#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2zag n SER 489 N 0.00 7.45 0.00 3.42 7.64 -1.26 -4.66 113.62 126.21 2zag n SER 489 Ca 0.00 -3.76 0.00 0.00 1.01 0.00 0.00 58.87 56.12 2zag n SER 489 Cb 0.00 -1.07 0.00 0.00 -1.01 0.00 0.00 64.21 62.13 2zag n SER 489 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2zag n GLY 490 N -0.46 1.29 0.23 0.23 0.00 -1.26 -0.22 105.19 105.00 2zag n GLY 490 Ca 0.55 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.57 2zag n GLY 490 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 2zag h TRP 491 N 0.00 0.27 0.42 1.61 4.06 -1.95 -0.64 115.95 119.72 2zag h TRP 491 Ca 0.00 0.03 -0.01 0.00 2.06 0.00 0.00 58.89 60.98 2zag h TRP 491 Cb 0.00 -0.03 -0.02 0.00 -1.00 0.00 0.00 29.16 28.11 2zag h TRP 491 CO 0.00 0.01 -0.40 1.49 -3.56 0.00 0.00 178.44 175.99 2zag h GLU 492 N 0.31 -0.80 -0.65 0.49 4.81 -1.91 -0.40 114.58 116.42 2zag h GLU 492 Ca 0.31 0.05 0.07 0.00 -0.13 0.00 0.00 59.36 59.67 2zag h GLU 492 Cb 0.43 0.18 -0.06 0.00 0.63 0.00 0.00 28.75 29.93 2zag h GLU 492 CO -0.36 -0.53 0.33 -0.44 -0.73 0.00 0.00 179.01 177.27 2zag h ASP 493 N -0.83 0.45 0.35 1.04 3.32 -1.91 -1.29 116.42 117.56 2zag h ASP 493 Ca -0.04 0.05 -0.01 0.00 0.02 0.00 0.00 57.03 57.05 2zag h ASP 493 Cb 0.73 -0.04 -0.02 0.00 0.22 0.00 0.00 39.33 40.23 2zag h ASP 493 CO -0.05 0.28 -0.37 0.00 -1.72 0.00 0.00 179.24 177.38 2zag h ALA 494 N 1.37 -1.04 -0.50 3.45 0.00 -0.75 0.50 119.26 122.30 2zag h ALA 494 Ca 0.30 -0.14 0.09 0.00 0.00 0.00 0.00 54.91 55.17 2zag h ALA 494 Cb 0.26 0.61 -0.07 0.00 0.00 0.00 0.00 17.79 18.59 2zag h ALA 494 CO -0.22 -1.07 0.08 -0.07 0.00 0.00 0.00 179.25 177.97 2zag h LEU 495 N -0.73 -0.05 0.16 0.00 3.38 -0.96 -0.43 115.31 116.68 2zag h LEU 495 Ca -0.04 0.10 0.02 0.00 0.09 0.00 0.00 57.88 58.04 2zag h LEU 495 Cb 0.64 0.14 -0.04 0.00 0.09 0.00 0.00 40.66 41.49 2zag h LEU 495 CO -0.05 0.00 -0.32 0.50 0.09 0.00 0.00 178.44 178.65 2zag h LYS 496 N 0.20 -0.55 -0.76 1.13 3.64 -0.97 -1.37 116.57 117.90 2zag h LYS 496 Ca 0.25 0.04 0.17 0.00 -1.27 0.00 0.00 60.65 59.84 2zag h LYS 496 Cb 0.35 0.13 -0.12 0.00 -0.41 0.00 0.00 32.23 32.18 2zag h LYS 496 CO -0.35 -0.37 0.13 2.35 -2.27 0.00 0.00 179.45 178.94 2zag h TRP 497 N -0.58 0.18 0.29 1.91 7.01 0.88 -1.94 115.95 123.70 2zag h TRP 497 Ca 0.02 0.05 0.00 0.00 2.11 0.00 0.00 58.89 61.07 2zag h TRP 497 Cb 0.59 0.04 -0.03 0.00 -2.10 0.00 0.00 29.16 27.66 2zag h TRP 497 CO -0.27 -0.15 -0.40 -0.07 -2.79 0.00 0.00 178.44 174.75 2zag h LEU 498 N 0.20 -1.14 -0.34 0.65 3.38 -0.04 -0.71 115.31 117.32 2zag h LEU 498 Ca 0.43 0.11 0.00 0.00 0.09 0.00 0.00 57.88 58.51 2zag h LEU 498 Cb 0.77 0.40 0.00 0.00 0.09 0.00 0.00 40.66 41.92 2zag h LEU 498 CO -0.58 -0.52 0.00 -2.11 0.09 0.00 0.00 178.44 175.32 2zag n ARG 499 N -5.48 0.53 -0.06 1.13 1.85 -0.77 -1.32 116.66 112.54 2zag n ARG 499 Ca -0.09 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.76 2zag n ARG 499 Cb 0.39 -1.09 0.00 0.00 -1.05 0.00 0.00 32.46 30.71 2zag n ARG 499 CO 0.00 0.00 0.00 0.39 -0.01 0.00 0.00 177.63 178.01 2zag n GLU 500 N -0.25 0.23 0.00 2.89 1.02 -0.56 -4.84 120.64 119.14 2zag n GLU 500 Ca 0.00 -0.66 0.00 0.00 -0.02 0.00 0.00 57.16 56.48 2zag n GLU 500 Cb 0.04 -0.55 0.00 0.00 -0.02 0.00 0.00 31.44 30.92 2zag n GLU 500 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2zag n ASN 501 N -0.05 0.00 -4.01 1.62 4.13 -0.38 -5.01 115.26 111.55 2zag n ASN 501 Ca 0.00 -1.00 -0.10 0.00 1.68 0.00 0.00 54.58 55.17 2zag n ASN 501 Cb 0.51 0.00 -0.11 0.00 -1.54 0.00 0.00 39.78 38.64 2zag n ASN 501 CO 0.00 0.00 0.00 0.42 0.28 0.00 0.00 177.26 177.96 2zag s THR 502 N 0.00 0.20 0.29 3.41 -4.23 -0.44 -5.00 115.64 109.88 2zag s THR 502 Ca 0.00 -1.04 -0.26 0.00 -1.18 0.00 0.00 61.69 59.21 2zag s THR 502 Cb 0.00 -0.46 -0.15 0.00 1.34 0.00 0.00 72.50 73.23 2zag s THR 502 CO 0.00 -0.53 0.66 -2.65 -0.54 0.00 0.00 174.62 171.56 2zag n PRO 503 N 1.41 0.58 0.00 3.99 -0.02 -1.26 -4.80 135.00 134.90 2zag n PRO 503 Ca -0.23 0.21 