00 44.72 44.34 1r0x s GLY 542 CO 0.06 0.12 1.22 -2.21 0.00 0.00 0.00 173.10 172.28 1r0x n GLU 543 N -3.14 1.92 0.00 2.90 4.07 -1.26 -1.07 120.64 124.06 1r0x n GLU 543 Ca 0.07 0.67 0.00 0.00 -0.06 0.00 0.00 57.16 57.84 1r0x n GLU 543 Cb 0.57 -2.22 0.00 0.00 -0.06 0.00 0.00 31.44 29.72 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 0.88 2.98 3.86 8.31 0.00 0.25 -4.39 105.19 117.08 1r0x n GLY 544 Ca 0.06 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.81 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 -1.52 -0.39 0.35 -0.02 0.00 -0.23 -4.64 105.19 98.74 1r0x n GLY 545 Ca 0.00 0.16 0.03 0.00 0.00 0.00 0.00 46.02 46.22 1r0x n GLY 545 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1r0x h VAL 546 N -1.96 1.11 -0.00 1.61 2.07 -1.81 -2.04 116.25 115.23 1r0x h VAL 546 Ca -0.60 -0.29 0.00 0.00 0.82 0.00 0.00 66.70 66.63 1r0x h VAL 546 Cb 1.37 0.18 0.00 0.00 -1.52 0.00 0.00 31.29 31.32 1r0x h VAL 546 CO 0.63 0.16 -0.04 0.35 0.02 0.00 0.00 177.57 178.69 1r0x n THR 547 N -4.45 0.00 -1.81 2.57 -2.24 -1.26 -4.85 114.28 102.24 1r0x n THR 547 Ca 0.09 -0.08 -0.29 0.00 -2.27 0.00 0.00 64.05 61.50 1r0x n THR 547 Cb 0.12 -0.14 0.09 0.00 -2.10 0.00 0.00 70.33 68.30 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 -2.20 2.49 0.56 3.22 1.02 -0.77 -5.07 118.68 117.94 1r0x s LEU 548 Ca 0.38 0.92 -0.06 0.00 0.02 0.00 0.00 54.13 55.39 1r0x s LEU 548 Cb 0.21 -3.45 -0.01 0.00 0.02 0.00 0.00 46.19 42.97 1r0x s LEU 548 CO 0.40 -1.92 0.87 -0.94 0.02 0.00 0.00 176.35 174.79 1r0x s SER 549 N -4.39 5.84 0.25 2.29 1.04 -1.26 -4.93 113.70 112.54 1r0x s SER 549 Ca 0.61 0.83 -0.04 0.00 0.48 0.00 0.00 55.95 57.83 1r0x s SER 549 Cb -0.12 -1.92 0.41 0.00 0.10 0.00 0.00 66.02 64.49 1r0x s SER 549 CO 0.51 -0.90 1.83 1.23 0.98 0.00 0.00 173.24 176.88 1r0x h GLY 550 N -0.06 1.35 0.78 7.32 0.00 -1.97 -1.80 103.07 108.69 1r0x h GLY 550 Ca -0.46 -0.35 0.04 0.00 0.00 0.00 0.00 47.33 46.56 1r0x h GLY 550 CO 0.61 0.17 0.43 -1.33 0.00 0.00 0.00 176.54 176.42 1r0x h GLY 551 N 0.88 1.04 0.73 4.60 0.00 -1.95 -1.38 103.07 106.99 1r0x h GLY 551 Ca 0.41 -0.31 -0.01 0.00 0.00 0.00 0.00 47.33 47.42 1r0x h GLY 551 CO -0.23 0.23 -0.00 1.46 0.00 0.00 0.00 176.54 178.00 1r0x h GLN 552 N 0.81 0.12 -0.63 4.80 4.20 -1.78 -0.21 115.11 122.43 1r0x h GLN 552 Ca 0.30 -0.04 0.08 0.00 0.06 0.00 0.00 58.65 59.05 1r0x h GLN 552 Cb 0.10 -0.01 -0.06 0.00 0.30 0.00 0.00 27.48 27.81 1r0x h GLN 552 CO -0.14 0.39 0.30 0.00 -0.67 0.00 0.00 178.83 178.71 1r0x h ARG 553 N -0.16 0.52 -0.44 1.46 3.08 -1.35 -1.13 114.38 116.35 1r0x h ARG 553 Ca 0.02 -0.03 -0.10 0.00 0.07 0.00 0.00 59.98 59.94 1r0x h ARG 553 Cb 0.34 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.26 1r0x h ARG 553 CO 0.00 0.34 -0.14 0.00 -1.07 0.00 0.00 179.97 179.11 1r0x h ALA 554 N 1.38 0.92 -0.58 0.04 0.00 -0.96 -0.74 119.26 119.31 1r0x h ALA 554 Ca 0.30 -0.34 -0.09 0.00 0.00 0.00 0.00 54.91 54.78 1r0x h ALA 554 Cb 0.29 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 1r0x h ALA 554 CO -0.24 0.62 -0.01 0.00 0.00 0.00 0.00 179.25 179.62 1r0x h ARG 555 N 0.74 1.02 -0.66 0.00 3.08 -0.86 -0.44 114.38 117.26 1r0x h ARG 555 Ca 0.12 -0.32 -0.04 0.00 0.07 0.00 0.00 59.98 59.81 1r0x h ARG 555 Cb 0.64 -0.09 -0.03 0.00 0.08 0.00 0.00 29.97 30.57 1r0x h ARG 555 CO 0.04 1.00 0.26 0.82 -1.07 0.00 0.00 179.97 181.03 1r0x h ILE 556 N 0.93 1.24 -0.13 2.04 2.04 -1.02 -0.21 117.51 122.40 1r0x h ILE 556 Ca 0.17 -0.75 -0.20 0.00 1.00 0.00 0.00 64.86 65.08 1r0x h ILE 556 Cb 0.55 0.50 0.00 0.00 -0.74 0.00 0.00 36.82 37.13 1r0x h ILE 556 CO 0.03 0.30 -0.71 0.77 0.00 0.00 0.00 178.15 178.53 1r0x h SER 557 N 0.93 0.69 -0.46 1.72 4.64 -1.08 -1.43 113.55 118.57 1r0x h SER 557 Ca 0.22 -0.44 0.00 0.00 -0.47 0.00 0.00 61.79 61.10 1r0x h SER 557 Cb 0.21 -0.20 -0.02 0.00 -0.31 0.00 0.00 62.40 62.07 1r0x h SER 557 CO -0.02 1.20 0.29 0.25 -0.87 0.00 0.00 176.83 177.68 1r0x h LEU 558 N 0.41 0.54 -0.62 5.97 6.46 -1.02 -2.57 115.31 124.48 1r0x h LEU 558 Ca -0.03 -0.03 0.07 0.00 -0.12 0.00 0.00 57.88 57.77 1r0x h LEU 558 Cb 1.31 -0.14 -0.06 0.00 -0.73 0.00 0.00 40.66 41.04 1r0x h LEU 558 CO 0.13 0.41 0.30 0.00 -0.62 0.00 0.00 178.44 178.67 1r0x h ALA 559 N 1.15 0.82 -0.80 1.25 0.00 -0.65 -0.29 119.26 120.74 1r0x h ALA 559 Ca 0.17 0.04 