#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 1.55 2.83 1.09 0.00 -1.26 -4.21 105.19 105.19 1r0x n GLY 391 Ca 0.00 -2.06 -0.14 0.00 0.00 0.00 0.00 46.02 43.82 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 0.88 0.01 -0.01 -0.61 2.07 -0.11 -4.45 121.20 118.98 1r0x s ILE 392 Ca 0.00 0.09 0.04 0.00 -1.41 0.00 0.00 60.65 59.37 1r0x s ILE 392 Cb 0.00 -0.08 -0.01 0.00 0.13 0.00 0.00 42.46 42.50 1r0x s ILE 392 CO 0.00 0.06 -0.14 -0.63 -1.91 0.00 0.00 174.94 172.32 1r0x s ILE 393 N 0.53 1.10 -0.15 2.00 1.01 -0.40 -0.77 121.20 124.51 1r0x s ILE 393 Ca -0.05 -0.63 0.01 0.00 0.00 0.00 0.00 60.65 59.98 1r0x s ILE 393 Cb -0.07 -0.92 0.02 0.00 0.01 0.00 0.00 42.46 41.50 1r0x s ILE 393 CO -0.01 0.28 -0.17 -0.04 0.00 0.00 0.00 174.94 175.00 1r0x s MET 394 N -0.40 2.55 -0.35 2.79 -1.94 -0.23 -0.11 119.30 121.60 1r0x s MET 394 Ca 0.05 -0.66 -0.07 0.00 -1.71 0.00 0.00 55.69 53.29 1r0x s MET 394 Cb -0.06 -2.23 0.04 0.00 2.01 0.00 0.00 34.83 34.59 1r0x s MET 394 CO -0.00 -0.18 0.13 -1.21 -0.01 0.00 0.00 175.02 173.75 1r0x s GLU 395 N 1.28 2.65 -1.25 2.03 2.02 0.76 -2.03 118.70 124.16 1r0x s GLU 395 Ca 0.02 -1.18 -0.26 0.00 0.02 0.00 0.00 54.97 53.57 1r0x s GLU 395 Cb -0.13 -3.53 0.03 0.00 0.10 0.00 0.00 34.13 30.60 1r0x s GLU 395 CO -0.09 -0.69 0.61 -1.71 0.02 0.00 0.00 175.26 173.40 1r0x n ASN 396 N 4.85 -3.53 -4.75 -0.19 2.85 -1.08 -0.17 115.26 113.24 1r0x n ASN 396 Ca -0.12 -1.23 -0.39 0.00 -0.11 0.00 0.00 54.58 52.73 1r0x n ASN 396 Cb 0.45 -2.09 -0.05 0.00 1.24 0.00 0.00 39.78 39.32 1r0x n ASN 396 CO 0.00 0.00 0.00 -0.69 -2.11 0.00 0.00 177.26 174.46 1r0x s VAL 397 N -3.65 4.96 -0.03 3.44 1.01 -0.65 -3.75 120.40 121.73 1r0x s VAL 397 Ca 0.40 1.26 0.03 0.00 0.00 0.00 0.00 61.98 63.67 1r0x s VAL 397 Cb -0.20 -3.94 0.00 0.00 0.00 0.00 0.00 36.38 32.23 1r0x s VAL 397 CO 0.95 0.38 -0.10 -0.89 0.00 0.00 0.00 175.10 175.44 1r0x s THR 398 N 0.08 0.86 -0.07 3.92 2.01 -0.56 -0.79 115.64 121.09 1r0x s THR 398 Ca 0.32 -0.41 0.02 0.00 0.31 0.00 0.00 61.69 61.93 1r0x s THR 398 Cb -0.18 -0.75 0.02 0.00 0.01 0.00 0.00 72.50 71.59 1r0x s THR 398 CO 0.17 0.26 -0.11 0.00 -0.69 0.00 0.00 174.62 174.25 1r0x s ALA 399 N 0.12 1.20 0.13 7.40 0.00 -0.39 -1.76 121.76 128.46 1r0x s ALA 399 Ca -0.02 -0.38 -0.05 0.00 0.00 0.00 0.00 51.96 51.50 1r0x s ALA 399 Cb -0.08 -0.59 -0.06 0.00 0.00 0.00 0.00 23.12 22.39 1r0x s ALA 399 CO 0.01 0.04 0.38 -0.06 0.00 0.00 0.00 175.76 176.12 1r0x s PHE 400 N 0.81 3.49 -0.03 0.00 0.08 -1.26 -0.29 117.98 120.78 1r0x s PHE 400 Ca -0.12 0.59 -0.37 0.00 0.12 0.00 0.00 56.93 57.14 1r0x s PHE 400 Cb -0.15 -2.02 -0.16 0.00 -0.57 0.00 0.00 43.02 40.11 1r0x s PHE 400 CO 0.02 0.45 1.52 0.91 -0.10 0.00 0.00 175.22 178.02 1r0x n TRP 401 N 0.23 1.78 -4.27 0.36 7.02 -0.62 -4.76 117.44 117.18 1r0x n TRP 401 Ca -0.03 0.55 -0.17 0.00 -1.02 0.00 0.00 57.50 56.82 1r0x n TRP 401 Cb 0.52 -2.41 -0.11 0.00 -2.42 0.00 0.00 31.31 26.90 1r0x n TRP 401 CO 0.00 0.00 0.00 -1.21 -2.02 0.00 0.00 177.69 174.46 1r0x s GLU 402 N 1.68 1.11 0.23 -0.99 0.41 -1.26 -4.64 118.70 115.25 1r0x s GLU 402 Ca 0.89 -1.38 -0.31 0.00 -0.41 0.00 0.00 54.97 53.75 1r0x s GLU 402 Cb -0.96 -0.89 -0.12 0.00 -1.78 0.00 0.00 34.13 30.38 1r0x s GLU 402 CO 0.52 0.15 1.69 -1.91 -0.49 0.00 0.00 175.26 175.23 1r0x n GLU 403 N 0.12 2.77 0.00 1.61 2.13 -1.26 -2.13 120.64 123.87 1r0x n GLU 403 Ca -0.12 0.99 0.00 0.00 0.66 0.00 0.00 57.16 58.69 1r0x n GLU 403 Cb 0.59 -2.82 0.00 0.00 0.27 0.00 0.00 31.44 29.47 1r0x n GLU 403 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1r0x n GLY 404 N 3.47 3.10 0.23 8.31 0.00 -1.26 -4.88 105.19 114.16 1r0x n GLY 404 Ca 0.14 -0.95 -0.03 0.00 0.00 0.00 0.00 46.02 45.17 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 0.59 -0.81 1.61 3.04 -1.78 0.44 116.94 120.02 1r0x h PHE 405 Ca 0.00 0.02 0.09 0.00 3.98 0.00 0.00 57.97 62.06 1r0x h PHE 405 Cb 0.00 -0.18 -0.07 0.00 2.56 0.00 0.00 35.95 38.26 1r0x h PHE 405 CO 0.00 0.30 0.46 0.78 -2.02 0.00 0.00 178.31 177.83 1r0x h GLY 406 N 0.61 1.25 1.05 2.40 0.00 -1.90 0.24 103.07 106.72 1r0x h GLY 406 Ca 0.26 -0.31 -0.14 0.00 0.00 0.00 0.00 47.33 47.13 1r0x h GLY 406 CO -0.16 0.14 -0.36 0.83 0.00 0.00 0.00 176.54 176.99 1r0x h GLU 407 N 0.79 0.81 -0.23 4.80 4.39 -1.48 -1.80 114.58 121.85 1r0x h GLU 407 Ca 0.39 -0.44 0.05 0.00 0.34 0.00 0.00 59.36 59.69 1r0x h GLU 407 Cb 0.34 0.02 -0.04 0.00 -0.10 0.00 0.00 28.75 28.97 1r0x h GLU 407 CO -0.24 1.08 -0.06 1.25 -1.16 0.00 0.00 179.01 179.88 1r0x h LEU 408 N 0.58 -0.21 -2.07 1.33 7.12 0.40 -1.67 115.31 120.79 1r0x h LEU 408 Ca 0.04 0.07 -0.00 0.00 0.13 0.00 0.00 57.88 58.12 1r0x h LEU 408 Cb 0.95 0.14 -0.00 0.00 -0.53 0.00 0.00 40.66 41.22 1r0x h LEU 408 CO 0.09 -0.07 -0.01 -0.07 -0.13 0.00 0.00 178.44 178.25 1r0x h LEU 409 N -0.00 0.00 -1.68 2.25 3.38 -0.41 -2.40 115.31 116.45 1r0x h LEU 409 Ca 0.11 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.08 1r0x h LEU 409 Cb 0.16 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.91 1r0x h LEU 409 CO -0.23 0.01 0.00 -0.62 0.09 0.00 0.00 178.44 177.68 1r0x n GLU 410 N -4.41 0.58 0.00 1.13 1.02 -0.63 -5.09 120.64 113.25 1r0x n GLU 410 Ca -0.03 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.11 1r0x n GLU 410 Cb 0.09 -1.23 0.00 0.00 -0.02 0.00 0.00 31.44 30.28 1r0x n GLU 410 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1r0x n LYS 411 N 0.55 0.00 -2.96 3.49 4.01 -0.91 -5.06 118.16 117.28 1r0x n LYS 411 Ca 0.00 -0.25 -0.40 0.00 -0.51 0.00 0.00 58.31 57.15 1r0x n LYS 411 Cb 0.25 -0.35 -0.05 0.00 -0.51 0.00 0.00 35.03 34.37 1r0x n LYS 411 CO 0.00 0.00 0.00 0.45 -1.11 0.00 0.00 177.40 176.74 1r0x s SER 429 N 0.00 7.26 0.34 4.39 0.15 -1.26 -4.77 113.70 119.80 1r0x s SER 429 Ca 0.00 1.50 0.07 0.00 0.70 0.00 0.00 55.95 58.23 1r0x s SER 429 Cb 0.00 -2.48 0.61 0.00 -1.71 0.00 0.00 66.02 62.44 1r0x s SER 429 CO 0.00 0.03 1.82 -0.26 1.20 0.00 0.00 173.24 176.03 1r0x h PHE 430 N 5.50 0.32 -0.44 3.44 0.04 -2.00 -2.51 116.94 121.30 1r0x h PHE 430 Ca -0.44 -0.06 -0.07 0.00 2.80 0.00 0.00 57.97 60.20 1r0x h PHE 430 Cb 1.21 -0.08 -0.02 0.00 2.20 0.00 0.00 35.95 39.25 1r0x h PHE 430 CO 0.65 0.51 -0.01 0.66 -0.60 0.00 0.00 178.31 179.52 1r0x h SER 431 N 0.27 0.68 -0.37 2.17 4.64 -1.98 -0.79 113.55 118.16 1r0x h SER 431 Ca 0.05 -0.16 -0.02 0.00 -0.47 0.00 0.00 61.79 61.19 1r0x h SER 431 Cb 0.55 -0.18 -0.02 0.00 -0.31 0.00 0.00 62.40 62.45 1r0x h SER 431 CO 0.04 0.76 0.16 0.45 -0.87 0.00 0.00 176.83 177.36 1r0x h HIS 432 N 0.67 0.56 -0.74 4.77 3.86 -1.89 0.29 115.15 122.67 1r0x h HIS 432 Ca 0.13 -0.04 -0.01 0.00 -1.16 0.00 0.00 60.37 59.29 1r0x h HIS 432 Cb 0.43 -0.17 -0.04 0.00 1.06 0.00 0.00 27.41 28.69 1r0x h HIS 432 CO 0.02 0.50 0.42 -0.07 0.86 0.00 0.00 177.93 179.66 1r0x h LEU 433 N 0.46 0.90 -0.53 2.43 3.38 -1.33 -1.95 115.31 118.67 1r0x h LEU 433 Ca 0.13 -0.06 -0.14 0.00 0.09 0.00 0.00 57.88 57.90 1r0x h LEU 433 Cb 0.17 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 1r0x h LEU 433 CO -0.01 0.71 -0.31 0.00 0.09 0.00 0.00 178.44 178.92 1r0x h LEU 435 N 0.73 0.91 -0.55 0.00 4.07 -0.28 -3.09 115.31 117.10 1r0x h LEU 435 Ca 0.08 -0.22 0.00 0.00 0.08 0.00 0.00 57.88 57.82 1r0x h LEU 435 Cb 0.86 -0.24 0.00 0.00 1.08 0.00 0.00 40.66 42.36 1r0x h LEU 435 CO 0.08 0.94 -0.16 0.52 -1.08 0.00 0.00 178.44 178.73 1r0x n VAL 436 N -4.21 0.00 -2.93 1.22 0.31 -0.80 -4.95 118.33 106.96 1r0x n VAL 436 Ca 0.03 -0.14 -0.11 0.00 -0.01 0.00 0.00 64.34 64.11 1r0x n VAL 436 Cb 0.30 0.32 0.06 0.00 -0.91 0.00 0.00 33.84 33.60 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 1.28 -0.15 3.79 2.92 0.00 -1.12 -5.00 105.19 106.91 1r0x n GLY 437 Ca 0.14 -0.04 -0.38 0.00 0.00 0.00 0.00 46.02 45.75 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 -3.84 6.70 0.19 1.61 0.01 -1.11 -4.96 114.94 113.54 1r0x s ASN 438 Ca 0.04 0.84 -0.30 0.00 -0.71 0.00 0.00 52.86 52.72 1r0x s ASN 438 Cb -0.00 -2.25 -0.08 0.00 0.41 0.00 0.00 41.25 39.33 1r0x s ASN 438 CO 0.50 0.20 1.23 -2.16 -1.51 0.00 0.00 177.10 175.36 1r0x s PRO 439 N -0.35 4.46 0.05 -0.60 0.04 -1.26 -1.59 135.00 135.74 1r0x s PRO 439 Ca 0.23 1.93 0.01 0.00 0.04 0.00 0.00 61.00 63.21 1r0x s PRO 439 Cb -0.16 -3.23 -0.25 0.00 0.04 0.00 0.00 34.50 30.90 1r0x s PRO 439 CO 0.11 -0.15 1.01 -0.24 0.04 0.00 0.00 177.00 177.77 1r0x h VAL 440 N 3.77 1.35 -3.71 -0.36 3.04 -0.95 -3.46 116.25 115.94 1r0x h VAL 440 Ca -0.44 -3.02 -0.24 0.00 -1.01 0.00 0.00 66.70 61.98 1r0x h VAL 440 Cb 1.21 2.78 -0.29 0.00 -2.01 0.00 0.00 31.29 32.99 1r0x h VAL 440 CO 0.76 0.84 -0.72 -0.76 -1.01 0.00 0.00 177.57 176.67 1r0x s LEU 441 N -6.83 1.88 -0.06 3.16 1.43 -1.06 -4.29 118.68 112.92 1r0x s LEU 441 Ca -0.05 0.00 0.00 0.00 -1.03 0.00 0.00 54.13 53.06 1r0x s LEU 441 Cb 0.08 -0.02 0.02 0.00 0.03 0.00 0.00 46.19 46.30 1r0x s LEU 441 CO 0.85 -0.01 -0.04 -0.75 0.23 0.00 0.00 176.35 176.62 1r0x s LYS 442 N 0.13 0.86 -1.24 1.70 2.20 -0.20 -1.26 119.74 121.93 1r0x s LYS 442 Ca -0.01 -0.08 -0.08 0.00 -0.36 0.00 0.00 55.97 55.44 1r0x s LYS 442 Cb -0.02 -0.95 -0.01 0.00 -1.51 0.00 0.00 37.83 35.34 1r0x s LYS 442 CO -0.00 -0.14 0.70 0.09 -0.36 0.00 0.00 175.35 175.63 1r0x n ASN 443 N 4.37 -2.96 -4.71 1.43 3.02 -0.72 -4.34 115.26 111.35 1r0x n ASN 443 Ca -0.20 -0.91 -0.40 0.00 -0.03 0.00 0.00 54.58 53.04 1r0x n ASN 443 Cb 0.51 -3.76 -0.04 0.00 -0.61 0.00 0.00 39.78 35.87 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 -3.62 5.00 -0.02 2.41 -1.09 0.03 -4.72 121.20 119.18 1r0x s ILE 444 Ca 0.21 1.57 0.05 0.00 -2.23 0.00 0.00 60.65 60.25 1r0x s ILE 444 Cb -0.06 -4.10 -0.01 0.00 -1.58 0.00 0.00 42.46 36.71 1r0x s ILE 444 CO 0.84 0.21 -0.17 0.20 -1.23 0.00 0.00 174.94 174.79 1r0x s ASN 445 N 0.87 1.99 -0.00 3.58 0.01 -1.26 -1.64 114.94 118.49 1r0x s ASN 445 Ca 0.40 -0.31 -0.28 0.00 -0.71 0.00 0.00 52.86 51.96 1r0x s ASN 445 Cb -0.18 -0.30 0.09 0.00 0.41 0.00 0.00 41.25 41.27 1r0x s ASN 445 CO 0.19 0.19 0.76 -1.48 -1.51 0.00 0.00 177.10 175.25 1r0x s LEU 446 N -0.29 -0.52 -0.27 0.60 0.05 -0.86 -4.95 118.68 112.44 1r0x s LEU 446 Ca 0.04 0.32 -0.01 0.00 0.05 0.00 0.00 54.13 54.54 1r0x s LEU 446 Cb -0.08 2.33 0.15 0.00 -2.05 0.00 0.00 46.19 46.54 1r0x s LEU 446 CO -0.00 -0.66 0.40 0.21 -0.55 0.00 0.00 176.35 175.75 1r0x s ASN 447 N -1.86 0.24 -0.12 1.48 3.84 -1.26 -1.07 114.94 116.20 1r0x s ASN 447 Ca -0.03 -0.02 0.03 0.00 0.21 0.00 0.00 52.86 53.05 1r0x s ASN 447 Cb -0.01 1.15 0.01 0.00 -0.55 0.00 0.00 41.25 41.86 1r0x s ASN 447 CO -0.02 -0.32 -0.21 -0.63 -2.79 0.00 0.00 177.10 173.13 1r0x s ILE 448 N 2.56 1.95 0.53 -5.21 -1.09 0.05 -4.99 121.20 114.99 1r0x s ILE 448 Ca 0.12 -0.93 -0.14 0.00 -2.23 0.00 0.00 60.65 57.47 1r0x s ILE 448 Cb -0.14 -1.71 -0.06 0.00 -1.58 0.00 0.00 42.46 38.96 1r0x s ILE 448 CO -0.23 0.53 0.96 -1.61 -1.23 0.00 0.00 174.94 173.36 1r0x s GLU 449 N 0.67 3.81 -0.25 2.79 0.41 -1.26 -0.93 118.70 123.93 1r0x s GLU 449 Ca -0.11 0.79 -0.35 0.00 -0.41 0.00 0.00 54.97 54.89 1r0x s GLU 449 Cb -0.16 -2.17 -0.16 0.00 -1.78 0.00 0.00 34.13 29.86 1r0x s GLU 449 CO 0.02 -0.32 1.10 1.63 -0.49 0.00 0.00 175.26 177.20 1r0x n LYS 450 N -1.90 0.00 -0.31 1.61 5.02 -1.26 -1.06 118.16 120.26 1r0x n LYS 450 Ca 0.05 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.34 1r0x n LYS 450 Cb 0.54 -1.17 0.00 0.00 -0.02 0.00 0.00 35.03 34.38 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 2.42 1.17 3.92 0.72 0.00 -1.26 -4.88 105.19 107.27 1r0x n GLY 451 Ca 0.21 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.97 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 -0.45 3.44 -0.19 1.61 2.02 -0.22 -4.42 118.70 120.50 1r0x s GLU 452 Ca 0.00 0.02 -0.05 0.00 0.02 0.00 0.00 54.97 54.97 1r0x s GLU 452 Cb 0.00 -2.44 -0.03 0.00 0.10 0.00 0.00 34.13 31.77 1r0x s GLU 452 CO 0.00 -0.19 -0.01 1.41 0.02 0.00 0.00 175.26 176.49 1r0x s MET 453 N -4.67 3.64 -0.24 1.61 -2.45 -1.26 -1.02 119.30 114.92 1r0x s MET 453 Ca 0.47 -0.52 -0.09 0.00 -1.25 0.00 0.00 55.69 54.30 1r0x s MET 453 Cb -0.10 -3.03 -0.04 0.00 1.25 0.00 0.00 34.83 32.91 1r0x s MET 453 CO 0.43 0.09 0.11 -1.17 1.05 0.00 0.00 175.02 175.52 1r0x s LEU 454 N 0.79 3.78 -0.23 4.11 0.20 0.10 -1.42 118.68 126.02 1r0x s LEU 454 Ca -0.00 -0.03 -0.18 0.00 0.69 0.00 0.00 54.13 54.60 1r0x s LEU 454 Cb -0.14 -2.01 -0.03 0.00 -0.43 0.00 0.00 46.19 43.58 1r0x s LEU 454 CO 0.02 0.04 0.52 0.00 -0.29 0.00 0.00 176.35 176.64 1r0x s ALA 455 N 1.21 3.57 -0.20 5.97 0.00 -0.61 -1.05 121.76 130.64 1r0x s ALA 455 Ca 0.06 -0.48 -0.08 0.00 0.00 0.00 0.00 51.96 51.45 1r0x s ALA 455 Cb -0.14 -2.85 -0.04 0.00 0.00 0.00 0.00 23.12 20.08 1r0x s ALA 455 CO 0.05 -0.58 0.09 0.42 0.00 0.00 0.00 175.76 175.74 1r0x s ILE 456 N 1.94 4.89 0.13 0.00 1.01 0.33 -1.16 121.20 128.35 1r0x s ILE 456 Ca 0.23 0.01 0.02 0.00 0.00 0.00 0.00 60.65 60.91 1r0x s ILE 456 Cb -0.15 -3.23 -0.01 0.00 0.01 0.00 0.00 42.46 39.08 1r0x s ILE 456 CO 0.09 0.43 0.08 1.07 0.00 0.00 0.00 174.94 176.60 1r0x n THR 457 N 3.81 0.00 -3.88 2.92 5.66 -0.19 -0.54 114.28 122.07 1r0x n THR 457 Ca -0.16 -0.84 0.00 0.00 -3.05 0.00 0.00 64.05 60.00 1r0x n THR 457 Cb 0.52 0.37 0.00 0.00 -1.55 0.00 0.00 70.33 69.67 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 0.45 -0.68 3.93 1.09 0.00 -1.26 -0.95 105.19 107.76 1r0x n GLY 458 Ca 0.01 -1.17 -0.26 0.00 0.00 0.00 0.00 46.02 44.59 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 4.90 0.30 1.61 1.04 -0.71 -4.66 113.70 112.19 1r0x s SER 459 Ca 0.00 0.47 -0.29 0.00 0.48 0.00 0.00 55.95 56.61 1r0x s SER 459 Cb 0.00 -1.16 -0.10 0.00 0.10 0.00 0.00 66.02 64.86 1r0x s SER 459 CO 0.00 -1.54 1.22 0.42 0.98 0.00 0.00 173.24 174.33 1r0x s THR 460 N -3.21 3.06 -1.35 2.02 -4.23 -1.26 -2.79 115.64 107.87 1r0x s THR 460 Ca 0.59 1.06 -0.07 0.00 -1.18 0.00 0.00 61.69 62.09 1r0x s THR 460 Cb -0.11 -3.67 0.01 0.00 1.34 0.00 0.00 72.50 70.07 1r0x s THR 460 CO 0.45 0.25 0.92 0.61 -0.54 0.00 0.00 174.62 176.30 1r0x n GLY 461 N 1.04 -0.46 0.06 3.99 0.00 -1.26 -4.91 105.19 103.65 1r0x n GLY 461 Ca -0.00 0.16 0.11 0.00 0.00 0.00 0.00 46.02 46.29 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 -2.58 0.84 0.00 1.61 3.41 -1.12 -4.69 113.62 111.09 1r0x n SER 462 Ca -0.04 -0.67 0.00 0.00 -0.26 0.00 0.00 58.87 57.90 1r0x n SER 462 Cb 0.58 0.51 0.00 0.00 -0.26 0.00 0.00 64.21 65.04 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 1.48 1.59 0.42 5.00 0.00 -1.26 -1.12 105.19 111.30 1r0x n GLY 463 Ca 0.06 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.92 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 0.43 -1.01 -0.45 1.61 1.57 -1.92 0.83 116.57 117.63 1r0x h LYS 464 Ca 0.00 0.07 0.07 0.00 -1.87 0.00 0.00 60.65 58.92 1r0x h LYS 464 Cb 0.00 0.23 -0.06 0.00 0.08 0.00 0.00 32.23 32.48 1r0x h LYS 464 CO 0.00 -0.68 0.09 1.15 -0.57 0.00 0.00 179.45 179.45 1r0x h THR 465 N -1.24 0.76 -0.97 -0.16 2.02 -2.00 -2.08 112.91 109.24 1r0x h THR 465 Ca -0.11 -0.08 0.18 0.00 0.77 0.00 0.00 66.41 67.18 1r0x h THR 465 Cb 0.81 0.52 -0.09 0.00 -1.74 0.00 0.00 68.15 67.64 1r0x h THR 465 CO 0.18 0.04 0.61 0.28 0.37 0.00 0.00 175.52 177.00 1r0x h SER 466 N 0.23 0.69 -0.88 4.18 0.02 -1.95 0.38 113.55 116.22 1r0x h SER 466 Ca 0.22 0.07 -0.01 0.00 -0.84 0.00 0.00 61.79 61.23 1r0x h SER 466 Cb 0.28 -0.06 -0.04 0.00 0.14 0.00 0.00 62.40 62.72 1r0x h SER 466 CO -0.28 0.28 0.52 0.25 -1.14 0.00 0.00 176.83 176.45 1r0x h LEU 467 N 0.69 1.06 -0.88 5.07 5.85 -0.11 -1.75 115.31 125.25 1r0x h LEU 467 Ca 0.53 -0.07 -0.03 0.00 0.84 0.00 0.00 57.88 59.15 1r0x h LEU 467 Cb 0.92 -0.27 -0.04 0.00 0.37 0.00 0.00 40.66 41.64 1r0x h LEU 467 CO -0.30 0.82 0.44 -0.07 -0.34 0.00 0.00 178.44 179.00 1r0x h LEU 468 N 1.21 1.13 -1.31 2.25 4.07 -0.80 -2.58 115.31 119.27 1r0x h LEU 468 Ca 0.31 -0.12 -0.04 0.00 0.08 0.00 0.00 57.88 58.11 1r0x h LEU 468 Cb -0.04 -0.29 -0.02 0.00 1.08 0.00 0.00 40.66 41.40 1r0x h LEU 468 CO -0.06 0.93 0.00 0.24 -1.08 0.00 0.00 178.44 178.48 1r0x h MET 469 N 1.24 0.47 -0.46 1.13 2.86 -0.48 -0.87 114.93 118.81 1r0x h MET 469 Ca 0.30 -0.09 -0.01 0.00 -2.06 0.00 0.00 59.70 57.85 1r0x h MET 469 Cb 0.09 -0.07 -0.02 0.00 0.06 0.00 0.00 31.60 31.65 1r0x h MET 469 CO -0.04 0.49 0.27 1.25 1.06 0.00 0.00 176.91 179.94 1r0x h LEU 470 N 0.45 0.57 -1.09 1.22 5.85 -0.95 0.50 115.31 121.86 1r0x h LEU 470 Ca 0.10 -0.07 -0.07 0.00 0.84 0.00 0.00 57.88 58.68 1r0x h LEU 470 Cb 0.29 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.16 1r0x h LEU 470 CO 0.01 0.47 -0.06 0.40 -0.34 0.00 0.00 178.44 178.92 1r0x h ILE 471 N 0.62 1.22 0.00 4.05 2.04 -1.16 -1.85 117.51 122.43 1r0x h ILE 471 Ca 0.17 -0.95 0.00 0.00 1.00 0.00 0.00 64.86 65.08 1r0x h ILE 471 Cb 0.02 1.02 0.00 0.00 -0.74 0.00 0.00 36.82 37.12 1r0x h ILE 471 CO -0.03 0.32 0.00 0.18 0.00 0.00 0.00 178.15 178.62 1r0x n LEU 472 N -4.23 0.05 0.00 1.44 4.77 -0.40 -4.89 117.00 113.74 1r0x n LEU 472 Ca 0.01 0.51 0.00 0.00 -0.03 0.00 0.00 56.01 56.50 1r0x n LEU 472 Cb 0.30 -0.49 0.00 0.00 -2.33 0.00 0.00 43.42 40.89 1r0x n LEU 472 CO 0.40 -0.08 0.00 0.61 -1.33 0.00 0.00 177.39 177.00 1r0x n GLY 473 N 1.11 0.53 0.00 -0.72 0.00 -0.68 -4.91 105.19 100.51 1r0x n GLY 473 Ca 0.06 -0.17 0.12 0.00 0.00 0.00 0.00 46.02 46.03 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 -2.91 0.02 -4.45 1.61 -0.58 0.08 -4.75 120.64 109.66 1r0x