0.02 0.00 -2.02 0.00 0.00 63.50 61.48 2zag n PRO 503 Cb 0.56 -1.40 0.10 0.00 -0.02 0.00 0.00 33.50 32.74 2zag n PRO 503 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 2zag n GLU 504 N 0.84 0.01 -0.06 -0.52 0.00 -1.26 -1.76 120.64 117.89 2zag n GLU 504 Ca 0.13 0.38 0.06 0.00 0.00 0.00 0.00 57.16 57.74 2zag n GLU 504 Cb 0.31 -1.50 0.08 0.00 0.00 0.00 0.00 31.44 30.34 2zag n GLU 504 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 2zag n TYR 505 N -1.45 0.00 -2.35 -1.84 0.53 -1.26 -4.99 117.16 105.80 2zag n TYR 505 Ca 0.01 -0.77 -0.41 0.00 -1.02 0.00 0.00 57.90 55.72 2zag n TYR 505 Cb 0.05 -0.11 -0.03 0.00 -1.03 0.00 0.00 39.34 38.21 2zag n TYR 505 CO 0.00 0.00 0.00 -1.12 -1.02 0.00 0.00 176.86 174.72 2zag s SER 506 N -2.08 7.08 -0.22 7.72 0.01 -0.72 -4.87 113.70 120.61 2zag s SER 506 Ca 0.19 2.38 -0.13 0.00 1.31 0.00 0.00 55.95 59.70 2zag s SER 506 Cb 0.16 -2.63 -0.05 0.00 0.21 0.00 0.00 66.02 63.72 2zag s SER 506 CO 0.02 -0.31 0.25 -0.89 0.41 0.00 0.00 173.24 172.72 2zag s THR 507 N -0.86 5.30 0.42 1.44 2.01 -1.26 -4.82 115.64 117.87 2zag s THR 507 Ca 0.48 0.39 0.08 0.00 0.31 0.00 0.00 61.69 62.94 2zag s THR 507 Cb -0.34 -3.59 -0.02 0.00 0.01 0.00 0.00 72.50 68.55 2zag s THR 507 CO 0.43 0.31 0.36 0.00 -0.69 0.00 0.00 174.62 175.03 2zag s ALA 508 N 1.15 4.02 0.08 7.40 0.00 0.10 -0.70 121.76 133.81 2zag s ALA 508 Ca 0.12 -1.91 -0.22 0.00 0.00 0.00 0.00 51.96 49.95 2zag s ALA 508 Cb -0.14 -0.96 0.05 0.00 0.00 0.00 0.00 23.12 22.08 2zag s ALA 508 CO 0.06 -0.22 0.52 0.99 0.00 0.00 0.00 175.76 177.11 2zag s THR 509 N -2.48 0.03 0.04 0.00 2.01 -0.53 -2.29 115.64 112.41 2zag s THR 509 Ca 0.48 -0.25 -0.26 0.00 0.31 0.00 0.00 61.69 61.97 2zag s THR 509 Cb -0.03 -1.01 0.06 0.00 0.01 0.00 0.00 72.50 71.54 2zag s THR 509 CO 0.27 -0.14 0.60 -0.94 -0.69 0.00 0.00 174.62 173.73 2zag s SER 510 N -2.22 -0.56 0.36 3.53 1.04 -1.26 -0.53 113.70 114.07 2zag s SER 510 Ca -0.03 0.34 -0.28 0.00 0.48 0.00 0.00 55.95 56.46 2zag s SER 510 Cb -0.00 0.54 -0.11 0.00 0.10 0.00 0.00 66.02 66.54 2zag s SER 510 CO -0.05 -0.74 1.51 1.87 0.98 0.00 0.00 173.24 176.81 2zag n TRP 511 N 0.40 2.98 -1.22 5.02 -0.00 -1.26 -1.46 117.44 121.90 2zag n TRP 511 Ca -0.18 0.41 -0.10 0.00 -0.00 0.00 0.00 57.50 57.63 2zag n TRP 511 Cb 0.60 -2.55 -0.04 0.00 -0.00 0.00 0.00 31.31 29.32 2zag n TRP 511 CO 0.00 0.00 0.00 1.87 -0.00 0.00 0.00 177.69 179.56 2zag n TRP 512 N 0.72 -0.31 -4.03 5.87 -0.00 -1.26 -3.19 117.44 115.24 2zag n TRP 512 Ca 0.02 0.00 -0.30 0.00 -0.00 0.00 0.00 57.50 57.23 2zag n TRP 512 Cb 0.39 -2.32 -0.03 0.00 -0.00 0.00 0.00 31.31 29.35 2zag n TRP 512 CO 0.00 0.00 0.00 -0.25 -0.00 0.00 0.00 177.69 177.44 2zag n ASP 513 N -0.27 -0.93 -0.07 5.87 10.43 -0.54 -4.88 116.55 126.16 2zag n ASP 513 Ca -0.10 -1.11 -0.13 0.00 2.57 0.00 0.00 54.79 56.01 2zag n ASP 513 Cb 0.40 -2.56 -0.06 0.00 1.84 0.00 0.00 41.12 40.74 2zag n ASP 513 CO 0.00 0.00 0.00 1.88 -1.07 0.00 0.00 177.20 178.01 2zag h TYR 514 N -1.92 0.63 -0.56 1.24 -1.99 -1.78 -2.55 116.97 110.05 2zag h TYR 514 Ca -0.65 -0.19 0.11 0.00 2.00 0.00 0.00 58.73 60.00 2zag h TYR 514 Cb 1.38 -0.13 -0.10 0.00 2.00 0.00 0.00 36.73 39.88 2zag h TYR 514 CO 0.47 0.87 -0.08 0.78 -0.00 0.00 0.00 178.16 180.20 2zag h GLY 515 N 0.20 0.48 0.13 3.88 0.00 -1.90 0.14 103.07 106.00 2zag h GLY 515 Ca 0.03 0.14 -0.01 0.00 0.00 0.00 0.00 47.33 47.50 2zag h GLY 515 CO 0.05 -0.20 -0.07 -1.82 0.00 0.00 0.00 176.54 174.50 2zag h TYR 516 N 0.04 -0.19 -1.08 5.60 3.20 -1.93 -2.71 116.97 119.90 2zag h TYR 516 Ca 0.28 -0.00 0.42 0.00 3.14 0.00 0.00 58.73 62.56 2zag h TYR 516 Cb 0.43 0.07 -0.16 0.00 1.54 0.00 0.00 36.73 38.61 2zag h TYR 516 CO -0.41 -0.11 0.63 1.87 -1.64 0.00 0.00 178.16 178.50 2zag n TRP 517 N -2.59 0.95 -0.04 -3.82 -0.00 -0.95 0.07 117.44 111.05 2zag n TRP 517 Ca -0.02 0.95 -0.17 0.00 -0.00 0.00 0.00 57.50 58.27 2zag n TRP 517 Cb 0.08 -1.37 -0.07 0.00 -0.00 0.00 0.00 31.31 29.95 2zag n TRP 517 CO 0.00 0.00 0.00 0.82 -0.00 0.00 0.00 177.69 