0.09 0.00 0.00 0.00 0.00 54.91 55.21 1r0x h ALA 559 Cb -0.04 -0.05 -0.07 0.00 0.00 0.00 0.00 17.79 17.63 1r0x h ALA 559 CO -0.03 -0.07 0.45 -0.09 0.00 0.00 0.00 179.25 179.51 1r0x h ARG 560 N 0.55 0.74 -0.19 0.00 2.43 -1.21 0.27 114.38 116.96 1r0x h ARG 560 Ca 0.29 -0.04 -0.21 0.00 -0.81 0.00 0.00 59.98 59.21 1r0x h ARG 560 Cb 0.26 -0.17 0.01 0.00 -0.42 0.00 0.00 29.97 29.65 1r0x h ARG 560 CO -0.22 0.49 -0.70 0.00 -1.51 0.00 0.00 179.97 178.03 1r0x h ALA 561 N 1.44 0.34 0.02 2.80 0.00 -0.86 -3.04 119.26 119.97 1r0x h ALA 561 Ca 0.38 -0.57 -0.21 0.00 0.00 0.00 0.00 54.91 54.51 1r0x h ALA 561 Cb 0.35 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 1r0x h ALA 561 CO -0.25 0.67 -0.96 0.28 0.00 0.00 0.00 179.25 178.99 1r0x h VAL 562 N 0.56 1.58 -0.20 0.00 2.07 -0.83 -3.16 116.25 116.28 1r0x h VAL 562 Ca -0.03 -2.97 -0.08 0.00 0.82 0.00 0.00 66.70 64.43 1r0x h VAL 562 Cb 1.33 2.67 -0.01 0.00 -1.52 0.00 0.00 31.29 33.75 1r0x h VAL 562 CO 0.15 0.86 -0.25 0.22 0.02 0.00 0.00 177.57 178.57 1r0x h TYR 563 N 0.05 0.40 -2.95 1.57 3.20 -0.51 -3.43 116.97 115.31 1r0x h TYR 563 Ca -0.04 -0.08 -0.52 0.00 3.14 0.00 0.00 58.73 61.23 1r0x h TYR 563 Cb 1.65 -0.10 0.05 0.00 1.54 0.00 0.00 36.73 39.86 1r0x h TYR 563 CO 0.02 0.59 0.86 0.21 -1.64 0.00 0.00 178.16 178.19 1r0x s LYS 564 N -4.49 4.22 -0.29 1.82 2.36 -1.15 -4.95 119.74 117.26 1r0x s LYS 564 Ca -0.06 2.36 -0.26 0.00 -2.55 0.00 0.00 55.97 55.46 1r0x s LYS 564 Cb 0.14 -3.14 0.00 0.00 -1.05 0.00 0.00 37.83 33.78 1r0x s LYS 564 CO 0.77 -0.57 0.90 0.34 1.55 0.00 0.00 175.35 178.33 1r0x s ASP 565 N 0.97 6.81 0.19 1.43 3.68 -1.26 -4.98 116.67 123.52 1r0x s ASP 565 Ca 0.68 0.92 -0.11 0.00 2.13 0.00 0.00 52.55 56.17 1r0x s ASP 565 Cb -0.43 -2.46 -0.00 0.00 -1.45 0.00 0.00 42.92 38.57 1r0x s ASP 565 CO 0.34 -0.66 0.35 0.00 0.13 0.00 0.00 175.17 175.33 1r0x s ALA 566 N 3.13 -0.12 0.03 3.66 0.00 -1.26 -4.98 121.76 122.22 1r0x s ALA 566 Ca 0.37 -0.84 0.07 0.00 0.00 0.00 0.00 51.96 51.57 1r0x s ALA 566 Cb -0.14 0.94 -0.23 0.00 0.00 0.00 0.00 23.12 23.69 1r0x s ALA 566 CO 0.11 -0.72 0.94 -0.44 0.00 0.00 0.00 175.76 175.65 1r0x h ASP 567 N 2.43 0.07 -3.52 0.00 3.32 -0.99 -3.47 116.42 114.26 1r0x h ASP 567 Ca -0.30 -0.11 -0.38 0.00 0.02 0.00 0.00 57.03 56.26 1r0x h ASP 567 Cb 1.24 -0.02 -0.33 0.00 0.22 0.00 0.00 39.33 40.43 1r0x h ASP 567 CO 0.44 1.09 -0.76 -0.22 -1.72 0.00 0.00 179.24 178.07 1r0x s LEU 568 N -6.50 1.38 -0.19 1.55 2.96 -0.52 -3.83 118.68 113.53 1r0x s LEU 568 Ca -0.03 -0.10 -0.04 0.00 -0.22 0.00 0.00 54.13 53.74 1r0x s LEU 568 Cb 0.09 -0.37 -0.02 0.00 0.50 0.00 0.00 46.19 46.38 1r0x s LEU 568 CO 0.83 -0.05 -0.03 -0.31 -1.32 0.00 0.00 176.35 175.47 1r0x s TYR 569 N 0.80 2.99 -0.28 5.38 1.51 -0.31 -0.50 117.35 126.94 1r0x s TYR 569 Ca -0.10 -0.55 -0.02 0.00 -1.01 0.00 0.00 57.07 55.39 1r0x s TYR 569 Cb -0.13 -2.04 0.04 0.00 -0.11 0.00 0.00 41.96 39.72 1r0x s TYR 569 CO -0.00 -0.26 -0.02 -0.51 -1.11 0.00 0.00 175.55 173.65 1r0x s LEU 570 N 0.91 3.66 -0.37 -1.29 1.43 0.19 0.81 118.68 124.01 1r0x s LEU 570 Ca -0.00 -1.12 0.01 0.00 -1.03 0.00 0.00 54.13 51.99 1r0x s LEU 570 Cb -0.15 -1.70 0.10 0.00 0.03 0.00 0.00 46.19 44.48 1r0x s LEU 570 CO 0.01 -0.21 0.12 -0.76 0.23 0.00 0.00 176.35 175.74 1r0x s LEU 571 N 1.29 4.98 -0.78 1.79 1.02 0.96 -0.26 118.68 127.68 1r0x s LEU 571 Ca -0.03 -2.09 -0.19 0.00 0.02 0.00 0.00 54.13 51.84 1r0x s LEU 571 Cb -0.19 -1.72 0.12 0.00 0.02 0.00 0.00 46.19 44.42 1r0x s LEU 571 CO -0.02 -0.46 0.96 -0.62 0.02 0.00 0.00 176.35 176.23 1r0x s ASP 572 N 1.34 6.42 -1.12 2.29 -1.08 -0.28 -0.48 116.67 123.76 1r0x s ASP 572 Ca 0.09 -1.70 -0.05 0.00 -0.52 0.00 0.00 52.55 50.37 1r0x s ASP 572 Cb -0.21 -2.36 0.01 0.00 -1.46 0.00 0.00 42.92 38.89 1r0x s ASP 572 CO -0.06 -1.12 0.63 -1.20 0.52 0.00 0.00 175.17 173.93 1r0x n SER 573 N 6.55 -5.15 0.26 -0.34 7.64 -0.26 -3.01 113.62 119.32 1r0x n SER 573 Ca 0.08 -0.29 0.13 0.00 1.01 0.00 0.00 58.87 59.80 1r0x n SER 573 Cb 0.46 -3.90 0.67 0.00 -1.01 0.00 0.00 64.21 60.43 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 -1.44 0.00 -3.22 1.43 0.13 -1.84 -3.34 132.00 123.73 1r0x h PRO 574 Ca -0.41 0.00 -0.80 0.00 -0.87 0.00 0.00 66.00 63.92 1r0x h PRO 574 Cb 1.28 0.00 -0.26 0.00 0.13 0.00 0.00 31.00 32.15 1r0x h PRO 574 CO 