n GLU 474 Ca 0.00 0.01 -0.20 0.00 -0.42 0.00 0.00 57.16 56.54 1r0x n GLU 474 Cb 0.00 -1.51 -0.15 0.00 -0.57 0.00 0.00 31.44 29.21 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 -3.07 1.93 -0.07 -4.62 2.96 -1.06 -4.92 118.68 109.84 1r0x s LEU 475 Ca 0.11 -0.20 -0.10 0.00 -0.22 0.00 0.00 54.13 53.73 1r0x s LEU 475 Cb 0.18 -0.56 -0.05 0.00 0.50 0.00 0.00 46.19 46.26 1r0x s LEU 475 CO 0.66 0.11 0.25 -1.83 -1.32 0.00 0.00 176.35 174.21 1r0x s GLU 476 N -0.08 3.62 -1.02 1.98 1.03 -1.26 -4.35 118.70 118.62 1r0x s GLU 476 Ca 0.01 0.07 -0.16 0.00 0.03 0.00 0.00 54.97 54.93 1r0x s GLU 476 Cb -0.06 -3.20 0.17 0.00 -0.80 0.00 0.00 34.13 30.25 1r0x s GLU 476 CO -0.00 0.74 1.17 0.00 -1.33 0.00 0.00 175.26 175.84 1r0x s ALA 477 N -1.06 3.80 0.55 -0.84 0.00 -1.26 -4.46 121.76 118.49 1r0x s ALA 477 Ca 0.19 -3.14 0.34 0.00 0.00 0.00 0.00 51.96 49.35 1r0x s ALA 477 Cb -0.14 -3.95 1.50 0.00 0.00 0.00 0.00 23.12 20.53 1r0x s ALA 477 CO 0.08 -2.74 1.81 0.77 0.00 0.00 0.00 175.76 175.69 1r0x h SER 478 N 7.96 0.00 -4.80 0.00 0.02 -1.79 -3.40 113.55 111.53 1r0x h SER 478 Ca 0.20 0.00 -0.17 0.00 -0.84 0.00 0.00 61.79 60.98 1r0x h SER 478 Cb 0.97 0.00 -0.22 0.00 0.14 0.00 0.00 62.40 63.29 1r0x h SER 478 CO 1.09 0.00 -0.65 -1.61 -1.14 0.00 0.00 176.83 174.52 1r0x s GLU 479 N -4.89 0.31 0.06 3.45 2.02 -0.72 -5.00 118.70 113.94 1r0x s GLU 479 Ca -0.05 -0.46 0.00 0.00 0.02 0.00 0.00 54.97 54.48 1r0x s GLU 479 Cb 0.21 0.12 0.00 0.00 0.10 0.00 0.00 34.13 34.56 1r0x s GLU 479 CO 0.75 -0.06 0.00 0.41 0.02 0.00 0.00 175.26 176.38 1r0x n GLY 480 N 1.77 -3.06 3.15 -1.39 0.00 -1.25 -1.49 105.19 102.92 1r0x n GLY 480 Ca -0.22 -2.01 -0.33 0.00 0.00 0.00 0.00 46.02 43.46 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 -0.56 2.22 -0.11 -0.61 1.09 0.77 -4.91 121.20 119.09 1r0x s ILE 481 Ca 0.00 -0.89 0.01 0.00 -1.10 0.00 0.00 60.65 58.67 1r0x s ILE 481 Cb 0.00 -1.94 -0.02 0.00 -1.06 0.00 0.00 42.46 39.44 1r0x s ILE 481 CO 0.00 0.53 -0.13 -0.51 -0.10 0.00 0.00 174.94 174.72 1r0x s ILE 482 N 1.28 3.05 -0.07 2.92 1.10 -1.26 0.27 121.20 128.49 1r0x s ILE 482 Ca 0.04 -0.68 -0.00 0.00 -0.51 0.00 0.00 60.65 59.50 1r0x s ILE 482 Cb -0.13 -2.26 0.02 0.00 0.15 0.00 0.00 42.46 40.24 1r0x s ILE 482 CO -0.11 0.54 -0.03 -0.54 -2.11 0.00 0.00 174.94 172.69 1r0x s LYS 483 N 0.10 0.90 -0.06 3.50 1.02 0.84 -4.99 119.74 121.05 1r0x s LYS 483 Ca -0.06 -0.06 -0.30 0.00 0.02 0.00 0.00 55.97 55.58 1r0x s LYS 483 Cb -0.15 -1.06 0.09 0.00 -0.52 0.00 0.00 37.83 36.19 1r0x s LYS 483 CO 0.05 -0.20 0.77 -3.38 -0.92 0.00 0.00 175.35 171.66 1r0x s HIS 484 N 1.50 -0.55 0.12 3.18 -3.43 -1.26 -1.28 115.29 113.57 1r0x s HIS 484 Ca -0.02 0.86 0.04 0.00 -0.80 0.00 0.00 55.06 55.15 1r0x s HIS 484 Cb -0.13 0.44 -0.04 0.00 -1.43 0.00 0.00 32.58 31.42 1r0x s HIS 484 CO -0.04 -0.56 -0.10 -1.54 -2.00 0.00 0.00 174.74 170.51 1r0x s SER 485 N -1.40 1.63 0.00 7.38 1.04 -1.26 -5.11 113.70 115.98 1r0x s SER 485 Ca -0.06 -0.91 0.00 0.00 0.48 0.00 0.00 55.95 55.45 1r0x s SER 485 Cb -0.00 -0.00 0.00 0.00 0.10 0.00 0.00 66.02 66.12 1r0x s SER 485 CO 0.04 -0.30 0.00 0.61 0.98 0.00 0.00 173.24 174.58 1r0x n GLY 486 N 0.18 1.01 3.77 7.32 0.00 -1.26 -4.50 105.19 111.71 1r0x n GLY 486 Ca -0.13 -2.07 -0.38 0.00 0.00 0.00 0.00 46.02 43.44 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 -1.56 3.87 0.06 1.61 0.52 -1.26 -4.87 118.95 117.33 1r0x s ARG 487 Ca 0.00 1.81 0.07 0.00 -0.52 0.00 0.00 55.73 57.09 1r0x s ARG 487 Cb 0.00 -2.52 -0.04 0.00 0.52 0.00 0.00 34.95 32.92 1r0x s ARG 487 CO 0.00 -0.47 -0.14 0.14 0.02 0.00 0.00 175.30 174.85 1r0x s VAL 488 N -1.49 3.11 -0.10 3.52 -7.23 -1.26 -1.96 120.40 115.00 1r0x s VAL 488 Ca 0.61 -1.18 0.03 0.00 -1.81 0.00 0.00 61.98 59.62 1r0x s VAL 488 Cb -0.30 -2.38 -0.01 0.00 0.56 0.00 0.00 36.38 34.26 1r0x s VAL 488 CO 0.37 0.25 -0.19 -0.55 -0.31 0.00 0.00 175.10 174.67 1r0x s SER 489 N -1.75 3.57 -0.15 4.85 0.15 0.05 -4.97 113.70 115.45 1r0x s SER 489 Ca 0.17 -0.41 0.02 0.00 0.70 0.00 0.00 55.95 56.43 1r0x s SER 489 Cb -0.11 -1.31 0.01 0.00 -1.71 0.00 0.00 66.02 62.90 1r0x s SER 489 CO 0.09 0.20 -0.20 0.12 1.20 0.00 0.00 173.24 174.65 1r0x s PHE 490 N 0.11 2.71 -0.36 3.44 5.36 -1.26 0.24 117.98 128.22 1r0x s PHE 490 Ca -0.09 -1.31 -0.07 0.00 -0.96 0.00 0.00 56.93 54.51 1r0x s PHE 490 Cb -0.15 -1.85 0.05 0.00 -0.34 0.00 0.00 43.02 40.73 1r0x s PHE 490 CO 0.06 -0.60 0.14 0.00 -1.46 0.00 0.00 175.22 173.35 1r0x s SER 492 N 1.58 6.03 0.48 0.00 1.04 -1.26 -0.74 113.70 120.83 1r0x s SER 492 Ca 0.00 1.63 0.16 0.00 0.48 0.00 0.00 55.95 58.23 1r0x s SER 492 Cb -0.20 -2.51 1.17 0.00 0.10 0.00 0.00 66.02 64.57 1r0x s SER 492 CO 0.02 -1.00 2.04 0.06 0.98 0.00 0.00 173.24 175.34 1r0x h GLN 493 N 0.22 0.21 -5.97 4.02 3.07 -1.86 -3.39 115.11 111.42 1r0x h GLN 493 Ca -0.46 -0.01 -0.58 0.00 0.09 0.00 0.00 58.65 57.69 1r0x h GLN 493 Cb 1.20 -0.05 -0.07 0.00 0.08 0.00 0.00 27.48 28.65 1r0x h GLN 493 CO 0.59 0.14 0.52 0.12 0.09 0.00 0.00 178.83 180.29 1r0x s PHE 494 N -5.22 3.38 -0.81 0.06 5.36 -1.26 -4.99 117.98 114.51 1r0x s PHE 494 Ca -0.06 1.31 -0.20 0.00 -0.96 0.00 0.00 56.93 57.01 1r0x s PHE 494 Cb 0.19 -3.10 0.10 0.00 -0.34 0.00 0.00 43.02 39.87 1r0x s PHE 494 CO 0.72 -0.34 1.05 -1.12 -1.46 0.00 0.00 175.22 174.07 1r0x s SER 495 N 1.21 6.42 0.42 6.13 0.01 -1.26 -5.03 113.70 121.60 1r0x s SER 495 Ca 0.40 -1.59 -0.14 0.00 1.31 0.00 0.00 55.95 55.93 1r0x s SER 495 Cb -0.16 -2.40 -0.08 0.00 0.21 0.00 0.00 66.02 63.59 1r0x s SER 495 CO 0.10 -1.22 0.84 -1.66 0.41 0.00 0.00 173.24 171.71 1r0x s TRP 496 N 3.28 3.42 -0.04 2.43 1.48 -1.26 -4.93 118.94 123.32 1r0x s TRP 496 Ca 0.28 1.27 -0.02 0.00 -1.06 0.00 0.00 56.10 56.57 1r0x s TRP 496 Cb -0.11 -2.61 0.03 0.00 -1.16 0.00 0.00 33.47 29.62 1r0x s TRP 496 CO -0.01 -0.14 0.05 0.42 -4.06 0.00 0.00 176.95 173.22 1r0x s ILE 497 N -2.33 -0.08 0.22 0.66 -1.09 -1.26 -4.81 121.20 112.51 1r0x s ILE 497 Ca 0.55 0.38 -0.04 0.00 -2.23 0.00 0.00 60.65 59.31 1r0x s ILE 497 Cb -0.10 -0.16 -0.05 0.00 -1.58 0.00 0.00 42.46 40.57 1r0x s ILE 497 CO 0.26 0.17 0.46 -0.04 -1.23 0.00 0.00 174.94 174.56 1r0x s MET 498 N 1.98 3.62 0.24 2.79 -1.94 -1.26 -2.05 119.30 122.67 1r0x s MET 498 Ca 0.03 -0.08 -0.31 0.00 -1.71 0.00 0.00 55.69 53.61 1r0x s MET 498 Cb -0.12 -2.75 -0.13 0.00 2.01 0.00 0.00 34.83 33.84 1r0x s MET 498 CO -0.03 0.34 1.46 -2.30 -0.01 0.00 0.00 175.02 174.48 1r0x n PRO 499 N -0.51 2.15 0.00 2.03 -0.02 -1.26 -4.60 135.00 132.80 1r0x n PRO 499 Ca -0.02 0.77 0.00 0.00 -2.02 0.00 0.00 63.50 62.22 1r0x n PRO 499 Cb 0.53 -2.46 0.00 0.00 -0.02 0.00 0.00 33.50 31.55 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 2.35 0.95 3.87 -1.23 0.00 -0.99 -4.97 105.19 105.16 1r0x n GLY 500 Ca 0.12 -1.97 -0.29 0.00 0.00 0.00 0.00 46.02 43.88 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 -1.50 2.00 0.11 2.61 -4.23 -1.26 -0.92 115.64 112.45 1r0x s THR 501 Ca 0.00 0.00 -0.24 0.00 -1.18 0.00 0.00 61.69 60.27 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 1.68 0.40 -0.54 0.00 0.00 174.62 176.16 1r0x h ILE 502 N -1.21 0.66 -0.39 2.99 2.04 -1.38 -0.26 117.51 119.95 1r0x h ILE 502 Ca -0.47 0.00 0.07 0.00 1.00 0.00 0.00 64.86 65.46 1r0x h ILE 502 Cb 1.33 0.66 -0.06 0.00 -0.74 0.00 0.00 36.82 38.00 1r0x h ILE 502 CO 0.63 0.00 -0.02 0.50 0.00 0.00 0.00 178.15 179.27 1r0x h LYS 503 N -0.25 0.08 -0.64 2.37 3.64 -1.73 -0.82 116.57 119.22 1r0x h LYS 503 Ca 0.04 -0.00 0.02 0.00 -1.27 0.00 0.00 60.65 59.44 1r0x h LYS 503 Cb 0.30 -0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.06 1r0x h LYS 503 CO -0.12 0.05 0.43 0.93 -2.27 0.00 0.00 179.45 178.47 1r0x h GLU 504 N 0.08 0.79 -0.54 1.90 5.08 -1.79 -0.22 114.58 119.90 1r0x h GLU 504 Ca 0.19 -0.05 -0.10 0.00 -1.00 0.00 0.00 59.36 58.40 1r0x h GLU 504 Cb 0.27 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.33 1r0x h GLU 504 CO -0.33 0.53 -0.07 -0.91 -1.00 0.00 0.00 179.01 177.22 1r0x h ASN 505 N 0.82 0.96 0.11 1.42 2.35 -0.09 -2.17 115.58 118.98 1r0x h ASN 505 Ca 0.25 -0.29 -0.20 0.00 -0.55 0.00 0.00 56.30 55.51 1r0x h ASN 505 Cb -0.01 -0.26 0.00 0.00 0.05 0.00 0.00 38.32 38.10 1r0x h ASN 505 CO -0.06 1.05 -0.73 0.40 -1.65 0.00 0.00 177.43 176.44 1r0x h ILE 506 N 0.88 1.34 -0.72 2.81 2.04 -0.16 -3.24 117.51 120.46 1r0x h ILE 506 Ca 0.15 -2.06 -0.22 0.00 1.00 0.00 0.00 64.86 63.72 1r0x h ILE 506 Cb 0.61 2.05 -0.13 0.00 -0.74 0.00 0.00 36.82 38.60 1r0x h ILE 506 CO 0.04 0.63 0.28 2.30 0.00 0.00 0.00 178.15 181.40 1r0x n ILE 507 N -3.88 2.82 -1.68 -0.67 -5.35 -0.19 -4.30 119.36 106.12 1r0x n ILE 507 Ca -0.05 -1.54 -0.46 0.00 -0.27 0.00 0.00 62.75 60.43 1r0x n ILE 