178.51 2zag h ILE 518 N 0.00 1.29 0.11 5.87 2.04 -0.63 0.23 117.51 126.42 2zag h ILE 518 Ca 0.82 -1.87 -0.01 0.00 1.00 0.00 0.00 64.86 64.80 2zag h ILE 518 Cb 2.34 1.94 0.00 0.00 -0.74 0.00 0.00 36.82 40.36 2zag h ILE 518 CO -0.62 0.59 -0.05 -0.08 0.00 0.00 0.00 178.15 177.99 2zag h GLU 519 N 0.48 -0.14 0.00 2.37 4.81 -0.44 -2.30 114.58 119.37 2zag h GLU 519 Ca -0.03 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.21 2zag h GLU 519 Cb 1.29 0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.70 2zag h GLU 519 CO 0.14 0.36 0.00 0.45 -0.73 0.00 0.00 179.01 179.23 2zag n SER 520 N -4.85 0.00 -2.85 1.04 2.88 0.11 -0.65 113.62 109.29 2zag n SER 520 Ca -0.08 0.52 0.00 0.00 -1.33 0.00 0.00 58.87 57.99 2zag n SER 520 Cb 0.28 -0.02 0.00 0.00 -0.75 0.00 0.00 64.21 63.72 2zag n SER 520 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2zag n SER 521 N -0.87 -0.03 0.00 -3.46 7.64 0.07 -2.88 113.62 114.08 2zag n SER 521 Ca 0.00 -0.21 0.00 0.00 1.01 0.00 0.00 58.87 59.67 2zag n SER 521 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 2zag n SER 521 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92 2zag n LEU 522 N 0.00 0.00 -0.11 -3.43 7.94 -1.26 -1.66 117.00 118.48 2zag n LEU 522 Ca 0.00 0.00 -0.11 0.00 -1.11 0.00 0.00 56.01 54.79 2zag n LEU 522 Cb 0.00 0.00 0.01 0.00 0.53 0.00 0.00 43.42 43.96 2zag n LEU 522 CO 0.00 0.00 0.60 -0.07 -1.11 0.00 0.00 177.39 176.81 2zag h LEU 523 N 0.00 0.93 -2.51 -1.96 3.38 -1.57 -3.50 115.31 110.08 2zag h LEU 523 Ca 0.00 -0.40 0.00 0.00 0.09 0.00 0.00 57.88 57.57 2zag h LEU 523 Cb 0.00 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.45 2zag h LEU 523 CO 0.00 1.17 -0.71 0.61 0.09 0.00 0.00 178.44 179.60 2zag n GLY 524 N 0.02 -3.95 0.00 0.83 0.00 0.17 -5.04 105.19 97.22 2zag n GLY 524 Ca -0.01 0.51 0.00 0.00 0.00 0.00 0.00 46.02 46.52 2zag n GLY 524 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2zag n GLN 525 N 0.68 0.00 -0.10 1.61 0.00 -1.17 -5.02 117.38 113.38 2zag n GLN 525 Ca -0.13 0.00 -0.01 0.00 0.00 0.00 0.00 57.00 56.85 2zag n GLN 525 Cb 0.21 0.00 0.01 0.00 0.00 0.00 0.00 30.24 30.46 2zag n GLN 525 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.06 179.95 2zag n ARG 526 N 0.00 -0.06 0.00 2.61 0.00 -1.26 -4.49 116.66 113.45 2zag n ARG 526 Ca 0.00 -0.10 0.00 0.00 -0.00 0.00 0.00 57.85 57.75 2zag n ARG 526 Cb 0.00 -0.07 0.00 0.00 -0.00 0.00 0.00 32.46 32.39 2zag n ARG 526 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 2zag n ARG 527 N -1.14 0.00 0.00 2.89 1.74 -1.26 -5.08 116.66 113.80 2zag n ARG 527 Ca 0.01 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.09 2zag n ARG 527 Cb 0.03 -0.01 0.00 0.00 -1.02 0.00 0.00 32.46 31.46 2zag n ARG 527 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2zag n ALA 528 N -2.42 1.36 0.00 7.54 0.00 -1.26 -5.06 120.51 120.66 2zag n ALA 528 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2zag n ALA 528 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2zag n ALA 528 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2zag n SER 529 N -2.28 0.00 -3.09 0.00 3.41 -1.26 -4.54 113.62 105.86 2zag n SER 529 Ca 0.00 0.00 -0.31 0.00 -0.26 0.00 0.00 58.87 58.30 2zag n SER 529 Cb 0.00 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 63.93 2zag n SER 529 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2zag n ALA 530 N 0.00 5.16 0.16 7.33 0.00 -1.26 -4.75 120.51 127.15 2zag n ALA 530 Ca 0.00 -4.63 0.01 0.00 0.00 0.00 0.00 53.44 48.82 2zag n ALA 530 Cb 0.00 -1.15 0.26 0.00 0.00 0.00 0.00 19.45 18.56 2zag n ALA 530 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2zag h ASP 531 N 3.28 0.00 -5.14 0.00 5.19 -1.93 -3.44 116.42 114.38 2zag h ASP 531 Ca 0.27 0.00 -0.07 0.00 -0.62 0.00 0.00 57.03 56.61 2zag h ASP 531 Cb 0.47 0.00 -0.13 0.00 0.18 0.00 0.00 39.33 39.85 2zag h ASP 531 CO 0.94 0.50 -0.25 -0.83 -3.12 0.00 0.00 179.24 176.48 2zag s GLY 532 N -4.40 0.02 -0.82 2.75 0.00 -1.25 -0.72 107.32 102.90 2zag s GLY 532 Ca -0.01 -0.46 -0.17 0.00 0.00 0.00 0.00 44.72 44.08 2zag s GLY 532 CO 0.73 -0.63 0.91 -0.32 0.00 0.00 0.00 173.10 173.80 2zag s GLY 533 N -2.86 2.15 0.00 0.20 0.00 -0.97 -4.91 107.32 100.93 2zag s GLY 533 Ca 0.06 -2.84 0.00 0.00 0.00 0.00 0.00 44.72 41.94 2zag s GLY 533 CO -0.09 1.65 0.00 -2.39 0.00 0.00 0.00 173.10 172.27 2zag n HIS 534 N 5.60 0.00 -0.81 1.90 1.44 -1.26 -4.85 115.22 117.25 2zag n HIS 534 Ca 0.13 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.84 2zag n HIS 534 Cb 0.47 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.58 2zag n HIS 534 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2zag n ALA 535 N -3.00 -1.26 -0.62 1.59 0.00 -1.26 -4.54 120.51 111.43 2zag n ALA 535 Ca 0.00 0.25 0.48 0.00 0.00 0.00 0.00 53.44 54.17 2zag n ALA 535 Cb 0.00 -1.00 0.75 0.00 0.00 0.00 0.00 19.45 19.21 2zag n ALA 535 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2zag n ARG 536 N -2.04 -0.01 0.14 0.00 3.00 -1.26 -2.06 116.66 114.43 2zag n ARG 536 Ca 0.00 1.11 -0.13 0.00 -0.01 0.00 0.00 57.85 58.82 2zag n ARG 536 Cb 0.24 -2.42 -0.08 0.00 0.00 0.00 0.00 32.46 30.19 2zag n ARG 536 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.63 177.19 2zag h ASP 537 N 0.00 -0.29 -0.66 0.55 3.32 -1.88 -3.26 116.42 114.20 2zag h ASP 537 Ca 0.90 -0.17 0.05 0.00 0.02 0.00 0.00 57.03 57.82 2zag h ASP 537 Cb 3.38 0.07 -0.04 0.00 0.22 0.00 0.00 39.33 42.96 2zag h ASP 537 CO -0.16 0.03 0.43 0.03 -1.72 0.00 0.00 179.24 177.85 2zag h ARG 538 N -0.63 0.70 -0.56 3.56 2.47 -1.65 -2.81 114.38 115.46 2zag h ARG 538 Ca -0.03 -0.04 0.08 0.00 -1.26 0.00 0.00 59.98 58.72 2zag h ARG 538 Cb 0.45 -0.16 -0.07 0.00 -1.65 0.00 0.00 29.97 28.54 2zag h ARG 538 CO 0.06 0.47 0.20 -0.44 0.56 0.00 0.00 179.97 180.82 2zag h ASP 539 N 0.72 0.20 -0.47 7.04 3.32 -1.60 1.84 116.42 127.48 2zag h ASP 539 Ca 0.27 0.07 0.00 0.00 0.02 0.00 0.00 57.03 57.40 2zag h ASP 539 Cb 0.17 0.05 -0.02 0.00 0.22 0.00 0.00 39.33 39.75 2zag h ASP 539 CO -0.08 0.13 0.31 0.45 -1.72 0.00 0.00 179.24 178.33 2zag h HIS 540 N 0.38 0.60 -0.29 4.55 3.86 -1.62 0.22 115.15 122.85 2zag h HIS 540 Ca 0.28 0.01 -0.14 0.00 -1.16 0.00 0.00 60.37 59.36 2zag h HIS 540 Cb 0.32 -0.20 -0.00 0.00 1.06 0.00 0.00 27.41 28.59 2zag h HIS 540 CO -0.17 0.38 -0.35 0.82 0.86 0.00 0.00 177.93 179.48 2zag h ILE 541 N 0.64 1.30 -0.90 2.45 1.08 -1.13 -0.26 117.51 120.69 2zag h ILE 541 Ca 0.17 -1.53 -0.01 0.00 -0.39 0.00 0.00 64.86 63.11 2zag h ILE 541 Cb -0.07 1.59 -0.04 0.00 -3.07 0.00 0.00 36.82 35.23 2zag h ILE 541 CO -0.04 0.49 0.53 -0.07 -0.69 0.00 0.00 178.15 178.37 2zag h LEU 542 N 0.51 1.09 0.49 1.44 3.38 0.30 -2.43 115.31 120.09 2zag h LEU 542 Ca 0.04 -0.07 -0.02 0.00 0.09 0.00 0.00 57.88 57.91 2zag h LEU 542 Cb 0.93 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 41.41 2zag h LEU 542 CO 0.08 0.85 -0.25 0.00 0.09 0.00 0.00 178.44 179.22 2zag h ALA 543 N 1.33 -1.17 -1.46 1.53 0.00 -0.32 -1.33 119.26 117.85 2zag h ALA 543 Ca 0.32 -0.15 0.46 0.00 0.00 0.00 0.00 54.91 55.55 2zag h ALA 543 Cb -0.03 0.28 -0.10 0.00 0.00 0.00 0.00 17.79 17.94 2zag h ALA 543 CO -0.06 -1.12 1.00 -0.11 0.00 0.00 0.00 179.25 178.95 2zag n LEU 544 N -3.84 0.11 0.00 0.00 7.94 -0.13 0.56 117.00 121.64 2zag n LEU 544 Ca -0.08 1.08 -0.18 0.00 -1.11 0.00 0.00 56.01 55.72 2zag n LEU 544 Cb 0.27 -0.54 -0.14 0.00 0.53 0.00 0.00 43.42 43.54 2zag n LEU 544 CO 0.20 -1.15 0.14 0.15 -1.11 0.00 0.00 177.39 175.63 2zag h PHE 545 N 0.00 0.34 -0.38 1.96 3.57 -0.97 -3.07 116.94 118.39 2zag h PHE 545 Ca 0.81 -0.25 -0.15 0.00 3.53 0.00 0.00 57.97 61.91 2zag h PHE 545 Cb 2.89 -0.01 -0.01 0.00 2.79 0.00 0.00 35.95 41.61 2zag h PHE 545 CO -0.00 1.21 -0.35 -0.07 -2.23 0.00 0.00 178.31 176.87 2zag h LEU 546 N -0.60 0.94 0.00 0.59 3.38 0.13 -3.30 115.31 116.44 2zag h LEU 546 Ca -0.10 -0.41 0.00 0.00 0.09 0.00 0.00 57.88 57.46 2zag h LEU 546 Cb 1.42 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 41.91 2zag h LEU 546 CO 0.09 1.18 -0.55 0.00 0.09 0.00 0.00 178.44 179.25 