0.43 0.14 0.92 1.19 -0.23 0.00 0.00 178.00 180.45 1r0x n PHE 575 N -3.50 3.10 -2.00 1.56 3.72 -1.26 -4.68 117.46 114.39 1r0x n PHE 575 Ca -0.01 -2.92 0.04 0.00 -0.05 0.00 0.00 57.45 54.51 1r0x n PHE 575 Cb 0.29 -1.49 0.05 0.00 -0.94 0.00 0.00 39.48 37.40 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 1.93 1.91 3.78 1.37 0.00 -1.26 -4.81 105.19 108.11 1r0x n GLY 576 Ca 0.28 -0.64 -0.34 0.00 0.00 0.00 0.00 46.02 45.32 1r0x n GLY 576 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1r0x s TYR 577 N -0.83 1.76 0.17 1.61 2.02 -1.26 -4.48 117.35 116.34 1r0x s TYR 577 Ca 0.22 -1.01 0.06 0.00 -0.37 0.00 0.00 57.07 55.97 1r0x s TYR 577 Cb 0.23 -1.58 -0.01 0.00 -0.40 0.00 0.00 41.96 40.20 1r0x s TYR 577 CO -0.07 0.19 1.38 -0.07 -1.57 0.00 0.00 175.55 175.42 1r0x h LEU 578 N 1.29 0.09 -7.48 -1.29 3.38 -1.99 -3.39 115.31 105.92 1r0x h LEU 578 Ca -0.44 -0.08 -0.67 0.00 0.09 0.00 0.00 57.88 56.78 1r0x h LEU 578 Cb 1.33 -0.03 -0.07 0.00 0.09 0.00 0.00 40.66 41.98 1r0x h LEU 578 CO 0.73 0.92 2.34 -0.90 0.09 0.00 0.00 178.44 181.63 1r0x n ASP 579 N -3.56 4.62 0.11 -0.43 3.85 -1.26 -4.76 116.55 115.11 1r0x n ASP 579 Ca -0.02 -2.89 -0.17 0.00 -0.71 0.00 0.00 54.79 51.01 1r0x n ASP 579 Cb 0.82 -1.72 -0.14 0.00 -1.35 0.00 0.00 41.12 38.73 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 5.27 1.48 -0.63 2.12 3.04 -1.98 -2.43 116.25 123.13 1r0x h VAL 580 Ca 0.46 -3.03 -0.03 0.00 -1.01 0.00 0.00 66.70 63.10 1r0x h VAL 580 Cb 0.83 2.95 -0.03 0.00 -2.01 0.00 0.00 31.29 33.03 1r0x h VAL 580 CO 1.54 0.89 0.29 -0.26 -1.01 0.00 0.00 177.57 179.01 1r0x h PHE 581 N 0.08 0.91 -0.60 3.17 -1.00 -1.97 -1.29 116.94 116.26 1r0x h PHE 581 Ca -0.14 -0.05 0.04 0.00 2.81 0.00 0.00 57.97 60.62 1r0x h PHE 581 Cb 1.98 -0.28 -0.04 0.00 3.61 0.00 0.00 35.95 41.22 1r0x h PHE 581 CO 0.07 0.70 0.35 1.15 -1.61 0.00 0.00 178.31 178.97 1r0x h THR 582 N 0.86 1.03 -0.94 -1.55 2.02 -1.95 -2.26 112.91 110.12 1r0x h THR 582 Ca 0.21 -0.23 -0.00 0.00 0.77 0.00 0.00 66.41 67.16 1r0x h THR 582 Cb 0.14 0.30 -0.05 0.00 -1.74 0.00 0.00 68.15 66.80 1r0x h THR 582 CO -0.02 0.12 0.59 -0.33 0.37 0.00 0.00 175.52 176.24 1r0x h GLU 583 N 0.67 1.27 -0.45 6.66 5.08 -1.12 0.14 114.58 126.84 1r0x h GLU 583 Ca 0.25 -0.10 0.02 0.00 -1.00 0.00 0.00 59.36 58.52 1r0x h GLU 583 Cb 0.08 -0.27 -0.03 0.00 0.50 0.00 0.00 28.75 29.03 1r0x h GLU 583 CO -0.13 0.88 0.27 0.93 -1.00 0.00 0.00 179.01 179.96 1r0x h GLU 584 N 1.30 0.53 -0.49 2.33 5.08 -1.09 0.17 114.58 122.41 1r0x h GLU 584 Ca 0.34 -0.03 -0.00 0.00 -1.00 0.00 0.00 59.36 58.67 1r0x h GLU 584 Cb -0.08 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.02 1r0x h GLU 584 CO -0.07 0.35 0.30 1.96 -1.00 0.00 0.00 179.01 180.56 1r0x h GLN 585 N 0.55 0.67 -0.30 2.33 4.20 -0.78 -2.25 115.11 119.52 1r0x h GLN 585 Ca 0.18 -0.06 -0.01 0.00 0.06 0.00 0.00 58.65 58.81 1r0x h GLN 585 Cb -0.00 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 27.62 1r0x h GLN 585 CO -0.07 0.48 0.13 0.28 -0.67 0.00 0.00 178.83 178.98 1r0x h VAL 586 N 0.66 1.17 -0.50 -0.54 2.07 -0.48 0.10 116.25 118.74 1r0x h VAL 586 Ca 0.18 -0.50 0.05 0.00 0.82 0.00 0.00 66.70 67.24 1r0x h VAL 586 Cb -0.02 0.94 -0.04 0.00 -1.52 0.00 0.00 31.29 30.65 1r0x h VAL 586 CO -0.03 0.18 0.24 0.15 0.02 0.00 0.00 177.57 178.12 1r0x h PHE 587 N 0.35 0.44 0.43 1.57 3.04 -0.45 -0.94 116.94 121.39 1r0x h PHE 587 Ca 0.10 0.02 -0.02 0.00 3.98 0.00 0.00 57.97 62.05 1r0x h PHE 587 Cb 0.15 -0.13 0.00 0.00 2.56 0.00 0.00 35.95 38.54 1r0x h PHE 587 CO -0.01 0.21 -0.21 0.93 -2.02 0.00 0.00 178.31 177.21 1r0x h GLU 588 N 0.47 -0.56 -0.07 1.11 4.39 -1.16 -0.74 114.58 118.03 1r0x h GLU 588 Ca 0.22 0.04 -0.20 0.00 0.34 0.00 0.00 59.36 59.76 1r0x h GLU 588 Cb 0.14 0.13 0.01 0.00 -0.10 0.00 0.00 28.75 28.93 1r0x h GLU 588 CO -0.16 -0.29 -0.72 0.77 -1.16 0.00 0.00 179.01 177.45 1r0x h SER 589 N -0.75 0.76 0.00 1.42 0.02 -0.71 -1.39 113.55 112.90 1r0x h SER 589 Ca -0.06 -0.69 -0.05 0.00 -0.84 0.00 0.00 61.79 60.15 1r0x h SER 589 Cb 0.53 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.83 1r0x h SER 589 CO 0.10 1.33 -0.63 0.00 -1.14 0.00 0.00 176.83 176.49 1r0x h VAL 591 N -1.00 1.35 0.13 0.00 2.07 -1.12 -1.82 116.25 115.85 1r0x h VAL 591 Ca -0.08 -1.93 -0.27 0.00 0.82 0.00 0.00 66.70 65.23 1r0x h