507 Cb 0.71 -0.39 -0.04 0.00 -1.74 0.00 0.00 39.64 38.19 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 -0.14 2.41 -1.71 4.28 7.35 -0.82 -1.96 117.46 126.87 1r0x n PHE 508 Ca 0.40 -0.03 -0.18 0.00 -0.76 0.00 0.00 57.45 56.88 1r0x n PHE 508 Cb 1.36 -2.67 -0.06 0.00 0.35 0.00 0.00 39.48 38.45 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 4.17 1.24 3.26 7.13 0.00 -1.26 -4.98 105.19 114.76 1r0x n GLY 509 Ca 0.20 -0.16 -0.09 0.00 0.00 0.00 0.00 46.02 45.97 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 -2.72 0.11 -0.04 1.61 1.01 -0.83 -5.15 120.40 114.39 1r0x s VAL 510 Ca 0.00 -1.30 -0.13 0.00 0.00 0.00 0.00 61.98 60.56 1r0x s VAL 510 Cb 0.00 -1.59 -0.05 0.00 0.00 0.00 0.00 36.38 34.74 1r0x s VAL 510 CO 0.00 -0.48 0.33 -0.94 0.00 0.00 0.00 175.10 174.01 1r0x s SER 511 N -2.92 6.67 0.15 3.32 1.04 -1.26 -4.92 113.70 115.78 1r0x s SER 511 Ca 0.11 0.80 -0.31 0.00 0.48 0.00 0.00 55.95 57.02 1r0x s SER 511 Cb 0.04 -2.20 -0.10 0.00 0.10 0.00 0.00 66.02 63.87 1r0x s SER 511 CO -0.06 0.33 1.55 -0.47 0.98 0.00 0.00 173.24 175.58 1r0x s TYR 512 N -0.93 3.03 -0.08 5.02 5.04 -1.26 -5.02 117.35 123.15 1r0x s TYR 512 Ca 0.21 0.64 0.00 0.00 -2.44 0.00 0.00 57.07 55.48 1r0x s TYR 512 Cb -0.15 -3.90 0.02 0.00 0.35 0.00 0.00 41.96 38.28 1r0x s TYR 512 CO 0.10 -3.33 -0.08 0.34 -1.34 0.00 0.00 175.55 171.24 1r0x s ASP 513 N 1.24 1.82 0.11 4.32 -1.08 -1.26 -5.08 116.67 116.74 1r0x s ASP 513 Ca 0.70 -0.25 -0.27 0.00 -0.52 0.00 0.00 52.55 52.20 1r0x s ASP 513 Cb -0.43 -0.74 -0.08 0.00 -1.46 0.00 0.00 42.92 40.21 1r0x s ASP 513 CO 0.31 -0.07 1.63 -0.08 0.52 0.00 0.00 175.17 177.48 1r0x h GLU 514 N 7.69 -0.47 -0.53 4.34 4.81 -2.00 -0.67 114.58 127.75 1r0x h GLU 514 Ca -0.30 0.03 -0.05 0.00 -0.13 0.00 0.00 59.36 58.91 1r0x h GLU 514 Cb 1.15 0.11 -0.02 0.00 0.63 0.00 0.00 28.75 30.61 1r0x h GLU 514 CO 0.42 -0.31 0.12 1.88 -0.73 0.00 0.00 179.01 180.39 1r0x h TYR 515 N -0.49 0.85 0.04 0.92 0.05 -2.00 -2.36 116.97 113.98 1r0x h TYR 515 Ca 0.03 -0.08 -0.00 0.00 0.05 0.00 0.00 58.73 58.73 1r0x h TYR 515 Cb 0.51 -0.25 0.00 0.00 1.01 0.00 0.00 36.73 38.01 1r0x h TYR 515 CO -0.25 0.71 -0.02 -0.09 -1.05 0.00 0.00 178.16 177.47 1r0x h ARG 516 N 0.79 -0.05 0.40 4.88 2.43 -1.90 -2.17 114.38 118.75 1r0x h ARG 516 Ca 0.17 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.34 1r0x h ARG 516 Cb 0.30 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 29.83 1r0x h ARG 516 CO -0.00 0.27 -0.48 -0.92 -1.51 0.00 0.00 179.97 177.33 1r0x h TYR 517 N -0.37 -1.34 -0.86 2.20 3.20 -1.05 -0.55 116.97 118.20 1r0x h TYR 517 Ca -0.01 0.02 0.06 0.00 3.14 0.00 0.00 58.73 61.94 1r0x h TYR 517 Cb 0.34 0.53 -0.05 0.00 1.54 0.00 0.00 36.73 39.09 1r0x h TYR 517 CO 0.03 -0.63 0.56 0.87 -1.64 0.00 0.00 178.16 177.36 1r0x h LYS 518 N -0.91 0.96 -0.40 1.82 1.57 -1.48 0.27 116.57 118.40 1r0x h LYS 518 Ca -0.04 -0.06 -0.05 0.00 -1.87 0.00 0.00 60.65 58.63 1r0x h LYS 518 Cb 0.82 -0.22 -0.02 0.00 0.08 0.00 0.00 32.23 32.89 1r0x h LYS 518 CO -0.11 0.64 0.07 1.03 -0.57 0.00 0.00 179.45 180.51 1r0x h SER 519 N 0.99 0.64 -0.24 0.86 0.87 -1.03 -1.52 113.55 114.13 1r0x h SER 519 Ca 0.37 -0.25 -0.06 0.00 -1.23 0.00 0.00 61.79 60.61 1r0x h SER 519 Cb 0.17 -0.17 -0.01 0.00 -0.44 0.00 0.00 62.40 61.96 1r0x h SER 519 CO -0.13 0.73 -0.09 0.58 -0.53 0.00 0.00 176.83 177.39 1r0x h VAL 520 N 0.52 1.30 -0.46 2.23 2.07 0.51 -1.61 116.25 120.81 1r0x h VAL 520 Ca 0.12 -1.15 0.09 0.00 0.82 0.00 0.00 66.70 66.59 1r0x h VAL 520 Cb 0.36 1.55 -0.08 0.00 -1.52 0.00 0.00 31.29 31.60 1r0x h VAL 520 CO 0.01 0.35 -0.08 0.58 0.02 0.00 0.00 177.57 178.45 1r0x h VAL 521 N 0.20 0.57 -0.14 2.57 2.07 -0.46 -1.63 116.25 119.43 1r0x h VAL 521 Ca 0.05 -0.01 -0.03 0.00 0.82 0.00 0.00 66.70 67.53 1r0x h VAL 521 Cb 0.58 0.53 -0.00 0.00 -1.52 0.00 0.00 31.29 30.88 1r0x h VAL 521 CO 0.03 0.01 -0.02 0.50 0.02 0.00 0.00 177.57 178.10 1r0x h LYS 522 N 0.03 0.27 0.00 1.57 3.64 -1.17 -1.94 116.57 118.98 1r0x h LYS 522 Ca 0.23 -0.10 -0.03 0.00 -1.27 0.00 0.00 60.65 59.48 1r0x h LYS 522 Cb 0.34 -0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 32.14 1r0x h LYS 522 CO -0.45 0.54 -0.13 0.00 -2.27 0.00 0.00 179.45 177.14 1r0x h ALA 523 N 0.72 1.06 -0.10 5.00 0.00 -1.02 -2.16 119.26 122.75 1r0x h ALA 523 Ca 0.04 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1r0x h ALA 523 Cb 0.44 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1r0x h ALA 523 CO 0.01 0.17 0.00 0.00 0.00 0.00 0.00 179.25 179.43 1r0x n GLN 525 N -0.02 -5.61 0.13 0.00 1.13 -0.81 -4.91 117.38 107.30 1r0x n GLN 525 Ca 0.16 0.78 0.12 0.00 -1.94 0.00 0.00 57.00 56.12 1r0x n GLN 525 Cb 0.26 -5.50 0.07 0.00 0.11 0.00 0.00 30.24 25.17 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 -1.77 0.00 -0.93 1.08 3.38 -1.58 -3.35 115.31 112.14 1r0x h LEU 526 Ca -0.49 -0.02 0.01 0.00 0.09 0.00 0.00 57.88 57.47 1r0x h LEU 526 Cb 1.33 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 42.03 1r0x h LEU 526 CO 0.51 0.01 0.62 -0.61 0.09 0.00 0.00 178.44 179.05 1r0x h GLN 527 N 0.00 1.22 0.00 1.13 5.75 -1.88 0.11 115.11 121.44 1r0x h GLN 527 Ca 0.00 -0.07 -0.01 0.00 -0.15 0.00 0.00 58.65 58.42 1r0x h GLN 527 Cb 0.97 -0.28 -0.00 0.00 1.07 0.00 0.00 27.48 29.25 1r0x h GLN 527 CO 0.00 0.81 -0.04 1.96 -2.65 0.00 0.00 178.83 178.91 1r0x h GLN 528 N 1.26 0.00 0.00 1.69 7.50 -1.96 -2.55 115.11 121.05 1r0x h GLN 528 Ca 0.34 0.00 -0.08 0.00 0.50 0.00 0.00 58.65 59.41 1r0x h GLN 528 Cb -0.14 0.00 -0.01 0.00 0.05 0.00 0.00 27.48 27.38 1r0x h GLN 528 CO -0.08 0.04 -0.49 -0.44 -1.50 0.00 0.00 178.83 176.36 1r0x h ASP 529 N 0.00 0.00 0.96 1.46 3.32 -1.03 -3.38 116.42 117.75 1r0x h ASP 529 Ca -0.00 -0.67 -0.01 0.00 0.02 0.00 0.00 57.03 56.36 1r0x h ASP 529 Cb 0.11 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.65 1r0x h ASP 529 CO 0.00 1.12 -0.07 0.16 -1.72 0.00 0.00 179.24 178.74 1r0x h ILE 530 N -1.00 0.18 0.00 0.35 3.07 -1.20 -1.35 117.51 117.56 1r0x h ILE 530 Ca -0.13 -0.68 0.00 0.00 1.55 0.00 0.00 64.86 65.61 1r0x h ILE 530 Cb 0.99 1.57 0.00 0.00 -0.27 0.00 0.00 36.82 39.12 1r0x h ILE 530 CO -0.08 0.07 0.00 1.07 -1.05 0.00 0.00 178.15 178.16 1r0x n THR 531 N -3.20 0.80 1.08 0.16 5.66 -0.97 -1.87 114.28 115.94 1r0x n THR 531 Ca 0.00 0.18 0.13 0.00 -3.05 0.00 0.00 64.05 61.31 1r0x n THR 531 Cb 0.34 -0.96 0.47 0.00 -1.55 0.00 0.00 70.33 68.62 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 -1.78 0.13 -4.23 1.09 5.02 -0.51 -4.87 118.16 113.00 1r0x n LYS 532 Ca 0.04 -0.05 -0.32 0.00 -2.02 0.00 0.00 58.31 55.95 1r0x n LYS 532 Cb 0.23 -1.50 -0.08 0.00 -0.02 0.00 0.00 35.03 33.65 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 -2.90 3.11 0.24 2.13 2.99 -0.78 -5.03 117.98 117.74 1r0x s PHE 533 Ca 0.16 0.10 -0.05 0.00 0.00 0.00 0.00 56.93 57.14 1r0x s PHE 533 Cb 0.19 -1.68 0.37 0.00 0.00 0.00 0.00 43.02 41.90 1r0x s PHE 533 CO 0.59 0.48 1.81 0.00 -0.00 0.00 0.00 175.22 178.10 1r0x h ALA 534 N 4.23 1.14 -0.66 5.36 0.00 -1.89 -2.56 119.26 124.87 1r0x h ALA 534 Ca -0.49 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1r0x h ALA 534 Cb 1.18 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.83 1r0x h ALA 534 CO 0.59 0.11 0.00 0.39 0.00 0.00 0.00 179.25 180.34 1r0x n GLU 535 N -4.74 2.98 0.00 0.00 -0.58 -1.26 -5.04 120.64 112.00 1r0x n GLU 535 Ca 0.13 -2.65 0.00 0.00 -0.42 0.00 0.00 57.16 54.22 1r0x n GLU 535 Cb 0.25 -1.61 0.00 0.00 -0.57 0.00 0.00 31.44 29.51 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 1.36 0.00 0.00 3.49 6.02 -0.97 -0.39 117.38 126.89 1r0x n GLN 536 Ca 0.23 0.00 0.14 0.00 -0.01 0.00 0.00 57.00 57.36 1r0x n GLN 536 Cb 0.66 0.00 0.77 0.00 1.02 0.00 0.00 30.24 32.70 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 3.65 0.00 -0.40 1.08 5.75 -1.26 -1.89 116.55 123.48 1r0x n ASP 537 Ca 0.00 -0.65 0.05 0.00 -0.01 0.00 0.00 54.79 54.19 1r0x n ASP 537 Cb 0.00 -0.08 0.19 0.00 -1.03 0.00 0.00 41.12 40.20 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 -1.08 1.16 -4.72 -1.12 5.03 0.47 -2.03 115.26 112.98 1r0x n ASN 538 Ca 0.18 -1.89 -0.42 0.00 0.87 0.00 0.00 54.58 53.32 1r0x n ASN 538 Cb 0.13 -0.13 -0.03 0.00 -1.02 0.00 0.00 39.78 38.73 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 -1.74 3.15 0.00 3.41 2.01 -0.79 -4.80 115.64 116.87 1r0x s THR 539 Ca 0.19 0.83 -0.30 0.00 0.31 0.00 0.00 61.69 62.72 1r0x s THR 539 Cb 0.10 -3.53 -0.04 0.00 0.01 0.00 0.00 72.50 69.04 1r0x s THR 539 CO 0.14 0.07 1.10 -0.69 -0.69 0.00 0.00 174.62 174.55 1r0x s VAL 540 N 1.06 4.44 0.09 3.82 1.01 -1.26 -2.18 120.40 127.37 1r0x s VAL 540 Ca 0.65 1.75 0.06 0.00 0.00 0.00 0.00 61.98 64.44 1r0x s VAL 540 Cb -0.38 -4.12 -0.04 0.00 0.00 0.00 0.00 36.38 31.84 1r0x s VAL 540 CO 0.31 0.10 -0.07 -0.76 0.00 0.00 0.00 175.10 174.68 1r0x s LEU 541 N 1.33 3.16 0.47 3.92 1.43 -0.10 -4.97 118.68 123.92 1r0x s LEU 541 Ca 0.55 -0.30 -0.03 0.00 -1.03 0.00 0.00 54.13 53.32 1r0x s LEU 541 Cb -0.25 -1.92 -0.03 0.00 0.03 0.00 0.00 46.19 44.03 1r0x s LEU 541 CO 0.26 0.19 0.74 -0.83 0.23 0.00 0.00 176.35 176.95 1r0x s GLY 542 N -2.11 1.49 0.70 -3.19 0.00 -1.26 -2.36 107.32 100.59 1r0x s GLY 542 Ca 0.22 -0.68 -0.16 0.00 0.00 0.00 0.00 44.72 44.09 1r0x s GLY 542 CO 0.14 -0.52 0.94 -2.21 0.00 0.00 0.00 173.10 171.45 1r0x n GLU 543 N -2.19 0.57 0.00 2.90 2.13 -1.26 0.59 120.64 123.38 1r0x n GLU 543 Ca 0.00 0.25 0.00 0.00 0.66 0.00 0.00 57.16 58.07 1r0x n GLU 543 Cb 0.56 -2.19 0.00 0.00 0.27 0.00 0.00 31.44 30.08 1r0x n GLU 543 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1r0x n GLY 544 N 1.17 1.97 4.05 8.31 0.00 -0.87 -4.36 105.19 115.45 1r0x n GLY 544 Ca 0.13 0.00 -0.34 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 -0.47 -0.50 0.19 -0.02 0.00 0.20 -4.74 105.19 99.84 1r0x n GLY 545 Ca 0.00 0.26 0.03 0.00 0.00 0.00 0.00 46.02 46.32 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 -2.08 1.19 -0.08 1.61 2.07 -1.77 -2.67 116.25 114.53 1r0x h VAL 546 Ca -0.67 -1.24 0.00 0.00 0.82 0.00 0.00 66.70 65.61 1r0x h VAL 546 Cb 1.39 1.68 0.00 0.00 -1.52 0.00 0.00 31.29 32.84 1r0x h VAL 546 CO 0.59 0.35 0.00 0.35 0.02 0.00 0.00 177.57 178.88 1r0x n THR 547 N -4.03 0.08 -1.87 2.57 -2.24 -1.26 -4.87 114.28 102.67 1r0x n THR 547 Ca -0.02 -0.33 -0.30 0.00 -2.27 0.00 0.00 64.05 61.13 1r0x n THR 547 Cb 0.40 0.60 0.03 0.00 -2.10 0.00 0.00 70.33 69.27 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 -1.85 3.01 0.73 3.22 1.02 -1.01 -5.09 118.68 118.71 1r0x s LEU 548 Ca 0.35 1.24 -0.11 0.00 0.02 0.00 0.00 54.13 55.63 1r0x s LEU 548 Cb 0.20 -4.12 0.03 0.00 0.02 0.00 0.00 46.19 42.32 1r0x s LEU 548 CO 0.31 -1.19 1.09 -0.94 0.02 0.00 0.00 176.35 175.63 1r0x s SER 549 N -4.28 5.11 0.29 2.29 1.04 -1.26 -4.90 113.70 111.99 1r0x s SER 549 Ca 0.57 1.29 0.01 0.00 0.48 0.00 0.00 55.95 58.29 1r0x s SER 549 Cb -0.11 -2.09 0.52 0.00 0.10 0.00 0.00 66.02 64.44 1r0x s SER 549 CO 0.53 -1.57 1.88 1.23 0.98 0.00 0.00 173.24 176.28 1r0x h GLY 550 N -0.81 1.46 1.41 7.32 0.00 -1.98 -1.80 103.07 108.68 1r0x h GLY 550 Ca -0.46 -0.43 -0.20 0.00 0.00 0.00 0.00 47.33 46.25 1r0x h GLY 550 CO 0.61 0.26 -0.72 -1.33 0.00 0.00 0.00 176.54 175.35 1r0x h GLY 551 N 1.04 0.64 0.97 4.60 0.00 -1.95 0.16 103.07 108.52 1r0x h GLY 551 Ca 0.44 -0.88 0.00 0.00 0.00 0.00 0.00 47.33 46.89 1r0x h GLY 551 CO -0.19 0.79 0.06 1.46 0.00 0.00 0.00 176.54 178.65 1r0x h GLN 552 N 0.40 0.12 -0.66 4.80 4.20 -1.88 0.14 115.11 122.22 1r0x h GLN 552 Ca -0.03 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.67 1r0x h GLN 552 Cb 1.31 -0.03 -0.03 0.00 0.30 0.00 0.00 27.48 29.04 1r0x h GLN 552 CO 0.14 0.08 0.43 0.00 -0.67 0.00 0.00 178.83 178.81 1r0x h ARG 553 N 0.12 0.88 -0.52 1.46 3.08 -1.18 -2.11 114.38 116.11 1r0x h ARG 553 Ca 0.04 -0.06 -0.08 0.00 0.07 0.00 0.00 59.98 59.95 1r0x h ARG 553 Cb 0.00 -0.20 -0.02 0.00 0.08 0.00 0.00 29.97 29.83 1r0x h ARG 553 CO -0.02 0.59 -0.01 0.00 -1.07 0.00 0.00 179.97 179.46 1r0x h ALA 554 N 1.24 1.00 -0.19 0.04 0.00 -0.71 -1.80 119.26 118.84 1r0x h ALA 554 Ca 0.24 -0.29 -0.12 0.00 0.00 0.00 0.00 54.91 54.75 1r0x h ALA 554 Cb -0.09 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.48 1r0x h ALA 554 CO -0.05 0.61 -0.40 0.00 0.00 0.00 0.00 179.25 179.41 1r0x h ARG 555 N 0.82 0.44 -0.52 0.00 3.08 -0.56 0.11 114.38 117.76 1r0x h ARG 555 Ca 0.15 -0.21 -0.10 0.00 0.07 0.00 0.00 59.98 59.89 1r0x h ARG 555 Cb 0.50 -0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.53 1r0x h ARG 555 CO 0.02 0.77 -0.06 0.82 -1.07 0.00 0.00 179.97 180.45 1r0x h ILE 556 N 0.36 1.27 -0.19 2.04 2.04 -1.16 -1.20 117.51 120.67 1r0x h ILE 556 Ca 0.03 -1.19 -0.19 0.00 1.00 0.00 0.00 64.86 64.52 1r0x h ILE 556 Cb 0.86 0.99 0.00 0.00 -0.74 0.00 0.00 36.82 37.93 1r0x h ILE 556 CO 0.07 0.42 -0.65 -1.28 0.00 0.00 0.00 178.15 176.71 1r0x h SER 557 N 0.82 0.79 -0.35 1.72 0.87 -1.21 -1.00 113.55 115.19 1r0x h SER 557 Ca 0.14 -0.47 -0.02 0.00 -1.23 0.00 0.00 61.79 60.21 1r0x h SER 557 Cb 0.61 -0.23 -0.02 0.00 -0.44 0.00 0.00 62.40 62.32 1r0x h SER 557 CO 0.04 1.24 0.13 0.25 -0.53 0.00 0.00 176.83 177.95 1r0x h LEU 558 N 0.50 0.49 -0.80 2.23 6.46 -0.76 -2.40 115.31 121.04 1r0x h LEU 558 Ca -0.01 -0.18 0.06 0.00 -0.12 0.00 0.00 57.88 57.62 1r0x h LEU 558 Cb 1.24 -0.13 -0.06 0.00 -0.73 0.00 0.00 40.66 40.98 1r0x h LEU 558 CO 0.13 0.54 0.49 0.00 -0.62 0.00 0.00 178.44 178.98 1r0x h ALA 559 N 0.97 1.10 -0.55 1.25 0.00 -1.00 -0.41 119.26 120.61 1r0x h ALA 559 Ca 0.12 -0.00 0.02 0.00 0.00 0.00 0.00 54.91 55.04 1r0x h ALA 559 Cb 0.21 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 1r0x h ALA 559 CO -0.01 0.22 0.34 -0.09 0.00 0.00 0.00 179.25 179.72 1r0x h ARG 560 N 0.90 0.66 -0.20 0.00 2.43 -1.12 0.63 114.38 117.67 1r0x h ARG 560 Ca 0.35 -0.04 -0.14 0.00 -0.81 0.00 0.00 59.98 59.34 1r0x h ARG 560 Cb 0.16 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.55 1r0x h ARG 560 CO -0.17 0.44 -0.46 0.00 -1.51 0.00 0.00 179.97 178.27 1r0x h ALA 561 N 1.24 0.82 0.07 2.80 0.00 -0.79 -3.12 119.26 120.28 1r0x h ALA 561 Ca 0.22 -0.47 -0.25 0.00 0.00 0.00 0.00 54.91 54.42 1r0x h ALA 561 Cb 0.00 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 1r0x h ALA 561 CO -0.09 0.66 -1.14 0.28 0.00 0.00 0.00 179.25 178.96 1r0x h VAL 562 N 0.42 1.58 0.00 0.00 2.07 -0.88 -3.20 116.25 116.24 1r0x h VAL 562 Ca 0.03 -3.22 -0.06 0.00 0.82 0.00 0.00 66.70 64.26 1r0x h VAL 562 Cb 0.97 2.89 -0.01 0.00 -1.52 0.00 0.00 31.29 33.62 1r0x h VAL 562 CO 0.09 0.93 -0.28 0.22 0.02 0.00 0.00 177.57 178.54 1r0x h TYR 563 N 0.04 0.00 -3.37 1.57 3.20 -0.91 -3.43 116.97 114.08 1r0x h TYR 563 Ca -0.08 0.00 -0.54 0.00 3.14 0.00 0.00 58.73 61.25 1r0x h TYR 563 Cb 1.88 0.00 0.09 0.00 1.54 0.00 0.00 36.73 40.24 1r0x h TYR 563 CO 0.03 0.28 0.81 1.17 -1.64 0.00 0.00 178.16 178.82 1r0x n LYS 564 N -4.18 2.60 -2.85 1.82 4.81 -1.18 -4.95 118.16 114.23 1r0x n LYS 564 Ca -0.02 0.92 -0.43 0.00 -0.87 0.00 0.00 58.31 57.91 1r0x n LYS 564 Cb 0.33 -2.67 -0.04 0.00 0.02 0.00 0.00 35.03 32.67 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 0.29 6.33 0.23 3.14 3.68 -1.26 -5.00 116.67 124.07 1r0x s ASP 565 Ca 0.61 -0.38 0.00 0.00 2.13 0.00 0.00 52.55 54.92 1r0x s ASP 565 Cb -0.51 -2.43 -0.05 0.00 -1.45 0.00 0.00 42.92 38.48 1r0x s ASP 565 CO 0.53 -1.22 0.10 0.00 0.13 0.00 0.00 175.17 174.70 1r0x s ALA 566 N 3.92 1.49 -0.18 3.66 0.00 -1.26 -4.89 121.76 124.49 1r0x s ALA 566 Ca 0.30 -1.78 0.22 0.00 0.00 0.00 0.00 51.96 50.70 1r0x s ALA 566 Cb -0.13 1.11 -0.10 0.00 0.00 0.00 0.00 23.12 24.01 1r0x s ALA 566 CO 0.19 -0.49 0.88 -0.25 0.00 0.00 0.00 175.76 176.08 1r0x n ASP 567 N -0.37 0.63 -3.80 0.00 8.00 -0.83 -4.91 116.55 115.27 1r0x n ASP 567 Ca -0.00 0.25 -0.16 0.00 0.71 0.00 0.00 54.79 55.59 1r0x n ASP 567 Cb 0.66 0.83 -0.16 0.00 -0.02 0.00 0.00 41.12 42.43 1r0x n ASP 567 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1r0x s LEU 568 N -5.18 1.20 -0.17 0.64 2.96 -1.08 -3.93 118.68 113.13 1r0x s LEU 568 Ca -0.03 0.00 -0.01 0.00 -0.22 0.00 0.00 54.13 53.88 1r0x s LEU 568 Cb 0.11 -0.14 -0.01 0.00 0.50 0.00 0.00 46.19 46.65 1r0x s LEU 568 CO 0.82 -0.10 -0.12 -0.31 -1.32 0.00 0.00 176.35 175.32 1r0x s TYR 569 N 0.95 2.84 -0.26 5.38 1.51 -0.86 -0.77 117.35 126.13 1r0x s TYR 569 Ca -0.09 -0.95 -0.04 0.00 -1.01 0.00 0.00 57.07 54.99 1r0x s TYR 569 Cb -0.12 -1.94 0.02 0.00 -0.11 0.00 0.00 41.96 39.81 1r0x s TYR 569 CO -0.02 -0.45 -0.01 -0.51 -1.11 0.00 0.00 175.55 173.46 1r0x s LEU 570 N 0.89 3.42 -0.30 -1.29 1.43 0.14 -0.13 118.68 122.83 1r0x s LEU 570 Ca -0.03 -0.77 0.02 0.00 -1.03 0.00 0.00 54.13 52.32 1r0x s LEU 570 Cb -0.15 -1.75 0.07 0.00 0.03 0.00 0.00 46.19 44.39 1r0x s LEU 570 CO -0.01 -0.14 -0.02 -0.76 0.23 0.00 0.00 176.35 175.65 1r0x s LEU 571 N 1.40 4.04 -0.69 1.79 1.02 0.18 -0.52 118.68 125.90 1r0x s LEU 571 Ca 0.01 -1.64 -0.16 0.00 0.02 0.00 0.00 54.13 52.36 1r0x s LEU 571 Cb -0.17 -1.62 0.16 0.00 0.02 0.00 0.00 46.19 44.58 1r0x s LEU 571 CO -0.02 -0.28 0.69 -0.62 0.02 0.00 0.00 176.35 176.14 1r0x s ASP 572 N 1.13 6.43 -1.24 2.29 -1.08 0.08 -0.66 116.67 123.61 1r0x s ASP 572 Ca -0.01 -2.06 -0.04 0.00 -0.52 0.00 0.00 52.55 49.91 1r0x s ASP 572 Cb -0.20 -2.24 0.00 0.00 -1.46 0.00 0.00 42.92 39.02 1r0x s ASP 572 CO -0.05 -0.83 1.06 -1.20 0.52 0.00 0.00 175.17 174.68 1r0x n SER 573 N 5.12 -4.08 0.29 -0.34 