2zag h ALA 547 N 0.86 0.64 -4.93 1.53 0.00 -0.85 0.29 119.26 116.80 2zag h ALA 547 Ca 0.07 0.00 -0.30 0.00 0.00 0.00 0.00 54.91 54.68 2zag h ALA 547 Cb 0.92 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.68 2zag h ALA 547 CO 0.09 0.00 -0.15 0.54 0.00 0.00 0.00 179.25 179.72 2zag n ARG 548 N -2.18 1.09 -3.76 0.00 5.12 -1.16 -4.48 116.66 111.29 2zag n ARG 548 Ca 0.03 -1.81 -0.13 0.00 -1.93 0.00 0.00 57.85 54.02 2zag n ARG 548 Cb 0.45 0.22 -0.08 0.00 -1.16 0.00 0.00 32.46 31.88 2zag n ARG 548 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 2zag s ASP 549 N -2.67 -0.17 0.00 0.55 -1.08 -1.26 -0.14 116.67 111.91 2zag s ASP 549 Ca 0.15 0.00 0.00 0.00 -0.52 0.00 0.00 52.55 52.18 2zag s ASP 549 Cb -0.01 0.32 0.00 0.00 -1.46 0.00 0.00 42.92 41.77 2zag s ASP 549 CO 0.09 -0.49 0.00 0.61 0.52 0.00 0.00 175.17 175.91 2zag n GLY 550 N 1.09 -1.73 0.42 2.66 0.00 -1.26 -4.32 105.19 102.05 2zag n GLY 550 Ca -0.21 -1.51 -0.11 0.00 0.00 0.00 0.00 46.02 44.19 2zag n GLY 550 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2zag h ASN 551 N 0.00 -1.60 0.00 1.61 2.35 -2.00 -0.06 115.58 115.87 2zag h ASN 551 Ca 0.00 0.23 0.00 0.00 -0.55 0.00 0.00 56.30 55.98 2zag h ASN 551 Cb 0.00 0.69 0.00 0.00 0.05 0.00 0.00 38.32 39.06 2zag h ASN 551 CO 0.00 -0.38 0.01 0.00 -1.65 0.00 0.00 177.43 175.41 2zag n ILE 552 N -5.40 1.45 1.06 2.81 3.06 -1.26 -0.97 119.36 120.10 2zag n ILE 552 Ca -0.01 0.63 0.12 0.00 -2.50 0.00 0.00 62.75 60.99 2zag n ILE 552 Cb 0.35 -1.63 0.27 0.00 0.54 0.00 0.00 39.64 39.17 2zag n ILE 552 CO 0.00 0.00 0.00 -1.54 -2.50 0.00 0.00 176.55 172.51 2zag n SER 553 N -1.91 0.64 -4.57 9.51 3.41 -0.04 -4.64 113.62 116.01 2zag n SER 553 Ca -0.01 -0.42 -0.42 0.00 -0.26 0.00 0.00 58.87 57.76 2zag n SER 553 Cb 0.03 0.24 -0.01 0.00 -0.26 0.00 0.00 64.21 64.21 2zag n SER 553 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 2zag s GLU 554 N -2.88 3.86 0.51 4.33 2.02 -0.15 -4.47 118.70 121.92 2zag s GLU 554 Ca 0.14 -1.72 -0.12 0.00 0.02 0.00 0.00 54.97 53.29 2zag s GLU 554 Cb 0.18 -5.47 -0.06 0.00 0.10 0.00 0.00 34.13 28.88 2zag s GLU 554 CO 0.66 -2.23 0.91 0.14 0.02 0.00 0.00 175.26 174.77 2zag s VAL 555 N 4.41 4.70 -0.94 2.63 -7.23 -1.26 -4.29 120.40 118.42 2zag s VAL 555 Ca 0.51 0.83 -0.20 0.00 -1.81 0.00 0.00 61.98 61.31 2zag s VAL 555 Cb 0.03 -3.79 0.11 0.00 0.56 0.00 0.00 36.38 33.29 2zag s VAL 555 CO 0.02 -0.80 1.18 -0.62 -0.31 0.00 0.00 175.10 174.57 2zag s ASP 556 N -3.55 6.59 0.34 4.85 2.15 -1.26 -4.20 116.67 121.59 2zag s ASP 556 Ca 0.54 -1.90 0.17 0.00 0.43 0.00 0.00 52.55 51.80 2zag s ASP 556 Cb -0.10 -2.43 0.54 0.00 -0.30 0.00 0.00 42.92 40.62 2zag s ASP 556 CO 0.40 -1.16 1.67 -0.26 -0.17 0.00 0.00 175.17 175.64 2zag h PHE 557 N 9.04 0.00 -0.56 -5.34 0.05 -1.90 -3.14 116.94 115.08 2zag h PHE 557 Ca 0.15 0.00 0.06 0.00 3.82 0.00 0.00 57.97 62.00 2zag h PHE 557 Cb 1.02 0.00 -0.03 0.00 2.00 0.00 0.00 35.95 38.94 2zag h PHE 557 CO 1.18 0.44 0.38 1.49 -0.18 0.00 0.00 178.31 181.62 2zag h GLU 558 N 0.00 0.51 0.00 1.51 4.57 -1.87 0.70 114.58 120.00 2zag h GLU 558 Ca -0.00 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.14 2zag h GLU 558 Cb 1.01 -0.12 0.00 0.00 -0.16 0.00 0.00 28.75 29.49 2zag h GLU 558 CO 0.06 0.34 0.04 1.03 -1.18 0.00 0.00 179.01 179.30 2zag h SER 559 N 0.53 0.00 -0.09 1.04 0.87 -1.96 0.10 113.55 114.05 2zag h SER 559 Ca 0.24 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.80 2zag h SER 559 Cb 0.29 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.25 2zag h SER 559 CO -0.07 0.00 0.00 0.79 -0.53 0.00 0.00 176.83 177.02 2zag n TRP 560 N -2.40 0.08 -2.79 2.24 7.02 0.23 -4.93 117.44 116.90 2zag n TRP 560 Ca -0.02 -0.04 -0.19 0.00 -1.02 0.00 0.00 57.50 56.23 2zag n TRP 560 Cb 0.08 0.00 0.02 0.00 -2.42 0.00 0.00 31.31 28.99 2zag n TRP 560 CO 0.00 0.00 0.00 -1.91 -2.02 0.00 0.00 177.69 173.76 2zag n GLU 561 N 1.28 -3.65 -2.37 -0.99 0.00 0.36 -4.90 120.64 110.36 2zag n GLU 561 Ca 0.15 0.82 -0.43 0.00 0.00 0.00 0.00 57.16 