VAL 591 Cb 0.65 2.24 0.00 0.00 -1.52 0.00 0.00 31.29 32.67 1r0x h VAL 591 CO -0.05 0.59 -1.38 0.00 0.02 0.00 0.00 177.57 176.75 1r0x n LYS 593 N -3.91 0.28 -0.20 0.00 5.02 -0.53 -3.33 118.16 115.49 1r0x n LYS 593 Ca -0.24 0.30 -0.00 0.00 -2.02 0.00 0.00 58.31 56.35 1r0x n LYS 593 Cb 0.91 -1.19 0.10 0.00 -0.02 0.00 0.00 35.03 34.83 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 -0.58 0.25 -2.81 -0.35 5.85 -1.32 -1.97 115.31 114.38 1r0x h LEU 594 Ca 0.00 0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.79 1r0x h LEU 594 Cb 0.40 0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.48 1r0x h LEU 594 CO 0.00 0.15 0.00 0.23 -0.34 0.00 0.00 178.44 178.48 1r0x n MET 595 N -4.98 3.62 -0.22 1.25 2.81 -0.69 -4.62 117.12 114.29 1r0x n MET 595 Ca 0.08 -2.45 0.31 0.00 -1.81 0.00 0.00 57.70 53.84 1r0x n MET 595 Cb 0.26 -1.92 0.70 0.00 -0.71 0.00 0.00 33.22 31.55 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 3.79 2.88 -0.18 3.04 0.00 -1.35 0.37 119.26 127.81 1r0x h ALA 596 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1r0x h ALA 596 Cb 1.42 0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.29 1r0x h ALA 596 CO 0.27 -1.36 0.00 0.09 0.00 0.00 0.00 179.25 178.25 1r0x n ASN 597 N -3.88 2.87 -4.91 0.00 3.02 -1.26 -4.78 115.26 106.31 1r0x n ASN 597 Ca 0.21 -2.47 -0.31 0.00 -0.03 0.00 0.00 54.58 51.99 1r0x n ASN 597 Cb 1.18 -0.30 -0.04 0.00 -0.61 0.00 0.00 39.78 40.01 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 -1.82 3.48 -0.32 3.52 -0.14 0.12 -4.29 119.74 120.28 1r0x s LYS 598 Ca 0.24 -0.35 -0.27 0.00 -1.36 0.00 0.00 55.97 54.24 1r0x s LYS 598 Cb 0.18 -3.00 0.01 0.00 -1.68 0.00 0.00 37.83 33.34 1r0x s LYS 598 CO 0.08 0.58 0.95 0.99 -0.76 0.00 0.00 175.35 177.19 1r0x s THR 599 N -1.54 4.62 0.03 2.17 2.01 -1.25 -3.91 115.64 117.77 1r0x s THR 599 Ca 0.36 1.46 0.04 0.00 0.31 0.00 0.00 61.69 63.87 1r0x s THR 599 Cb -0.13 -4.31 -0.02 0.00 0.01 0.00 0.00 72.50 68.06 1r0x s THR 599 CO 0.27 -0.40 -0.13 0.00 -0.69 0.00 0.00 174.62 173.66 1r0x s ARG 600 N 3.37 0.93 -0.15 4.92 3.03 -0.74 -1.17 118.95 129.14 1r0x s ARG 600 Ca 0.40 -0.68 0.02 0.00 2.03 0.00 0.00 55.73 57.50 1r0x s ARG 600 Cb -0.13 -0.92 0.01 0.00 -1.03 0.00 0.00 34.95 32.88 1r0x s ARG 600 CO 0.15 0.23 -0.21 0.42 -1.13 0.00 0.00 175.30 174.76 1r0x s ILE 601 N -0.73 2.03 -0.28 4.99 1.01 0.24 -1.66 121.20 126.79 1r0x s ILE 601 Ca 0.02 -0.95 0.00 0.00 0.00 0.00 0.00 60.65 59.73 1r0x s ILE 601 Cb -0.07 -1.81 0.05 0.00 0.01 0.00 0.00 42.46 40.65 1r0x s ILE 601 CO 0.01 0.54 -0.05 -0.22 0.00 0.00 0.00 174.94 175.22 1r0x s LEU 602 N 0.99 3.71 -0.15 2.97 2.96 -0.23 -0.03 118.68 128.91 1r0x s LEU 602 Ca -0.03 -1.33 -0.29 0.00 -0.22 0.00 0.00 54.13 52.26 1r0x s LEU 602 Cb -0.15 -1.64 -0.01 0.00 0.50 0.00 0.00 46.19 44.89 1r0x s LEU 602 CO -0.06 -0.23 1.08 -0.69 -1.32 0.00 0.00 176.35 175.14 1r0x s VAL 603 N 1.19 4.59 0.12 1.68 1.01 0.37 -1.15 120.40 128.21 1r0x s VAL 603 Ca -0.07 1.90 -0.12 0.00 0.00 0.00 0.00 61.98 63.69 1r0x s VAL 603 Cb -0.20 -4.22 0.01 0.00 0.00 0.00 0.00 36.38 31.97 1r0x s VAL 603 CO -0.03 -0.08 0.29 0.28 0.00 0.00 0.00 175.10 175.57 1r0x s THR 604 N 2.63 0.10 -0.23 3.92 -1.32 -0.74 -1.10 115.64 118.91 1r0x s THR 604 Ca 0.49 -0.97 0.13 0.00 -1.21 0.00 0.00 61.69 60.13 1r0x s THR 604 Cb -0.19 -1.35 0.45 0.00 -1.51 0.00 0.00 72.50 69.90 1r0x s THR 604 CO 0.14 -0.46 1.19 -1.54 -2.21 0.00 0.00 174.62 171.74 1r0x n SER 605 N -0.15 2.95 -4.37 8.08 3.41 -1.26 -4.24 113.62 118.03 1r0x n SER 605 Ca -0.14 -3.38 -0.31 0.00 -0.26 0.00 0.00 58.87 54.78 1r0x n SER 605 Cb 0.63 -0.42 -0.15 0.00 -0.26 0.00 0.00 64.21 64.01 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 -3.11 2.15 0.07 4.33 1.02 -1.26 -4.84 119.74 118.10 1r0x s LYS 606 Ca 0.41 -0.91 -0.08 0.00 0.02 0.00 0.00 55.97 55.42 1r0x s LYS 606 Cb 0.38 -2.13 -0.27 0.00 -0.52 0.00 0.00 37.83 35.30 1r0x s LYS 606 CO -0.03 0.57 1.14 0.52 -0.92 0.00 0.00 175.35 176.62 1r0x h MET 607 N 5.23 0.38 -0.95 1.68 2.86 -1.96 -2.83 114.93 119.35 1r0x h MET 607 Ca -0.45 -0.59 0.29 0.00 -2.06 0.00 0.00 59.70 56.89 1r0x h MET 607 Cb 1.14 0.21 -0.16 0.00 0.06 0.00 0.00 31.60 32.85 1r0x h MET 607 CO 0.47 1.26 0.31 1.49 1.06 0.00 0.00 176.91 181.50 1r0x h GLU 608 N 0.13 0.15 -0.10 1.72 4.57 -1.97 0.14 114.58 