7.64 -0.94 -2.69 113.62 118.62 1r0x n SER 573 Ca -0.00 -0.57 0.17 0.00 1.01 0.00 0.00 58.87 59.49 1r0x n SER 573 Cb 0.44 -4.97 0.83 0.00 -1.01 0.00 0.00 64.21 59.49 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 -2.23 0.00 -2.91 1.43 0.13 -1.82 -3.36 132.00 123.23 1r0x h PRO 574 Ca -0.57 0.00 -0.72 0.00 -0.87 0.00 0.00 66.00 63.84 1r0x h PRO 574 Cb 1.35 0.00 -0.34 0.00 0.13 0.00 0.00 31.00 32.14 1r0x h PRO 574 CO 0.52 0.04 0.13 1.19 -0.23 0.00 0.00 178.00 179.64 1r0x n PHE 575 N -3.22 3.49 -0.86 1.56 3.72 -1.26 -4.68 117.46 116.21 1r0x n PHE 575 Ca -0.01 -3.59 0.01 0.00 -0.05 0.00 0.00 57.45 53.81 1r0x n PHE 575 Cb 0.24 -1.08 0.01 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 1.62 -0.08 3.38 1.37 0.00 -1.26 -4.83 105.19 105.38 1r0x n GLY 576 Ca 0.25 -0.10 -0.26 0.00 0.00 0.00 0.00 46.02 45.92 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 -0.27 -0.01 0.12 1.61 4.01 -1.26 -4.47 117.16 116.89 1r0x n TYR 577 Ca 0.01 -2.16 -0.00 0.00 -0.16 0.00 0.00 57.90 55.58 1r0x n TYR 577 Cb 0.47 -0.37 0.01 0.00 -0.31 0.00 0.00 39.34 39.14 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 -6.14 7.72 3.38 -1.99 -3.38 115.31 114.90 1r0x h LEU 578 Ca -0.34 0.00 -0.73 0.00 0.09 0.00 0.00 57.88 56.90 1r0x h LEU 578 Cb 1.15 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 41.80 1r0x h LEU 578 CO 0.55 0.66 2.59 -0.90 0.09 0.00 0.00 178.44 181.42 1r0x n ASP 579 N -3.31 4.93 0.20 -0.43 3.85 -1.26 -4.72 116.55 115.81 1r0x n ASP 579 Ca 0.01 -2.98 0.05 0.00 -0.71 0.00 0.00 54.79 51.16 1r0x n ASP 579 Cb 0.78 -1.55 0.41 0.00 -1.35 0.00 0.00 41.12 39.41 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 3.74 1.09 -0.17 2.12 3.04 -1.99 -2.60 116.25 121.49 1r0x h VAL 580 Ca 0.51 -1.20 -0.22 0.00 -1.01 0.00 0.00 66.70 64.78 1r0x h VAL 580 Cb 0.60 1.67 0.01 0.00 -2.01 0.00 0.00 31.29 31.56 1r0x h VAL 580 CO 1.74 0.33 -0.75 -0.26 -1.01 0.00 0.00 177.57 177.61 1r0x h PHE 581 N 0.00 1.05 -0.39 3.17 -1.00 -1.96 -2.38 116.94 115.43 1r0x h PHE 581 Ca -0.00 -0.46 -0.02 0.00 2.81 0.00 0.00 57.97 60.30 1r0x h PHE 581 Cb 0.64 -0.17 -0.02 0.00 3.61 0.00 0.00 35.95 40.02 1r0x h PHE 581 CO 0.00 1.29 0.17 1.15 -1.61 0.00 0.00 178.31 179.31 1r0x h THR 582 N 0.54 1.19 -0.42 -1.55 2.02 -1.90 -2.28 112.91 110.51 1r0x h THR 582 Ca -0.04 -0.55 0.04 0.00 0.77 0.00 0.00 66.41 66.62 1r0x h THR 582 Cb 1.38 0.82 -0.02 0.00 -1.74 0.00 0.00 68.15 68.58 1r0x h THR 582 CO 0.16 0.20 0.28 -0.33 0.37 0.00 0.00 175.52 176.20 1r0x h GLU 583 N 0.49 0.41 -0.43 6.66 5.08 -1.44 0.19 114.58 125.55 1r0x h GLU 583 Ca 0.13 -0.02 -0.09 0.00 -1.00 0.00 0.00 59.36 58.38 1r0x h GLU 583 Cb 0.16 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 1r0x h GLU 583 CO -0.01 0.27 -0.10 0.93 -1.00 0.00 0.00 179.01 179.10 1r0x h GLU 584 N 0.42 0.82 -0.50 2.33 5.08 -1.14 -0.70 114.58 120.89 1r0x h GLU 584 Ca 0.17 -0.31 -0.10 0.00 -1.00 0.00 0.00 59.36 58.12 1r0x h GLU 584 Cb 0.15 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.34 1r0x h GLU 584 CO -0.04 0.93 -0.07 1.96 -1.00 0.00 0.00 179.01 180.79 1r0x h GLN 585 N 0.65 0.89 -0.28 2.33 4.20 -0.74 -2.72 115.11 119.43 1r0x h GLN 585 Ca 0.11 -0.29 -0.06 0.00 0.06 0.00 0.00 58.65 58.47 1r0x h GLN 585 Cb 0.63 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 28.32 1r0x h GLN 585 CO 0.04 0.93 -0.06 0.28 -0.67 0.00 0.00 178.83 179.35 1r0x h VAL 586 N 0.81 1.28 -0.84 -0.54 2.07 -0.47 -0.49 116.25 118.06 1r0x h VAL 586 Ca 0.14 -1.08 0.05 0.00 0.82 0.00 0.00 66.70 66.63 1r0x h VAL 586 Cb 0.58 1.40 -0.05 0.00 -1.52 0.00 0.00 31.29 31.70 1r0x h VAL 586 CO 0.04 0.34 0.53 0.15 0.02 0.00 0.00 177.57 178.65 1r0x h PHE 587 N 0.30 0.99 0.60 1.57 3.04 -1.13 0.85 116.94 123.16 1r0x h PHE 587 Ca 0.07 0.03 -0.03 0.00 3.98 0.00 0.00 57.97 62.02 1r0x h PHE 587 Cb 0.53 -0.32 0.01 0.00 2.56 0.00 0.00 35.95 38.73 1r0x h PHE 587 CO 0.05 0.54 -0.29 0.93 -2.02 0.00 0.00 178.31 177.52 1r0x h GLU 588 N 1.00 -0.77 -0.00 1.11 5.08 -1.36 -1.09 114.58 118.54 1r0x h GLU 588 Ca 0.35 0.05 -0.17 0.00 -1.00 0.00 0.00 59.36 58.60 1r0x h GLU 588 Cb 0.08 0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.48 1r0x h GLU 588 CO -0.14 -0.52 -0.78 0.66 -1.00 0.00 0.00 179.01 177.23 1r0x h SER 589 N -1.15 0.01 0.00 1.42 4.64 -1.03 -2.51 113.55 114.93 1r0x h SER 589 Ca -0.08 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.23 1r0x h SER 589 Cb 0.61 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.70 1r0x h SER 589 CO 0.13 0.79 -0.21 0.00 -0.87 0.00 0.00 176.83 176.68 1r0x h VAL 591 N -0.43 1.30 0.00 0.00 2.07 -1.55 -0.08 116.25 117.57 1r0x h VAL 591 Ca 0.00 -1.59 -0.11 0.00 0.82 0.00 0.00 66.70 65.82 1r0x h VAL 591 Cb 0.21 1.65 -0.02 0.00 -1.52 0.00 0.00 31.29 31.61 1r0x h VAL 591 CO 0.00 0.51 -0.95 0.00 0.02 0.00 0.00 177.57 177.15 1r0x n LYS 593 N -3.00 0.07 -0.31 0.00 4.76 -0.96 -4.10 118.16 114.62 1r0x n LYS 593 Ca -0.03 0.03 0.03 0.00 -2.87 0.00 0.00 58.31 55.46 1r0x n LYS 593 Cb 0.75 -0.42 0.17 0.00 -1.84 0.00 0.00 35.03 33.68 1r0x n LYS 593 CO 0.00 0.00 0.00 1.25 -1.37 0.00 0.00 177.40 177.28 1r0x h LEU 594 N -0.12 0.79 -3.25 -0.35 5.85 -1.21 -2.35 115.31 114.68 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 0.12 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 41.03 1r0x h LEU 594 CO 0.00 0.47 0.00 0.23 -0.34 0.00 0.00 178.44 178.80 1r0x n MET 595 N -4.67 4.01 -0.31 1.25 2.81 -0.06 -4.63 117.12 115.52 1r0x n MET 595 Ca 0.14 -2.96 0.26 0.00 -1.81 0.00 0.00 57.70 53.34 1r0x n MET 595 Cb 0.25 -1.98 0.59 0.00 -0.71 0.00 0.00 33.22 31.36 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 4.00 2.50 -0.41 3.04 0.00 -1.54 -1.51 119.26 125.34 1r0x h ALA 596 Ca 0.00 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1r0x h ALA 596 Cb 1.58 0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.42 1r0x h ALA 596 CO 0.29 -0.88 0.00 0.09 0.00 0.00 0.00 179.25 178.75 1r0x n ASN 597 N -4.49 3.90 -4.61 0.00 3.02 -1.26 -4.79 115.26 107.04 1r0x n ASN 597 Ca 0.25 -2.53 -0.34 0.00 -0.03 0.00 0.00 54.58 51.92 1r0x n ASN 597 Cb 0.98 -0.46 -0.10 0.00 -0.61 0.00 0.00 39.78 39.59 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 -1.97 3.92 0.27 3.52 -0.14 -0.57 -4.19 119.74 120.57 1r0x s LYS 598 Ca 0.39 -0.38 -0.31 0.00 -1.36 0.00 0.00 55.97 54.32 1r0x s LYS 598 Cb 0.27 -3.15 -0.12 0.00 -1.68 0.00 0.00 37.83 33.15 1r0x s LYS 598 CO 0.16 0.27 1.64 2.41 -0.76 0.00 0.00 175.35 179.07 1r0x n THR 599 N 3.53 0.69 -3.71 2.17 -1.04 -1.25 -4.46 114.28 110.21 1r0x n THR 599 Ca -0.17 -0.17 -0.14 0.00 -2.04 0.00 0.00 64.05 61.53 1r0x n THR 599 Cb 0.52 -1.98 -0.09 0.00 -1.82 0.00 0.00 70.33 66.96 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 0.04 0.60 -0.19 -2.82 1.70 -0.19 -2.03 118.95 116.06 1r0x s ARG 600 Ca 0.68 0.47 0.01 0.00 -0.47 0.00 0.00 55.73 56.41 1r0x s ARG 600 Cb -0.49 0.28 0.02 0.00 -0.57 0.00 0.00 34.95 34.19 1r0x s ARG 600 CO 0.43 -0.10 -0.17 0.42 -1.08 0.00 0.00 175.30 174.79 1r0x s ILE 601 N -0.13 2.22 -0.21 4.99 1.01 0.81 -0.72 121.20 129.16 1r0x s ILE 601 Ca -0.03 -0.97 -0.01 0.00 0.00 0.00 0.00 60.65 59.63 1r0x s ILE 601 Cb -0.03 -1.98 0.01 0.00 0.01 0.00 0.00 42.46 40.47 1r0x s ILE 601 CO 0.02 0.46 -0.11 -0.22 0.00 0.00 0.00 174.94 175.09 1r0x s LEU 602 N 1.29 2.69 0.00 2.97 2.96 -0.22 0.52 118.68 128.90 1r0x s LEU 602 Ca 0.04 -0.62 -0.23 0.00 -0.22 0.00 0.00 54.13 53.10 1r0x s LEU 602 Cb -0.14 -1.62 -0.05 0.00 0.50 0.00 0.00 46.19 44.88 1r0x s LEU 602 CO -0.11 -0.04 0.68 -0.69 -1.32 0.00 0.00 176.35 174.87 1r0x s VAL 603 N 1.36 4.86 0.18 1.68 1.01 0.17 -0.51 120.40 129.16 1r0x s VAL 603 Ca 0.04 1.43 -0.22 0.00 0.00 0.00 0.00 61.98 63.24 1r0x s VAL 603 Cb -0.14 -4.02 0.05 0.00 0.00 0.00 0.00 36.38 32.27 1r0x s VAL 603 CO -0.07 0.37 0.60 0.28 0.00 0.00 0.00 175.10 176.27 1r0x s THR 604 N 0.04 0.01 -0.13 3.92 -1.32 0.30 -2.20 115.64 116.25 1r0x s THR 604 Ca 0.35 -0.31 0.15 0.00 -1.21 0.00 0.00 61.69 60.67 1r0x s THR 604 Cb -0.19 -1.26 0.37 0.00 -1.51 0.00 0.00 72.50 69.90 1r0x s THR 604 CO 0.20 -0.04 1.18 -1.54 -2.21 0.00 0.00 174.62 172.21 1r0x n SER 605 N -0.38 1.55 -4.51 8.08 3.41 -1.26 -4.21 113.62 116.29 1r0x n SER 605 Ca -0.14 -3.21 -0.34 0.00 -0.26 0.00 0.00 58.87 54.93 1r0x n SER 605 Cb 0.64 -0.44 -0.12 0.00 -0.26 0.00 0.00 64.21 64.03 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 -2.24 3.35 0.18 4.33 1.02 -1.26 -4.82 119.74 120.30 1r0x s LYS 606 Ca 0.33 -0.54 0.05 0.00 0.02 0.00 0.00 55.97 55.83 1r0x s LYS 606 Cb 0.33 -2.78 0.04 0.00 -0.52 0.00 0.00 37.83 34.89 1r0x s LYS 606 CO -0.07 0.38 1.41 0.52 -0.92 0.00 0.00 175.35 176.67 1r0x h MET 607 N 6.22 0.14 -0.95 1.68 2.86 -1.96 -2.59 114.93 120.33 1r0x h MET 607 Ca -0.36 -0.14 0.21 0.00 -2.06 0.00 0.00 59.70 57.35 1r0x h MET 607 Cb 1.19 0.04 -0.08 0.00 0.06 0.00 0.00 31.60 32.81 1r0x h MET 607 CO 0.59 0.89 0.62 1.49 1.06 0.00 0.00 176.91 181.56 1r0x h GLU 608 N 0.08 0.45 -0.08 1.72 4.57 -1.98 0.11 114.58 119.44 1r0x h GLU 608 Ca -0.03 -0.03 -0.14 0.00 -1.18 0.00 0.00 59.36 57.98 1r0x h GLU 608 Cb 1.45 -0.10 -0.01 0.00 -0.16 0.00 0.00 28.75 29.93 1r0x h GLU 608 CO 0.12 0.30 -0.58 0.45 -1.18 0.00 0.00 179.01 178.12 1r0x h HIS 609 N 0.46 0.32 -0.02 0.92 3.86 -1.89 -1.84 115.15 116.96 1r0x h HIS 609 Ca 0.51 -0.12 -0.01 0.00 -1.16 0.00 0.00 60.37 59.60 1r0x h HIS 609 Cb 1.19 -0.06 -0.00 0.00 1.06 0.00 0.00 27.41 29.61 1r0x h HIS 609 CO -0.00 0.77 -0.01 -0.07 0.86 0.00 0.00 177.93 179.48 1r0x h LEU 610 N 0.19 0.05 -1.04 2.43 4.07 -1.30 -2.58 115.31 117.13 1r0x h LEU 610 Ca -0.00 -0.38 0.24 0.00 0.08 0.00 0.00 57.88 57.82 1r0x h LEU 610 Cb 1.08 -0.01 -0.12 0.00 1.08 0.00 0.00 40.66 42.69 1r0x h LEU 610 CO 0.09 0.42 0.61 -0.09 -1.08 0.00 0.00 178.44 178.38 1r0x h ARG 611 N -0.32 0.57 -0.01 1.13 2.43 -0.64 -2.23 114.38 115.30 1r0x h ARG 611 Ca 0.01 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 1r0x h ARG 611 Cb 0.40 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 29.82 1r0x h ARG 611 CO 0.00 0.38 -0.25 1.63 -1.51 0.00 0.00 179.97 180.21 1r0x n LYS 612 N -4.84 1.32 -2.25 0.20 4.76 -0.71 -4.91 118.16 111.73 1r0x n LYS 612 Ca 0.26 -0.96 -0.32 0.00 -2.87 0.00 0.00 58.31 54.42 1r0x n LYS 612 Cb 0.74 -1.48 -0.01 0.00 -1.84 0.00 0.00 35.03 32.43 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 -2.34 2.92 0.07 7.82 0.00 -0.84 -4.97 121.76 124.42 1r0x s ALA 613 Ca 0.25 0.28 -0.11 0.00 0.00 0.00 0.00 51.96 52.39 1r0x s ALA 613 Cb 0.19 -3.17 -0.26 0.00 0.00 0.00 0.00 23.12 19.88 1r0x s ALA 613 CO 0.48 -0.49 1.14 -0.44 0.00 0.00 0.00 175.76 176.44 1r0x h ASP 614 N 0.72 0.71 -4.88 0.00 3.32 -1.56 -3.44 116.42 111.29 1r0x h ASP 614 Ca -0.47 -0.67 -0.18 0.00 0.02 0.00 0.00 57.03 55.73 1r0x h ASP 614 Cb 1.20 -0.22 -0.15 0.00 0.22 0.00 0.00 39.33 40.38 1r0x h ASP 614 CO 0.60 1.50 -0.69 -0.54 -1.72 0.00 0.00 179.24 178.39 1r0x s LYS 615 N -2.91 0.75 -0.01 3.56 -0.14 -0.98 -4.65 119.74 115.36 1r0x s LYS 615 Ca -0.07 -1.30 0.02 0.00 -1.36 0.00 0.00 55.97 53.26 1r0x s LYS 615 Cb 0.06 -0.02 0.00 0.00 -1.68 0.00 0.00 37.83 36.19 1r0x s LYS 615 CO 0.91 -0.07 -0.06 0.42 -0.76 0.00 0.00 175.35 175.79 1r0x s ILE 616 N -3.76 0.53 -0.10 2.17 1.01 0.11 -1.57 121.20 119.58 1r0x s ILE 616 Ca 0.11 -0.25 -0.00 0.00 0.00 0.00 0.00 60.65 60.50 1r0x s ILE 616 Cb 0.06 -0.47 0.02 0.00 0.01 0.00 0.00 42.46 42.09 1r0x s ILE 616 CO -0.06 0.16 -0.08 -0.22 0.00 0.00 0.00 174.94 174.74 1r0x s LEU 617 N 0.04 1.22 -0.20 2.97 0.20 -0.31 -1.81 118.68 120.79 1r0x s LEU 617 Ca -0.00 -0.28 -0.06 0.00 0.69 0.00 0.00 54.13 54.48 1r0x s LEU 617 Cb -0.05 -0.79 -0.03 0.00 -0.43 0.00 0.00 46.19 44.89 1r0x s LEU 617 CO -0.00 -0.10 0.03 -0.63 -0.29 0.00 0.00 176.35 175.36 1r0x s ILE 618 N 1.53 4.24 -0.07 6.68 1.01 -0.04 -1.02 121.20 133.53 1r0x s ILE 618 Ca 0.01 -0.22 -0.02 0.00 0.00 0.00 0.00 60.65 60.42 1r0x s ILE 618 Cb -0.13 -2.93 -0.04 0.00 0.01 0.00 0.00 42.46 39.38 1r0x s ILE 618 CO -0.06 0.42 0.04 -0.76 0.00 0.00 0.00 174.94 174.58 1r0x s LEU 619 N 0.94 3.78 -0.12 2.97 1.02 -0.13 -0.52 118.68 126.62 1r0x s LEU 619 Ca 0.02 0.19 -0.05 0.00 0.02 0.00 0.00 54.13 54.32 1r0x s LEU 619 Cb -0.14 -1.96 0.06 0.00 0.02 0.00 0.00 46.19 44.17 1r0x s LEU 619 CO 0.02 0.36 0.25 -2.28 0.02 0.00 0.00 176.35 174.72 1r0x s HIS 620 N -0.98 -0.37 -1.38 0.29 2.46 0.62 -1.74 115.29 114.20 1r0x s HIS 620 Ca 0.16 0.87 -0.05 0.00 0.47 0.00 0.00 55.06 56.51 1r0x s HIS 620 Cb -0.12 -0.02 0.03 0.00 -0.13 0.00 0.00 32.58 32.34 1r0x s HIS 620 CO 0.05 -0.30 0.83 0.94 -2.47 0.00 0.00 174.74 173.79 1r0x n GLN 621 N 4.92 -5.35 -0.85 2.88 -0.06 -1.26 -0.64 117.38 117.02 1r0x n GLN 621 Ca -0.13 0.63 0.00 0.00 -2.00 0.00 0.00 57.00 55.50 1r0x n GLN 621 Cb 0.51 -5.34 0.00 0.00 -4.06 0.00 0.00 30.24 21.35 1r0x n GLN 621 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1r0x n GLY 622 N -1.62 0.68 3.59 1.69 0.00 -0.28 -4.95 105.19 104.30 1r0x n GLY 622 Ca -0.17 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.55 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 -2.67 4.45 -0.66 1.61 0.01 0.18 -1.04 113.70 115.59 1r0x s SER 623 Ca 0.00 -0.37 -0.27 0.00 1.31 0.00 0.00 55.95 56.62 1r0x s SER 623 Cb 0.00 -0.87 0.01 0.00 0.21 0.00 0.00 66.02 65.38 1r0x s SER 623 CO 0.00 0.18 1.49 -0.55 0.41 0.00 0.00 173.24 174.76 1r0x s SER 624 N -2.23 5.89 0.25 2.44 0.15 -1.26 -0.27 113.70 118.66 1r0x s SER 624 Ca 0.22 -0.04 0.03 0.00 0.70 0.00 0.00 55.95 56.87 1r0x s SER 624 Cb -0.11 -2.55 0.29 0.00 -1.71 0.00 0.00 66.02 61.94 1r0x s SER 624 CO 0.14 -1.97 1.60 0.22 1.20 0.00 0.00 173.24 174.43 1r0x h TYR 625 N 11.74 0.39 -1.77 3.44 5.03 -1.12 -3.46 116.97 131.22 1r0x h TYR 625 Ca -0.27 -0.13 0.05 0.00 2.58 0.00 0.00 58.73 60.96 1r0x h TYR 625 Cb 1.09 -0.08 -0.24 0.00 1.55 0.00 0.00 36.73 39.06 1r0x h TYR 625 CO 1.08 0.77 0.25 0.12 -1.32 0.00 0.00 178.16 179.06 1r0x s PHE 626 N -3.97 -0.73 -0.03 -3.82 2.19 -1.16 -4.98 117.98 105.47 1r0x s PHE 626 Ca -0.05 1.57 0.04 0.00 0.33 0.00 0.00 56.93 58.82 1r0x s PHE 626 Cb 0.12 0.42 -0.00 0.00 -1.31 0.00 0.00 43.02 42.26 1r0x s PHE 626 CO 0.80 -0.36 -0.14 -0.47 1.83 0.00 0.00 175.22 176.88 1r0x s TYR 627 N 1.02 1.40 -5.00 10.12 5.04 -1.26 -0.86 117.35 127.81 1r0x s TYR 627 Ca -0.05 -0.38 0.00 0.00 -2.44 0.00 0.00 57.07 54.20 1r0x s TYR 627 Cb -0.05 -0.96 0.00 0.00 0.35 0.00 0.00 41.96 41.31 1r0x s TYR 627 CO -0.12 -0.13 0.00 0.41 -1.34 0.00 0.00 175.55 174.37 1r0x n GLY 628 N 3.17 -0.01 3.97 8.97 0.00 -0.75 -4.98 105.19 115.56 1r0x n GLY 628 Ca -0.18 -1.12 -0.21 0.00 0.00 0.00 0.00 46.02 44.51 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 -3.91 4.14 0.28 2.61 -4.23 -1.26 0.04 115.64 113.31 1r0x s THR 629 Ca 0.00 -0.72 0.01 0.00 -1.18 0.00 0.00 61.69 59.80 1r0x s THR 629 Cb 0.00 -3.49 0.26 0.00 1.34 0.00 0.00 72.50 70.62 1r0x s THR 629 CO 0.00 -0.27 1.78 0.15 -0.54 0.00 0.00 174.62 175.73 1r0x h PHE 630 N 0.65 0.90 -0.28 3.99 3.57 -1.85 -1.31 116.94 122.61 1r0x h PHE 630 Ca -0.46 0.03 -0.14 0.00 3.53 0.00 0.00 57.97 60.93 1r0x h PHE 630 Cb 1.25 -0.26 -0.01 0.00 2.79 0.00 0.00 35.95 39.72 1r0x h PHE 630 CO 0.44 0.23 -0.39 0.77 -2.23 0.00 0.00 178.31 177.14 1r0x h SER 631 N 0.71 0.69 -0.03 0.41 0.02 -1.96 -1.81 113.55 111.58 1r0x h SER 631 Ca 0.50 -0.30 -0.05 0.00 -0.84 0.00 0.00 61.79 61.10 1r0x h SER 631 Cb 0.70 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 63.03 1r0x h SER 631 CO -0.35 1.00 -0.10 -0.33 -1.14 0.00 0.00 176.83 175.91 1r0x h GLU 632 N 0.54 0.28 -0.74 3.45 5.08 -1.84 -2.62 114.58 118.74 1r0x h GLU 632 Ca 0.05 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.34 1r0x h GLU 632 Cb 0.91 -0.04 -0.04 0.00 0.50 0.00 0.00 28.75 30.08 1r0x h GLU 632 CO 0.08 0.39 0.43 1.25 -1.00 0.00 0.00 179.01 180.16 1r0x h LEU 633 N 0.27 0.89 -0.81 1.33 5.85 -0.43 0.27 115.31 122.68 1r0x h LEU 633 Ca 0.06 -0.07 -0.11 0.00 0.84 0.00 0.00 57.88 58.59 1r0x h LEU 633 Cb 0.35 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.14 1r0x h LEU 633 CO 0.02 0.71 -0.32 1.56 -0.34 0.00 0.00 178.44 180.06 1r0x h GLN 634 N 1.01 0.52 0.05 1.25 4.20 -1.07 0.14 115.11 121.20 1r0x h GLN 634 Ca 0.26 -0.23 -0.37 0.00 0.06 0.00 0.00 58.65 58.38 1r0x h GLN 634 Cb -0.01 -0.01 -0.05 0.00 0.30 0.00 0.00 27.48 27.70 1r0x h GLN 634 CO -0.05 0.78 -2.20 -1.13 -0.67 0.00 0.00 178.83 175.56 1r0x n SER 635 N -4.07 1.67 0.15 1.46 3.41 -1.02 -4.01 113.62 111.20 1r0x n SER 635 Ca -0.01 0.07 0.12 0.00 -0.26 0.00 0.00 58.87 58.79 1r0x n SER 635 Cb 0.46 -0.37 0.17 0.00 -0.26 0.00 0.00 64.21 64.21 1r0x n SER 635 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1r0x h LEU 636 N 0.03 0.00 -5.85 1.04 3.38 -0.48 -3.37 115.31 110.05 1r0x h LEU 636 Ca -0.48 -0.03 -0.53 0.00 0.09 0.00 0.00 57.88 56.92 1r0x h LEU 636 Cb 2.01 0.00 -0.40 0.00 0.09 0.00 0.00 40.66 42.35 1r0x h LEU 636 CO 0.01 0.01 -0.99 0.54 0.09 0.00 0.00 178.44 178.10 1r0x n ARG 637 N -2.72 1.62 -0.05 1.13 5.12 0.48 -4.97 116.66 117.26 1r0x n ARG 637 Ca 0.03 -3.83 -0.04 0.00 -1.93 0.00 0.00 57.85 52.08 1r0x n ARG 637 Cb 0.51 -1.79 0.18 0.00 -1.16 0.00 0.00 32.46 30.20 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 3.30 0.65 0.31 5.56 0.13 -1.71 -0.15 132.00 140.09 1r0x h PRO 638 Ca 0.11 -0.20 -0.02 0.00 -0.87 0.00 0.00 66.00 65.02 1r0x h PRO 638 Cb 0.81 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 