57.70 2zag n GLU 561 Cb 0.58 -5.41 -0.02 0.00 0.00 0.00 0.00 31.44 26.59 2zag n GLU 561 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.13 175.96 2zag s LEU 562 N -5.73 4.24 -0.27 4.31 0.20 -1.22 -4.18 118.68 116.03 2zag s LEU 562 Ca 0.20 1.83 -0.13 0.00 0.69 0.00 0.00 54.13 56.73 2zag s LEU 562 Cb -0.09 -3.55 -0.12 0.00 -0.43 0.00 0.00 46.19 42.00 2zag s LEU 562 CO 0.25 -0.72 -0.34 0.59 -0.29 0.00 0.00 176.35 175.84 2zag n ASN 563 N 6.09 1.94 -4.03 3.68 4.13 0.13 -4.71 115.26 122.49 2zag n ASN 563 Ca 0.13 0.30 -0.18 0.00 1.68 0.00 0.00 54.58 56.51 2zag n ASN 563 Cb 0.45 -0.78 -0.14 0.00 -1.54 0.00 0.00 39.78 37.77 2zag n ASN 563 CO 0.00 0.00 0.00 -0.31 0.28 0.00 0.00 177.26 177.23 2zag s TYR 564 N -2.50 0.83 -0.14 3.10 1.51 -0.88 0.64 117.35 119.91 2zag s TYR 564 Ca -0.38 -0.18 -0.02 0.00 -1.01 0.00 0.00 57.07 55.48 2zag s TYR 564 Cb 0.14 -0.53 -0.02 0.00 -0.11 0.00 0.00 41.96 41.44 2zag s TYR 564 CO 0.49 -0.01 -0.09 0.12 -1.11 0.00 0.00 175.55 174.95 2zag s PHE 565 N -0.30 2.90 -0.33 2.71 2.19 0.53 -1.45 117.98 124.23 2zag s PHE 565 Ca 0.03 -0.52 -0.09 0.00 0.33 0.00 0.00 56.93 56.68 2zag s PHE 565 Cb -0.04 -1.90 0.01 0.00 -1.31 0.00 0.00 43.02 39.79 2zag s PHE 565 CO -0.00 -0.16 0.13 -0.51 1.83 0.00 0.00 175.22 176.52 2zag s LEU 566 N 0.40 4.21 -0.17 6.12 1.43 0.31 0.01 118.68 130.99 2zag s LEU 566 Ca -0.08 -0.81 -0.11 0.00 -1.03 0.00 0.00 54.13 52.11 2zag s LEU 566 Cb -0.15 -1.95 -0.05 0.00 0.03 0.00 0.00 46.19 44.07 2zag s LEU 566 CO 0.04 -0.26 0.18 0.68 0.23 0.00 0.00 176.35 177.22 2zag s VAL 567 N 1.53 5.39 -0.28 -1.59 -7.23 -0.38 -4.39 120.40 113.44 2zag s VAL 567 Ca 0.02 0.30 -0.03 0.00 -1.81 0.00 0.00 61.98 60.46 2zag s VAL 567 Cb -0.18 -3.50 0.03 0.00 0.56 0.00 0.00 36.38 33.29 2zag s VAL 567 CO 0.05 0.46 0.00 -0.47 -0.31 0.00 0.00 175.10 174.83 2zag s TYR 568 N 0.11 3.15 0.23 2.82 5.04 -1.26 -1.17 117.35 126.27 2zag s TYR 568 Ca 0.12 -1.48 -0.08 0.00 -2.44 0.00 0.00 57.07 53.18 2zag s TYR 568 Cb -0.12 -2.13 0.38 0.00 0.35 0.00 0.00 41.96 40.44 2zag s TYR 568 CO 0.01 -0.71 1.68 -0.07 -1.34 0.00 0.00 175.55 175.11 2zag h LEU 569 N 8.08 -0.11 -0.56 6.97 3.38 -0.19 -1.04 115.31 131.84 2zag h LEU 569 Ca -0.29 0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.83 2zag h LEU 569 Cb 1.10 0.23 0.00 0.00 0.09 0.00 0.00 40.66 42.07 2zag h LEU 569 CO 0.57 -0.07 0.19 0.59 0.09 0.00 0.00 178.44 179.81 2zag n ASN 570 N -5.21 0.22 0.12 -0.43 3.02 -1.26 -1.81 115.26 109.91 2zag n ASN 570 Ca 0.12 0.50 0.10 0.00 -0.03 0.00 0.00 54.58 55.26 2zag n ASN 570 Cb 0.41 -0.48 0.46 0.00 -0.61 0.00 0.00 39.78 39.55 2zag n ASN 570 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 2zag n ASP 571 N -1.77 0.51 -0.29 6.41 8.00 -0.39 -1.81 116.55 127.20 2zag n ASP 571 Ca -0.01 0.66 0.08 0.00 0.71 0.00 0.00 54.79 56.24 2zag n ASP 571 Cb 0.20 -0.76 0.30 0.00 -0.02 0.00 0.00 41.12 40.84 2zag n ASP 571 CO 0.00 0.00 0.00 4.11 -0.39 0.00 0.00 177.20 180.92 2zag h TRP 572 N 0.00 0.96 -0.51 1.24 5.08 -1.59 0.20 115.95 121.34 2zag h TRP 572 Ca 0.00 0.03 0.15 0.00 1.08 0.00 0.00 58.89 60.14 2zag h TRP 572 Cb 0.21 -0.31 -0.02 0.00 -3.00 0.00 0.00 29.16 26.05 2zag h TRP 572 CO 0.00 0.42 0.37 0.00 -1.28 0.00 0.00 178.44 177.95 2zag h ALA 573 N 1.56 2.48 -0.19 0.11 0.00 -1.62 -0.14 119.26 121.46 2zag h ALA 573 Ca 0.43 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 55.25 2zag h ALA 573 Cb 0.46 0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.25 2zag h ALA 573 CO -0.19 -0.63 -0.15 0.36 0.00 0.00 0.00 179.25 178.64 2zag n LYS 574 N -4.38 1.88 0.00 0.00 2.85 0.62 -4.68 118.16 114.45 2zag n LYS 574 Ca 0.09 -3.04 0.08 0.00 -1.05 0.00 0.00 58.31 54.39 2zag n LYS 574 Cb 0.59 -1.72 0.39 0.00 -0.65 0.00 0.00 35.03 33.64 2zag n LYS 574 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 177.40 177.69 2zag n PHE 575 N -1.07 0.00 0.10 5.58 7.35 -0.07 -2.19 117.46 127.16 2zag n PHE 575 Ca 0.25 0.00 -0.04 0.00 -0.76 0.00 0.00 57.45 56.90 2zag n PHE 575 Cb 0.86 -0.38 