119.22 1r0x h GLU 608 Ca -0.16 -0.01 -0.14 0.00 -1.18 0.00 0.00 59.36 57.87 1r0x h GLU 608 Cb 1.95 -0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 30.49 1r0x h GLU 608 CO 0.22 0.10 -0.56 0.45 -1.18 0.00 0.00 179.01 178.04 1r0x h HIS 609 N 0.15 0.37 -0.24 0.92 3.86 -1.93 -1.49 115.15 116.79 1r0x h HIS 609 Ca 0.65 -0.13 -0.05 0.00 -1.16 0.00 0.00 60.37 59.68 1r0x h HIS 609 Cb 1.44 -0.07 -0.01 0.00 1.06 0.00 0.00 27.41 29.84 1r0x h HIS 609 CO -0.22 0.78 -0.06 -0.07 0.86 0.00 0.00 177.93 179.22 1r0x h LEU 610 N 0.22 0.46 -1.44 2.43 4.07 -1.18 -2.05 115.31 117.82 1r0x h LEU 610 Ca 0.00 -0.37 0.00 0.00 0.08 0.00 0.00 57.88 57.60 1r0x h LEU 610 Cb 1.05 -0.13 0.00 0.00 1.08 0.00 0.00 40.66 42.66 1r0x h LEU 610 CO 0.09 0.72 0.00 -0.09 -1.08 0.00 0.00 178.44 178.08 1r0x h ARG 611 N 0.20 0.00 0.00 1.13 2.43 -0.62 -2.92 114.38 114.60 1r0x h ARG 611 Ca 0.06 0.00 -0.10 0.00 -0.81 0.00 0.00 59.98 59.13 1r0x h ARG 611 Cb 0.52 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.05 1r0x h ARG 611 CO 0.02 0.00 -1.95 1.63 -1.51 0.00 0.00 179.97 178.16 1r0x n LYS 612 N -2.80 0.66 -1.27 0.20 4.01 -0.57 -4.98 118.16 113.41 1r0x n LYS 612 Ca 0.00 -0.09 -0.31 0.00 -0.51 0.00 0.00 58.31 57.41 1r0x n LYS 612 Cb 0.24 -1.57 0.10 0.00 -0.51 0.00 0.00 35.03 33.28 1r0x n LYS 612 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1r0x s ALA 613 N -3.21 2.18 0.01 7.82 0.00 -0.78 -4.97 121.76 122.81 1r0x s ALA 613 Ca -0.07 0.21 -0.03 0.00 0.00 0.00 0.00 51.96 52.07 1r0x s ALA 613 Cb 0.11 -3.26 -0.28 0.00 0.00 0.00 0.00 23.12 19.70 1r0x s ALA 613 CO 0.87 -1.82 0.87 -0.44 0.00 0.00 0.00 175.76 175.24 1r0x h ASP 614 N -1.16 0.39 -5.23 0.00 3.32 -1.61 -3.45 116.42 108.68 1r0x h ASP 614 Ca -0.44 -0.53 -0.12 0.00 0.02 0.00 0.00 57.03 55.96 1r0x h ASP 614 Cb 1.24 -0.13 -0.15 0.00 0.22 0.00 0.00 39.33 40.51 1r0x h ASP 614 CO 0.52 1.44 -0.67 -0.54 -1.72 0.00 0.00 179.24 178.27 1r0x s LYS 615 N -2.62 0.60 -0.02 3.56 1.02 -0.96 -4.65 119.74 116.67 1r0x s LYS 615 Ca -0.09 -1.18 0.01 0.00 0.02 0.00 0.00 55.97 54.73 1r0x s LYS 615 Cb 0.07 0.21 0.01 0.00 -0.52 0.00 0.00 37.83 37.60 1r0x s LYS 615 CO 0.85 -0.11 -0.04 0.42 -0.92 0.00 0.00 175.35 175.55 1r0x s ILE 616 N -3.81 0.39 -0.17 2.17 1.01 -0.01 -1.04 121.20 119.75 1r0x s ILE 616 Ca 0.06 -0.12 0.01 0.00 0.00 0.00 0.00 60.65 60.60 1r0x s ILE 616 Cb 0.07 -0.39 0.02 0.00 0.01 0.00 0.00 42.46 42.17 1r0x s ILE 616 CO -0.10 0.15 -0.19 -0.22 0.00 0.00 0.00 174.94 174.59 1r0x s LEU 617 N 0.44 2.04 -0.26 2.97 0.20 0.56 -2.35 118.68 122.28 1r0x s LEU 617 Ca -0.05 -0.61 -0.07 0.00 0.69 0.00 0.00 54.13 54.09 1r0x s LEU 617 Cb -0.08 -1.42 -0.01 0.00 -0.43 0.00 0.00 46.19 44.25 1r0x s LEU 617 CO -0.00 0.00 0.07 -0.63 -0.29 0.00 0.00 176.35 175.50 1r0x s ILE 618 N 1.24 4.14 0.08 6.68 1.01 -0.36 -0.31 121.20 133.68 1r0x s ILE 618 Ca 0.03 -0.36 0.02 0.00 0.00 0.00 0.00 60.65 60.34 1r0x s ILE 618 Cb -0.13 -3.00 -0.04 0.00 0.01 0.00 0.00 42.46 39.30 1r0x s ILE 618 CO -0.11 0.26 0.12 -0.76 0.00 0.00 0.00 174.94 174.45 1r0x s LEU 619 N 1.57 3.95 -0.20 2.97 1.02 0.06 -0.28 118.68 127.76 1r0x s LEU 619 Ca 0.05 0.05 -0.05 0.00 0.02 0.00 0.00 54.13 54.21 1r0x s LEU 619 Cb -0.16 -2.60 0.10 0.00 0.02 0.00 0.00 46.19 43.55 1r0x s LEU 619 CO 0.03 0.16 0.37 -2.28 0.02 0.00 0.00 176.35 174.65 1r0x s HIS 620 N -1.44 -0.73 -0.52 0.29 5.65 0.27 -2.51 115.29 116.30 1r0x s HIS 620 Ca 0.31 1.12 -0.24 0.00 0.25 0.00 0.00 55.06 56.49 1r0x s HIS 620 Cb -0.12 0.11 0.04 0.00 -1.18 0.00 0.00 32.58 31.43 1r0x s HIS 620 CO 0.24 -0.56 0.58 1.04 -0.65 0.00 0.00 174.74 175.39 1r0x n GLN 621 N 5.37 -1.62 -0.63 2.88 6.02 -1.26 -0.68 117.38 127.47 1r0x n GLN 621 Ca -0.06 1.07 0.00 0.00 -0.01 0.00 0.00 57.00 58.00 1r0x n GLN 621 Cb 0.50 -1.85 0.00 0.00 1.02 0.00 0.00 30.24 29.90 1r0x n GLN 621 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1r0x n GLY 622 N -0.62 0.00 3.35 1.08 0.00 -0.42 -4.93 105.19 103.66 1r0x n GLY 622 Ca -0.15 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.61 1r0x n GLY 622 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1r0x s SER 623 N -1.88 2.98 -0.72 1.61 0.15 0.15 0.10 113.70 116.09 1r0x s SER 623 Ca 0.00 -0.77 -0.23 0.00 0.70 0.00 0.00 55.95 55.64 1r0x s SER 623 Cb 0.00 -0.19 0.07 0.00 -1.71 0.00 0.00 66.02 