31.88 1r0x h PRO 638 CO 0.60 0.75 -0.15 -0.44 -0.23 0.00 0.00 178.00 178.53 1r0x h ASP 639 N 0.59 -0.35 0.05 1.44 3.45 -1.93 0.11 116.42 119.78 1r0x h ASP 639 Ca 0.10 -0.14 0.03 0.00 0.43 0.00 0.00 57.03 57.45 1r0x h ASP 639 Cb 0.55 0.09 -0.04 0.00 -0.56 0.00 0.00 39.33 39.36 1r0x h ASP 639 CO 0.03 -0.04 -0.29 0.15 -1.57 0.00 0.00 179.24 177.52 1r0x h PHE 640 N -0.68 -0.79 -0.33 4.55 3.04 -1.87 -2.48 116.94 118.36 1r0x h PHE 640 Ca -0.04 0.02 -0.01 0.00 3.98 0.00 0.00 57.97 61.92 1r0x h PHE 640 Cb 0.48 0.34 -0.02 0.00 2.56 0.00 0.00 35.95 39.31 1r0x h PHE 640 CO 0.01 -0.39 0.16 0.77 -2.02 0.00 0.00 178.31 176.84 1r0x h SER 641 N -0.47 0.44 -0.30 0.41 0.02 -1.04 -1.16 113.55 111.46 1r0x h SER 641 Ca 0.05 -0.13 0.05 0.00 -0.84 0.00 0.00 61.79 60.92 1r0x h SER 641 Cb 0.53 -0.11 -0.05 0.00 0.14 0.00 0.00 62.40 62.91 1r0x h SER 641 CO -0.22 0.44 -0.00 -1.28 -1.14 0.00 0.00 176.83 174.64 1r0x h SER 642 N 0.40 -0.12 -0.21 3.07 0.87 -0.55 0.41 113.55 117.42 1r0x h SER 642 Ca 0.11 0.07 -0.08 0.00 -1.23 0.00 0.00 61.79 60.66 1r0x h SER 642 Cb 0.12 0.12 -0.02 0.00 -0.44 0.00 0.00 62.40 62.19 1r0x h SER 642 CO -0.01 -0.03 -0.13 0.50 -0.53 0.00 0.00 176.83 176.63 1r0x h LYS 643 N 0.09 0.62 0.21 2.24 1.63 -1.30 -1.68 116.57 118.37 1r0x h LYS 643 Ca 0.14 -0.20 -0.32 0.00 -0.85 0.00 0.00 60.65 59.43 1r0x h LYS 643 Cb 0.19 -0.06 0.03 0.00 -0.60 0.00 0.00 32.23 31.79 1r0x h LYS 643 CO -0.24 0.73 -1.41 -0.07 -3.45 0.00 0.00 179.45 175.01 1r0x h LEU 644 N 0.56 0.70 0.00 5.20 4.07 0.13 -2.93 115.31 123.03 1r0x h LEU 644 Ca 0.10 -0.75 0.00 0.00 0.08 0.00 0.00 57.88 57.31 1r0x h LEU 644 Cb 0.56 -0.23 0.00 0.00 1.08 0.00 0.00 40.66 42.07 1r0x h LEU 644 CO 0.04 1.59 0.00 0.23 -1.08 0.00 0.00 178.44 179.21 1r0x n MET 645 N -3.65 0.62 0.15 1.13 2.81 0.13 -3.90 117.12 114.41 1r0x n MET 645 Ca -0.14 0.02 0.03 0.00 -1.81 0.00 0.00 57.70 55.80 1r0x n MET 645 Cb 1.08 -1.50 0.06 0.00 -0.71 0.00 0.00 33.22 32.15 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 4.26 0.00 -1.67 3.03 0.00 -1.10 -3.45 103.07 104.14 1r0x h GLY 646 Ca 0.00 0.00 -0.50 0.00 0.00 0.00 0.00 47.33 46.83 1r0x h GLY 646 CO 0.00 0.00 0.37 -0.19 0.00 0.00 0.00 176.54 176.72 1r0x s TYR 647 N -3.03 2.89 -0.01 5.60 1.51 -1.25 -5.00 117.35 118.06 1r0x s TYR 647 Ca 0.04 1.51 -0.09 0.00 -1.01 0.00 0.00 57.07 57.52 1r0x s TYR 647 Cb 0.08 -3.04 -0.31 0.00 -0.11 0.00 0.00 41.96 38.59 1r0x s TYR 647 CO 0.74 -1.29 0.83 -0.44 -1.11 0.00 0.00 175.55 174.27 1r0x h ASP 648 N 0.17 0.57 -1.40 2.29 3.32 -1.94 -3.40 116.42 116.02 1r0x h ASP 648 Ca -0.46 -0.76 -0.41 0.00 0.02 0.00 0.00 57.03 55.41 1r0x h ASP 648 Cb 1.23 -0.19 -0.40 0.00 0.22 0.00 0.00 39.33 40.19 1r0x h ASP 648 CO 0.56 1.63 -1.19 0.35 -1.72 0.00 0.00 179.24 178.87 1r0x n THR 649 N -3.56 0.59 -0.33 0.35 -2.24 -1.26 -4.95 114.28 102.88 1r0x n THR 649 Ca -0.19 -3.70 0.27 0.00 -2.27 0.00 0.00 64.05 58.16 1r0x n THR 649 Cb 1.07 0.26 0.52 0.00 -2.10 0.00 0.00 70.33 70.07 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 0.89 0.00 4.78 3.57 -1.92 -2.00 116.94 125.26 1r0x h PHE 650 Ca -0.01 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.52 1r0x h PHE 650 Cb 1.09 -0.22 0.00 0.00 2.79 0.00 0.00 35.95 39.61 1r0x h PHE 650 CO 0.49 -0.29 0.00 -0.44 -2.23 0.00 0.00 178.31 175.84 1r0x h ASP 651 N 0.20 0.00 -0.19 0.41 5.19 -1.92 -0.73 116.42 119.39 1r0x h ASP 651 Ca 0.78 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 57.19 1r0x h ASP 651 Cb 1.88 0.00 0.00 0.00 0.18 0.00 0.00 39.33 41.39 1r0x h ASP 651 CO -0.67 0.00 0.00 0.00 -3.12 0.00 0.00 179.24 175.45 1r0x n GLN 652 N -2.80 2.03 -1.24 3.56 6.02 -0.75 -4.91 117.38 119.28 1r0x n GLN 652 Ca 0.02 -1.53 -0.30 0.00 -0.01 0.00 0.00 57.00 55.17 1r0x n GLN 652 Cb 0.34 -1.45 0.11 0.00 1.02 0.00 0.00 30.24 30.25 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 -1.77 2.48 0.93 1.08 2.99 -0.28 -5.00 117.98 118.40 1r0x s PHE 653 Ca 0.34 1.42 -0.11 0.00 0.00 0.00 0.00 56.93 58.59 1r0x s PHE 653 Cb 0.20 -3.09 0.15 0.00 0.00 0.00 0.00 43.02 40.28 1r0x s PHE 653 CO 0.29 -2.04 1.12 0.95 -0.00 0.00 0.00 175.22 175.54 1r0x s THR 654 N -2.92 2.30 0.34 0.64 -4.23 -1.26 -4.74 115.64 105.76 1r0x s THR 654 Ca 0.62 0.10 0.04 0.00 -1.18 0.00 0.00 61.69 61.27 1r0x s THR 654 Cb -0.17 -2.23 0.17 0.00 1.34 0.00 0.00 72.50 71.61 1r0x s THR 654 CO 0.56 -0.13 1.89 -0.08 -0.54 0.00 0.00 174.62 176.33 1r0x h GLU 655 N -1.84 0.57 0.08 3.99 4.22 -1.89 -0.34 114.58 119.36 1r0x h GLU 655 Ca -0.46 -0.11 -0.00 0.00 0.08 0.00 0.00 59.36 58.87 1r0x h GLU 655 Cb 1.27 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 30.43 1r0x h GLU 655 CO 0.45 0.55 -0.04 1.49 -2.18 0.00 0.00 179.01 179.29 1r0x h GLU 656 N 0.55 -0.10 -0.04 1.92 4.81 -1.91 -0.88 114.58 118.93 1r0x h GLU 656 Ca 0.12 0.01 0.01 0.00 -0.13 0.00 0.00 59.36 59.37 1r0x h GLU 656 Cb 0.27 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.66 1r0x h GLU 656 CO 0.00 0.07 -0.03 -0.09 -0.73 0.00 0.00 179.01 178.24 1r0x h ARG 657 N -0.26 -0.03 -0.61 1.92 9.65 -1.88 0.15 114.38 123.33 1r0x h ARG 657 Ca -0.01 0.00 0.07 0.00 -1.10 0.00 0.00 59.98 58.94 1r0x h ARG 657 Cb 0.22 0.01 -0.06 0.00 -1.39 0.00 0.00 29.97 28.75 1r0x h ARG 657 CO 0.02 -0.02 0.30 0.00 2.80 0.00 0.00 179.97 183.07 1r0x h ARG 658 N -0.03 0.54 -0.09 0.20 3.08 -1.00 0.96 114.38 118.03 1r0x h ARG 658 Ca 0.03 -0.03 -0.13 0.00 0.07 0.00 0.00 59.98 59.91 1r0x h ARG 658 Cb 0.07 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 29.99 1r0x h ARG 658 CO -0.06 0.35 -0.53 0.77 -1.07 0.00 0.00 179.97 179.43 1r0x h SER 659 N 0.55 0.29 0.18 7.04 0.02 -0.89 -1.70 113.55 119.05 1r0x h SER 659 Ca 0.29 -0.15 -0.20 0.00 -0.84 0.00 0.00 61.79 60.89 1r0x h SER 659 Cb 0.24 -0.08 -0.00 0.00 0.14 0.00 0.00 62.40 62.70 1r0x h SER 659 CO -0.22 0.77 -0.77 0.77 -1.14 0.00 0.00 176.83 176.24 1r0x h SER 660 N 0.21 0.59 -0.41 3.07 4.64 0.55 -1.83 113.55 120.38 1r0x h SER 660 Ca 0.00 -0.40 0.00 0.00 -0.47 0.00 0.00 61.79 60.93 1r0x h SER 660 Cb 1.00 -0.18 -0.02 0.00 -0.31 0.00 0.00 62.40 62.90 1r0x h SER 660 CO 0.08 1.16 0.26 0.40 -0.87 0.00 0.00 176.83 177.87 1r0x h ILE 661 N 0.33 1.11 -0.43 0.95 2.04 -0.73 -1.40 117.51 119.39 1r0x h ILE 661 Ca -0.04 -0.23 0.05 0.00 1.00 0.00 0.00 64.86 65.64 1r0x h ILE 661 Cb 1.36 0.53 -0.05 0.00 -0.74 0.00 0.00 36.82 37.93 1r0x h ILE 661 CO 0.14 0.11 0.15 -0.07 0.00 0.00 0.00 178.15 178.48 1r0x h LEU 662 N 0.55 0.15 0.20 1.44 3.38 -1.30 0.19 115.31 119.92 1r0x h LEU 662 Ca 0.15 0.05 -0.00 0.00 0.09 0.00 0.00 57.88 58.17 1r0x h LEU 662 Cb -0.04 0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 1r0x h LEU 662 CO -0.03 0.12 -0.14 0.74 0.09 0.00 0.00 178.44 179.22 1r0x h THR 663 N 0.31 0.69 -0.28 0.22 2.02 -1.14 0.23 112.91 114.97 1r0x h THR 663 Ca 0.20 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.39 1r0x h THR 663 Cb 0.19 0.69 -0.02 0.00 -1.74 0.00 0.00 68.15 67.28 1r0x h THR 663 CO -0.21 0.00 0.17 -0.33 0.37 0.00 0.00 175.52 175.52 1r0x h GLU 664 N -0.35 0.34 -0.56 6.66 5.08 -1.12 0.93 114.58 125.55 1r0x h GLU 664 Ca -0.01 -0.02 0.02 0.00 -1.00 0.00 0.00 59.36 58.35 1r0x h GLU 664 Cb 0.30 -0.08 -0.04 0.00 0.50 0.00 0.00 28.75 29.44 1r0x h GLU 664 CO 0.00 0.23 0.34 1.15 -1.00 0.00 0.00 179.01 179.73 1r0x h THR 665 N 0.35 1.07 -0.50 1.13 2.02 -0.73 -0.47 112.91 115.78 1r0x h THR 665 Ca 0.11 -0.23 -0.06 0.00 0.77 0.00 0.00 66.41 66.99 1r0x h THR 665 Cb -0.02 0.33 -0.02 0.00 -1.74 0.00 0.00 68.15 66.70 1r0x h THR 665 CO -0.04 0.12 0.06 -0.07 0.37 0.00 0.00 175.52 175.97 1r0x h LEU 666 N 0.68 0.75 -0.60 2.58 4.07 -0.02 -1.97 115.31 120.80 1r0x h LEU 666 Ca 0.22 -0.16 -0.01 0.00 0.08 0.00 0.00 57.88 58.01 1r0x h LEU 666 Cb 0.01 -0.20 -0.03 0.00 1.08 0.00 0.00 40.66 41.53 1r0x h LEU 666 CO -0.09 0.78 0.32 0.03 -1.08 0.00 0.00 178.44 178.40 1r0x h ARG 667 N 0.76 0.84 -0.02 1.13 3.08 -0.20 -2.81 114.38 117.17 1r0x h ARG 667 Ca 0.16 -0.10 0.00 0.00 0.07 0.00 0.00 59.98 60.11 1r0x h ARG 667 Cb 0.37 -0.16 -0.00 0.00 0.08 0.00 0.00 29.97 30.25 1r0x h ARG 667 CO 0.01 0.65 -0.01 0.00 -1.07 0.00 0.00 179.97 179.54 1r0x h ARG 668 N 0.81 -0.01 -0.57 0.04 3.08 -0.59 -3.31 114.38 113.82 1r0x h ARG 668 Ca 0.21 0.00 -0.34 0.00 0.07 0.00 0.00 59.98 59.92 1r0x h ARG 668 Cb 0.06 0.00 -0.20 0.00 0.08 0.00 0.00 29.97 29.91 1r0x h ARG 668 CO -0.03 -0.01 0.03 1.19 -1.07 0.00 0.00 179.97 180.08 1r0x n PHE 669 N -5.11 1.84 0.00 3.04 3.72 -0.79 -5.11 117.46 115.05 1r0x n PHE 669 Ca -0.07 -1.90 0.00 0.00 -0.05 0.00 0.00 57.45 55.43 1r0x n PHE 669 Cb 0.05 -0.65 0.00 0.00 -0.94 0.00 0.00 39.48 37.93 1r0x n PHE 669 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58