0.04 0.00 0.35 0.00 0.00 39.48 40.34 2zag n PHE 575 CO 0.00 0.00 0.00 -0.91 -0.76 0.00 0.00 176.76 175.09 2zag h ASN 576 N 0.00 0.00 0.34 -2.13 4.21 -1.83 0.17 115.58 116.33 2zag h ASN 576 Ca 0.00 0.00 -0.02 0.00 1.21 0.00 0.00 56.30 57.49 2zag h ASN 576 Cb 0.22 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.42 2zag h ASN 576 CO 0.00 0.79 -0.16 0.00 -1.29 0.00 0.00 177.43 176.76 2zag h ALA 577 N 1.21 -0.50 -0.90 -0.83 0.00 -1.79 -2.09 119.26 114.36 2zag h ALA 577 Ca -0.01 -0.10 0.24 0.00 0.00 0.00 0.00 54.91 55.04 2zag h ALA 577 Cb 1.40 0.18 -0.13 0.00 0.00 0.00 0.00 17.79 19.24 2zag h ALA 577 CO 0.10 -0.47 0.36 0.82 0.00 0.00 0.00 179.25 180.06 2zag h ILE 578 N -1.01 0.40 -0.41 0.00 2.04 -1.58 0.25 117.51 117.21 2zag h ILE 578 Ca -0.05 -0.11 -0.05 0.00 1.00 0.00 0.00 64.86 65.65 2zag h ILE 578 Cb 0.35 0.05 -0.02 0.00 -0.74 0.00 0.00 36.82 36.47 2zag h ILE 578 CO 0.08 0.06 0.04 0.28 0.00 0.00 0.00 178.15 178.61 2zag h SER 579 N 0.32 0.66 -0.08 1.72 0.02 -0.98 0.35 113.55 115.57 2zag h SER 579 Ca 0.58 -0.28 -0.01 0.00 -0.84 0.00 0.00 61.79 61.24 2zag h SER 579 Cb 1.15 -0.18 -0.00 0.00 0.14 0.00 0.00 62.40 63.51 2zag h SER 579 CO -0.58 0.77 -0.00 0.22 -1.14 0.00 0.00 176.83 176.10 2zag h TYR 580 N 0.53 0.15 -0.84 3.45 3.20 -0.30 0.13 116.97 123.29 2zag h TYR 580 Ca 0.12 -0.03 -0.00 0.00 3.14 0.00 0.00 58.73 61.96 2zag h TYR 580 Cb 0.41 -0.04 -0.04 0.00 1.54 0.00 0.00 36.73 38.60 2zag h TYR 580 CO 0.03 0.42 0.52 -0.07 -1.64 0.00 0.00 178.16 177.42 2zag h LEU 581 N -0.16 1.00 0.00 2.82 3.38 -0.55 0.24 115.31 122.05 2zag h LEU 581 Ca 0.02 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.94 2zag h LEU 581 Cb 0.36 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.86 2zag h LEU 581 CO 0.00 0.76 0.00 0.61 0.09 0.00 0.00 178.44 179.90 2zag n GLY 582 N -1.30 -0.84 2.51 0.83 0.00 0.11 -4.62 105.19 101.87 2zag n GLY 582 Ca 0.09 -0.12 -0.17 0.00 0.00 0.00 0.00 46.02 45.82 2zag n GLY 582 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2zag n GLY 583 N 0.58 -0.31 0.11 -0.02 0.00 0.07 -4.43 105.19 101.19 2zag n GLY 583 Ca 0.14 -0.12 -0.16 0.00 0.00 0.00 0.00 46.02 45.88 2zag n GLY 583 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2zag n ALA 584 N -2.41 1.15 -2.72 4.61 0.00 0.44 -4.67 120.51 116.91 2zag n ALA 584 Ca -0.15 -0.67 -0.32 0.00 0.00 0.00 0.00 53.44 52.30 2zag n ALA 584 Cb 0.63 -0.75 -0.07 0.00 0.00 0.00 0.00 19.45 19.26 2zag n ALA 584 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 2zag s ILE 585 N -2.57 0.88 0.52 0.00 -4.36 -1.19 -4.87 121.20 109.61 2zag s ILE 585 Ca -0.15 -2.00 0.08 0.00 -0.26 0.00 0.00 60.65 58.33 2zag s ILE 585 Cb 0.07 -2.09 0.05 0.00 1.25 0.00 0.00 42.46 41.74 2zag s ILE 585 CO 0.79 0.00 0.64 0.42 0.24 0.00 0.00 174.94 177.03 2zag s THR 586 N -2.98 2.31 0.27 8.37 -4.23 -1.26 -4.57 115.64 113.55 2zag s THR 586 Ca 0.06 -1.12 -0.03 0.00 -1.18 0.00 0.00 61.69 59.43 2zag s THR 586 Cb 0.00 -2.42 0.18 0.00 1.34 0.00 0.00 72.50 71.60 2zag s THR 586 CO 0.04 0.00 1.85 -0.09 -0.54 0.00 0.00 174.62 175.88 2zag h ARG 587 N 0.46 0.99 0.40 3.99 2.43 -1.04 0.17 114.38 121.77 2zag h ARG 587 Ca -0.34 -0.16 -0.02 0.00 -0.81 0.00 0.00 59.98 58.65 2zag h ARG 587 Cb 1.29 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 30.67 2zag h ARG 587 CO 0.46 0.80 -0.19 -0.09 -1.51 0.00 0.00 179.97 179.44 2zag h ARG 588 N 0.97 -0.51 0.00 0.20 2.43 -1.68 -1.81 114.38 113.98 2zag h ARG 588 Ca 0.23 0.03 -0.00 0.00 -0.81 0.00 0.00 59.98 59.43 2zag h ARG 588 Cb 0.18 0.12 -0.00 0.00 -0.42 0.00 0.00 29.97 29.84 2zag h ARG 588 CO -0.02 -0.26 -0.00 0.93 -1.51 0.00 0.00 179.97 179.11 2zag h GLU 589 N -0.68 0.00 0.10 0.20 5.08 -1.63 0.42 114.58 118.07 2zag h GLU 589 Ca -0.05 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.30 2zag h GLU 589 Cb 0.49 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.74 2zag h GLU 589 CO 0.09 0.00 -0.05 -0.92 -1.00 0.00 0.00 179.01 177.13 2zag h TYR 590 N 0.00 -0.13 0.00 4.33 3.20 -0.34 -2.39 