64.19 1r0x s SER 623 CO 0.00 0.09 1.07 -0.55 1.20 0.00 0.00 173.24 175.05 1r0x s SER 624 N -2.24 6.22 0.51 5.45 0.15 -1.26 0.95 113.70 123.47 1r0x s SER 624 Ca 0.13 -0.97 0.22 0.00 0.70 0.00 0.00 55.95 56.03 1r0x s SER 624 Cb -0.09 -2.46 1.35 0.00 -1.71 0.00 0.00 66.02 63.12 1r0x s SER 624 CO 0.06 -1.51 2.09 0.22 1.20 0.00 0.00 173.24 175.30 1r0x h TYR 625 N 9.63 0.00 -1.32 3.44 5.03 -0.95 -3.46 116.97 129.33 1r0x h TYR 625 Ca -0.23 0.00 0.13 0.00 2.58 0.00 0.00 58.73 61.22 1r0x h TYR 625 Cb 1.06 0.00 -0.29 0.00 1.55 0.00 0.00 36.73 39.05 1r0x h TYR 625 CO 1.03 0.11 0.69 0.12 -1.32 0.00 0.00 178.16 178.79 1r0x s PHE 626 N -4.51 -0.25 -0.12 -3.82 2.19 -1.00 -4.98 117.98 105.50 1r0x s PHE 626 Ca -0.04 0.57 -0.05 0.00 0.33 0.00 0.00 56.93 57.74 1r0x s PHE 626 Cb 0.15 0.43 0.06 0.00 -1.31 0.00 0.00 43.02 42.35 1r0x s PHE 626 CO 0.62 -0.14 0.25 -0.47 1.83 0.00 0.00 175.22 177.32 1r0x s TYR 627 N -0.11 -0.38 -3.88 10.12 5.04 -1.26 -1.22 117.35 125.66 1r0x s TYR 627 Ca 0.05 0.90 0.00 0.00 -2.44 0.00 0.00 57.07 55.58 1r0x s TYR 627 Cb -0.04 -0.01 0.00 0.00 0.35 0.00 0.00 41.96 42.26 1r0x s TYR 627 CO -0.10 -0.31 0.00 0.41 -1.34 0.00 0.00 175.55 174.22 1r0x n GLY 628 N 4.92 -0.53 3.97 8.97 0.00 -0.99 -5.00 105.19 116.53 1r0x n GLY 628 Ca -0.13 -0.88 -0.26 0.00 0.00 0.00 0.00 46.02 44.75 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 -3.37 2.03 0.04 2.61 -4.23 -1.26 -0.83 115.64 110.63 1r0x s THR 629 Ca 0.00 -0.37 -0.19 0.00 -1.18 0.00 0.00 61.69 59.94 1r0x s THR 629 Cb 0.00 -2.66 -0.15 0.00 1.34 0.00 0.00 72.50 71.03 1r0x s THR 629 CO 0.00 0.00 1.31 0.15 -0.54 0.00 0.00 174.62 175.54 1r0x h PHE 630 N -1.04 0.52 -0.30 3.99 3.57 -1.86 -2.51 116.94 119.31 1r0x h PHE 630 Ca -0.38 -0.18 0.04 0.00 3.53 0.00 0.00 57.97 60.98 1r0x h PHE 630 Cb 1.24 -0.10 -0.04 0.00 2.79 0.00 0.00 35.95 39.85 1r0x h PHE 630 CO -0.71 0.86 0.06 1.03 -2.23 0.00 0.00 178.31 177.32 1r0x h SER 631 N 0.03 0.03 -0.77 0.41 0.87 -1.97 -0.70 113.55 111.44 1r0x h SER 631 Ca 0.01 0.05 0.17 0.00 -1.23 0.00 0.00 61.79 60.79 1r0x h SER 631 Cb 0.81 0.06 -0.11 0.00 -0.44 0.00 0.00 62.40 62.72 1r0x h SER 631 CO 0.05 0.05 0.23 -0.33 -0.53 0.00 0.00 176.83 176.30 1r0x h GLU 632 N 0.18 0.30 -0.18 2.24 5.08 -1.95 -2.89 114.58 117.36 1r0x h GLU 632 Ca 0.14 -0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 58.48 1r0x h GLU 632 Cb 0.14 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.32 1r0x h GLU 632 CO -0.18 0.20 0.10 1.25 -1.00 0.00 0.00 179.01 179.38 1r0x h LEU 633 N 0.31 0.23 -1.35 1.33 5.85 -0.68 0.54 115.31 121.54 1r0x h LEU 633 Ca 0.45 -0.09 0.08 0.00 0.84 0.00 0.00 57.88 59.15 1r0x h LEU 633 Cb 0.78 -0.06 -0.05 0.00 0.37 0.00 0.00 40.66 41.70 1r0x h LEU 633 CO -0.51 0.26 0.50 1.56 -0.34 0.00 0.00 178.44 179.91 1r0x h GLN 634 N 0.19 0.73 0.00 1.25 4.20 -1.22 -1.65 115.11 118.62 1r0x h GLN 634 Ca 0.06 -0.04 -0.08 0.00 0.06 0.00 0.00 58.65 58.65 1r0x h GLN 634 Cb 0.08 -0.17 -0.01 0.00 0.30 0.00 0.00 27.48 27.68 1r0x h GLN 634 CO -0.01 0.48 -0.71 1.03 -0.67 0.00 0.00 178.83 178.96 1r0x h SER 635 N 0.75 0.00 0.59 1.46 0.87 -1.31 -3.21 113.55 112.70 1r0x h SER 635 Ca 0.34 -0.21 0.00 0.00 -1.23 0.00 0.00 61.79 60.69 1r0x h SER 635 Cb 0.35 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.31 1r0x h SER 635 CO -0.12 1.00 0.00 -0.11 -0.53 0.00 0.00 176.83 177.06 1r0x n LEU 636 N -4.57 0.42 -2.84 2.23 0.00 0.19 -3.76 117.00 108.67 1r0x n LEU 636 Ca -0.15 0.61 -0.11 0.00 0.00 0.00 0.00 56.01 56.35 1r0x n LEU 636 Cb 0.40 -0.56 0.03 0.00 0.00 0.00 0.00 43.42 43.29 1r0x n LEU 636 CO 0.14 -0.48 0.01 0.54 0.00 0.00 0.00 177.39 177.60 1r0x n ARG 637 N -1.98 1.08 0.29 1.96 5.12 -0.62 -4.99 116.66 117.53 1r0x n ARG 637 Ca 0.02 -2.87 0.17 0.00 -1.93 0.00 0.00 57.85 53.24 1r0x n ARG 637 Cb 0.19 -1.16 0.90 0.00 -1.16 0.00 0.00 32.46 31.23 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 2.83 0.00 -0.01 5.56 0.13 -1.64 -1.80 132.00 137.08 1r0x h PRO 638 Ca -0.07 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.04 1r0x h PRO 638 Cb 1.12 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.25 1r0x h PRO 638 CO 0.35 0.05 -0.09 -0.44 -0.23 0.00 0.00 178.00 177.64 1r0x h ASP 639 N 0.00 0.09 -0.17 1.44 3.45 -1.92 -1.53 116.42 117.78 1r0x h ASP 639 Ca -0.00 -0.74 0.03 0.00 0.43 0.00 0.00 57.03 56.75 1r0x h ASP 639 Cb 0.22 -0.03 -0.03 0.00 -0.56 0.00 0.00 39.33 38.94 1r0x h ASP 639 CO 0.01 0.82 0.00 0.15 -1.57 0.00 0.00 179.24 178.64 1r0x h PHE 640 N -0.63 -0.01 -0.68 4.55 3.04 -1.86 -3.12 116.94 118.24 1r0x h PHE 640 Ca -0.01 0.01 -0.01 0.00 3.98 0.00 0.00 57.97 61.94 1r0x h PHE 640 Cb 0.83 0.03 -0.03 0.00 2.56 0.00 0.00 35.95 39.33 1r0x h PHE 640 CO 0.18 -0.02 0.37 0.77 -2.02 0.00 0.00 178.31 177.59 1r0x h SER 641 N 0.06 0.84 -0.62 0.41 0.02 -1.36 -2.30 113.55 110.59 1r0x h SER 641 Ca 0.08 -0.10 -0.09 0.00 -0.84 0.00 0.00 61.79 60.85 1r0x h SER 641 Cb 0.10 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 62.40 1r0x h SER 641 CO -0.13 0.70 0.06 -1.28 -1.14 0.00 0.00 176.83 175.03 1r0x h SER 642 N 0.93 1.04 0.07 3.07 0.87 -1.28 0.14 113.55 118.39 1r0x h SER 642 Ca 0.24 -0.27 -0.00 0.00 -1.23 0.00 0.00 61.79 60.53 1r0x h SER 642 Cb 0.04 -0.28 0.00 0.00 -0.44 0.00 0.00 62.40 61.72 1r0x h SER 642 CO -0.04 1.06 -0.04 0.50 -0.53 0.00 0.00 176.83 177.78 1r0x h LYS 643 N 1.00 -0.10 0.08 2.24 1.63 -1.46 -2.12 116.57 117.83 1r0x h LYS 643 Ca 0.19 0.01 -0.00 0.00 -0.85 0.00 0.00 60.65 59.99 1r0x h LYS 643 Cb 0.49 0.02 0.00 0.00 -0.60 0.00 0.00 32.23 32.14 1r0x h LYS 643 CO 0.02 0.24 -0.04 -0.07 -3.45 0.00 0.00 179.45 176.15 1r0x h LEU 644 N -0.44 -0.09 0.00 5.20 4.07 -1.26 -1.75 115.31 121.05 1r0x h LEU 644 Ca -0.01 -0.26 0.00 0.00 0.08 0.00 0.00 57.88 57.69 1r0x h LEU 644 Cb 0.38 0.02 0.00 0.00 1.08 0.00 0.00 40.66 42.14 1r0x h LEU 644 CO 0.02 0.21 0.00 0.23 -1.08 0.00 0.00 178.44 177.82 1r0x n MET 645 N -5.00 0.17 0.35 1.13 2.81 0.46 -3.42 117.12 113.62 1r0x n MET 645 Ca -0.08 0.17 -0.14 0.00 -1.81 0.00 0.00 57.70 55.84 1r0x n MET 645 Cb 0.19 -1.50 -0.07 0.00 -0.71 0.00 0.00 33.22 31.13 1r0x n MET 645 CO 0.00 0.00 0.00 0.78 1.51 0.00 0.00 175.97 178.26 1r0x h GLY 646 N 1.79 -0.95 -5.31 3.03 0.00 -0.59 -3.45 103.07 97.58 1r0x h GLY 646 Ca 0.00 0.35 -0.68 0.00 0.00 0.00 0.00 47.33 47.00 1r0x h GLY 646 CO 0.00 -0.35 0.26 -1.72 0.00 0.00 0.00 176.54 174.74 1r0x n TYR 647 N -5.08 1.19 0.09 5.60 4.02 -1.22 -4.94 117.16 116.82 1r0x n TYR 647 Ca -0.11 0.73 -0.12 0.00 -0.01 0.00 0.00 57.90 58.39 1r0x n TYR 647 Cb 0.36 -2.26 -0.05 0.00 -0.02 0.00 0.00 39.34 37.37 1r0x n TYR 647 CO 0.00 0.00 0.00 -0.44 -1.01 0.00 0.00 176.86 175.41 1r0x h ASP 648 N 3.61 -0.54 -2.05 7.72 3.32 -1.92 -3.37 116.42 123.19 1r0x h ASP 648 Ca -0.45 0.07 -0.50 0.00 0.02 0.00 0.00 57.03 56.16 1r0x h ASP 648 Cb 1.36 0.21 -0.40 0.00 0.22 0.00 0.00 39.33 40.72 1r0x h ASP 648 CO 0.71 -0.27 -1.07 0.35 -1.72 0.00 0.00 179.24 177.25 1r0x n THR 649 N -5.32 0.62 -0.29 0.35 -2.24 -1.26 -4.92 114.28 101.23 1r0x n THR 649 Ca -0.06 -4.80 0.09 0.00 -2.27 0.00 0.00 64.05 57.01 1r0x n THR 649 Cb 0.23 -0.52 0.24 0.00 -2.10 0.00 0.00 70.33 68.19 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 2.99 0.61 0.00 4.78 3.57 -1.92 -2.38 116.94 124.60 1r0x h PHE 650 Ca 0.11 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.64 1r0x h PHE 650 Cb 0.86 -0.14 0.00 0.00 2.79 0.00 0.00 35.95 39.46 1r0x h PHE 650 CO 0.55 0.04 0.00 -0.44 -2.23 0.00 0.00 178.31 176.23 1r0x h ASP 651 N 0.46 0.00 -0.23 0.41 5.19 -1.91 -1.72 116.42 118.62 1r0x h ASP 651 Ca 0.48 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.89 1r0x h ASP 651 Cb 0.80 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.31 1r0x h ASP 651 CO -0.45 0.00 0.00 0.00 -3.12 0.00 0.00 179.24 175.67 1r0x n GLN 652 N -2.30 2.15 -1.53 3.56 6.02 -0.90 -4.92 117.38 119.46 1r0x n GLN 652 Ca -0.00 -1.98 -0.31 0.00 -0.01 0.00 0.00 57.00 54.70 1r0x n GLN 652 Cb 0.12 -1.43 0.06 0.00 1.02 0.00 0.00 30.24 30.01 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 -1.48 3.02 0.74 1.08 2.99 -0.65 -5.02 117.98 118.66 1r0x s PHE 653 Ca 0.30 1.40 -0.15 0.00 0.00 0.00 0.00 56.93 58.47 1r0x s PHE 653 Cb 0.19 -2.93 0.04 0.00 0.00 0.00 0.00 43.02 40.32 1r0x s PHE 653 CO 0.27 -1.37 1.25 0.95 -0.00 0.00 0.00 175.22 176.32 1r0x s THR 654 N -3.04 2.02 0.31 0.64 -4.23 -1.26 -4.74 115.64 105.33 1r0x s THR 654 Ca 0.59 0.01 0.07 0.00 -1.18 0.00 0.00 61.69 61.18 1r0x s THR 654 Cb -0.14 -2.68 0.31 0.00 1.34 0.00 0.00 72.50 71.33 1r0x s THR 654 CO 0.55 -0.00 1.78 -0.08 -0.54 0.00 0.00 174.62 176.33 1r0x h GLU 655 N -0.26 0.71 -0.31 3.99 4.22 -1.89 -1.61 114.58 119.42 1r0x h GLU 655 Ca -0.48 -0.04 -0.01 0.00 0.08 0.00 0.00 59.36 58.91 1r0x h GLU 655 Cb 1.32 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 30.39 1r0x h GLU 655 CO 0.49 0.47 0.16 1.49 -2.18 0.00 0.00 179.01 179.44 1r0x h GLU 656 N 0.73 0.44 0.20 1.92 4.81 -1.91 -1.29 114.58 119.48 1r0x h GLU 656 Ca 0.57 -0.06 -0.01 0.00 -0.13 0.00 0.00 59.36 59.74 1r0x h GLU 656 Cb 0.94 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 30.24 1r0x h GLU 656 CO -0.37 0.39 -0.10 -0.09 -0.73 0.00 0.00 179.01 178.12 1r0x h ARG 657 N 0.38 -0.26 -0.82 1.92 2.43 -1.81 -1.25 114.38 114.97 1r0x h ARG 657 Ca 0.11 0.02 0.16 0.00 -0.81 0.00 0.00 59.98 59.45 1r0x h ARG 657 Cb 0.09 0.06 -0.15 0.00 -0.42 0.00 0.00 29.97 29.54 1r0x h ARG 657 CO -0.02 0.01 -0.24 0.00 -1.51 0.00 0.00 179.97 178.22 1r0x h ARG 658 N -0.50 -0.02 0.00 0.20 3.08 -1.33 0.11 114.38 115.92 1r0x h ARG 658 Ca -0.03 0.00 -0.11 0.00 0.07 0.00 0.00 59.98 59.91 1r0x h ARG 658 Cb 0.38 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.42 1r0x h ARG 658 CO 0.04 -0.01 -0.54 0.77 -1.07 0.00 0.00 179.97 179.16 1r0x h SER 659 N -0.02 0.00 -0.20 7.04 0.02 -1.11 -1.86 113.55 117.42 1r0x h SER 659 Ca 0.38 0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 61.29 1r0x h SER 659 Cb 0.60 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.13 1r0x h SER 659 CO -0.85 0.54 -0.03 0.28 -1.14 0.00 0.00 176.83 175.63 1r0x h SER 660 N 0.00 0.37 -0.68 3.07 0.02 -0.44 -1.03 113.55 114.86 1r0x h SER 660 Ca -0.01 -0.35 0.01 0.00 -0.84 0.00 0.00 61.79 60.61 1r0x h SER 660 Cb 0.96 -0.10 -0.04 0.00 0.14 0.00 0.00 62.40 63.36 1r0x h SER 660 CO 0.07 0.63 0.45 0.40 -1.14 0.00 0.00 176.83 177.24 1r0x h ILE 661 N 0.11 1.16 -0.37 3.27 2.04 -0.90 0.29 117.51 123.11 1r0x h ILE 661 Ca 0.05 -0.31 -0.03 0.00 1.00 0.00 0.00 64.86 65.57 1r0x h ILE 661 Cb 0.46 0.17 -0.02 0.00 -0.74 0.00 0.00 36.82 36.69 1r0x h ILE 661 CO 0.02 0.17 0.10 -0.07 0.00 0.00 0.00 178.15 178.36 1r0x h LEU 662 N 0.91 0.56 0.15 1.44 3.38 -1.31 0.30 115.31 120.73 1r0x h LEU 662 Ca 0.25 -0.22 0.01 0.00 0.09 0.00 0.00 57.88 58.01 1r0x h LEU 662 Cb -0.09 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.50 1r0x h LEU 662 CO -0.06 0.63 -0.16 0.74 0.09 0.00 0.00 178.44 179.68 1r0x h THR 663 N 0.45 0.64 -0.36 0.22 2.02 -0.51 -1.02 112.91 114.35 1r0x h THR 663 Ca 0.12 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.31 1r0x h THR 663 Cb 0.29 0.64 -0.02 0.00 -1.74 0.00 0.00 68.15 67.32 1r0x h THR 663 CO -0.00 0.00 0.22 -0.33 0.37 0.00 0.00 175.52 175.78 1r0x h GLU 664 N -0.34 0.43 -0.86 6.66 5.08 -0.29 -1.75 114.58 123.50 1r0x h GLU 664 Ca 0.01 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.34 1r0x h GLU 664 Cb 0.33 -0.10 -0.04 0.00 0.50 0.00 0.00 28.75 29.45 1r0x h GLU 664 CO -0.05 0.28 0.51 1.15 -1.00 0.00 0.00 179.01 179.90 1r0x h THR 665 N 0.44 1.24 0.00 1.13 2.02 -0.26 -2.27 112.91 115.21 1r0x h THR 665 Ca 0.14 -0.53 -0.14 0.00 0.77 0.00 0.00 66.41 66.65 1r0x h THR 665 Cb -0.00 0.04 -0.02 0.00 -1.74 0.00 0.00 68.15 66.43 1r0x h THR 665 CO -0.06 0.25 -0.66 -0.07 0.37 0.00 0.00 175.52 175.35 1r0x h LEU 666 N 1.18 0.00 -0.48 2.58 4.07 -0.71 -2.56 115.31 119.39 1r0x h LEU 666 Ca 0.31 0.00 -0.12 0.00 0.08 0.00 0.00 57.88 58.14 1r0x h LEU 666 Cb -0.04 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 41.69 1r0x h LEU 666 CO -0.06 0.66 -0.18 0.03 -1.08 0.00 0.00 178.44 177.81 1r0x h ARG 667 N 0.00 0.97 0.84 1.13 3.08 -0.94 -3.27 114.38 116.20 1r0x h ARG 667 Ca -0.01 -0.40 -0.04 0.00 0.07 0.00 0.00 59.98 59.60 1r0x h ARG 667 Cb 1.26 -0.04 0.01 0.00 0.08 0.00 0.00 29.97 31.28 1r0x h ARG 667 CO 0.09 1.07 -0.41 0.00 -1.07 0.00 0.00 179.97 179.65 1r0x h ARG 668 N 0.82 -1.09 -2.16 0.04 3.08 -1.25 -3.30 114.38 110.52 1r0x h ARG 668 Ca 0.11 0.07 -0.49 0.00 0.07 0.00 0.00 59.98 59.75 1r0x h ARG 668 Cb 0.76 0.25 -0.13 0.00 0.08 0.00 0.00 29.97 30.92 1r0x h ARG 668 CO 0.06 -0.73 0.79 1.19 -1.07 0.00 0.00 179.97 180.21 1r0x n PHE 669 N -5.18 1.50 0.00 3.04 3.72 -0.98 -5.13 117.46 114.43 1r0x n PHE 669 Ca -0.14 -2.07 0.00 0.00 -0.05 0.00 0.00 57.45 55.19 1r0x n PHE 669 Cb 0.45 -1.57 0.00 0.00 -0.94 0.00 0.00 39.48 37.42 1r0x n PHE 669 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14