116.97 121.63 2zag h TYR 590 Ca -0.00 -0.00 -0.14 0.00 3.14 0.00 0.00 58.73 61.72 2zag h TYR 590 Cb 0.06 0.04 -0.26 0.00 1.54 0.00 0.00 36.73 38.12 2zag h TYR 590 CO 0.00 0.37 -0.71 -1.71 -1.64 0.00 0.00 178.16 174.48 2zag n ASN 591 N -4.85 0.21 -0.44 -2.11 5.15 -0.74 -4.70 115.26 107.78 2zag n ASN 591 Ca -0.07 -1.96 0.02 0.00 -0.60 0.00 0.00 54.58 51.97 2zag n ASN 591 Cb 0.28 -0.08 -0.01 0.00 -0.53 0.00 0.00 39.78 39.44 2zag n ASN 591 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2zag n GLY 592 N 0.28 -3.04 3.93 8.20 0.00 0.15 -4.82 105.19 109.89 2zag n GLY 592 Ca -0.06 -1.24 -0.30 0.00 0.00 0.00 0.00 46.02 44.42 2zag n GLY 592 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2zag s ASP 593 N -4.22 3.10 0.00 1.61 1.47 0.25 -4.73 116.67 114.15 2zag s ASP 593 Ca 0.00 0.24 0.00 0.00 1.18 0.00 0.00 52.55 53.97 2zag s ASP 593 Cb 0.00 -0.28 0.00 0.00 -0.34 0.00 0.00 42.92 42.30 2zag s ASP 593 CO 0.00 -2.74 0.23 -1.84 0.68 0.00 0.00 175.17 171.50 2zag n GLU 594 N -3.76 0.00 -0.91 2.11 -0.00 -1.26 0.64 120.64 117.45 2zag n GLU 594 Ca 0.15 0.00 0.04 0.00 -0.00 0.00 0.00 57.16 57.36 2zag n GLU 594 Cb 0.59 -1.28 0.08 0.00 -0.00 0.00 0.00 31.44 30.84 2zag n GLU 594 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.13 176.00 2zag n SER 595 N -0.68 1.16 -3.65 -1.84 3.41 -1.26 -5.01 113.62 105.76 2zag n SER 595 Ca 0.00 -2.64 -0.27 0.00 -0.26 0.00 0.00 58.87 55.70 2zag n SER 595 Cb 0.00 -0.36 0.04 0.00 -0.26 0.00 0.00 64.21 63.63 2zag n SER 595 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2zag n GLY 596 N -0.25 -0.52 3.18 5.00 0.00 0.21 -5.00 105.19 107.81 2zag n GLY 596 Ca 0.10 0.20 -0.13 0.00 0.00 0.00 0.00 46.02 46.18 2zag n GLY 596 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2zag s ARG 597 N -6.35 0.87 0.00 1.61 0.52 -1.25 -4.79 118.95 109.56 2zag s ARG 597 Ca 0.57 -1.24 0.00 0.00 -0.52 0.00 0.00 55.73 54.54 2zag s ARG 597 Cb -0.27 -0.47 0.00 0.00 0.52 0.00 0.00 34.95 34.72 2zag s ARG 597 CO 0.71 0.06 0.00 0.41 0.02 0.00 0.00 175.30 176.49 2zag n GLY 598 N 0.32 2.18 3.52 -3.53 0.00 -1.26 0.85 105.19 107.27 2zag n GLY 598 Ca -0.14 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.41 2zag n GLY 598 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2zag n ALA 599 N -0.38 -1.32 -2.41 4.61 0.00 -1.20 -4.00 120.51 115.81 2zag n ALA 599 Ca 0.00 0.42 -0.18 0.00 0.00 0.00 0.00 53.44 53.68 2zag n ALA 599 Cb 0.00 -1.86 -0.11 0.00 0.00 0.00 0.00 19.45 17.48 2zag n ALA 599 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2zag s VAL 600 N -0.96 1.50 -0.45 0.00 1.01 -0.90 -4.94 120.40 115.66 2zag s VAL 600 Ca 0.62 -1.93 -0.08 0.00 0.00 0.00 0.00 61.98 60.59 2zag s VAL 600 Cb -0.81 -1.77 0.11 0.00 0.00 0.00 0.00 36.38 33.91 2zag s VAL 600 CO 0.58 -0.49 0.31 -0.89 0.00 0.00 0.00 175.10 174.60 2zag s THR 601 N -2.51 4.04 0.37 3.92 2.01 -1.26 -4.90 115.64 117.31 2zag s THR 601 Ca 0.15 -1.77 0.10 0.00 0.31 0.00 0.00 61.69 60.48 2zag s THR 601 Cb -0.03 -3.65 0.12 0.00 0.01 0.00 0.00 72.50 68.95 2zag s THR 601 CO 0.04 -0.71 1.85 0.71 -0.69 0.00 0.00 174.62 175.82 2zag h THR 602 N 6.17 1.22 -2.98 -0.82 1.35 -1.91 -3.36 112.91 112.59 2zag h THR 602 Ca -0.20 -1.05 -0.13 0.00 -0.55 0.00 0.00 66.41 64.48 2zag h THR 602 Cb 1.07 1.43 -0.23 0.00 -1.73 0.00 0.00 68.15 68.70 2zag h THR 602 CO 0.82 0.31 -0.31 -0.76 -0.25 0.00 0.00 175.52 175.33 2zag s LEU 603 N -8.51 0.78 -0.20 3.87 1.43 -1.26 -1.52 118.68 113.27 2zag s LEU 603 Ca -0.05 0.43 -0.06 0.00 -1.03 0.00 0.00 54.13 53.42 2zag s LEU 603 Cb 0.15 1.19 0.09 0.00 0.03 0.00 0.00 46.19 47.65 2zag s LEU 603 CO 0.74 -0.25 0.41 -0.22 0.23 0.00 0.00 176.35 177.25 2zag s LEU 604 N -0.45 -0.63 -0.02 1.79 2.96 -0.97 -4.84 118.68 116.52 2zag s LEU 604 Ca -0.06 0.91 -0.22 0.00 -0.22 0.00 0.00 54.13 54.54 2zag s LEU 604 Cb -0.04 1.30 -0.05 0.00 0.50 0.00 0.00 46.19 47.91 2zag s LEU 604 CO 0.02 -0.24 0.66 -2.16 -1.32 0.00 0.00 176.35 173.32 2zag s PRO 605 N 2.60 4.40 -0.43 0.98 0.04 -1.26 -1.11 135.00 140.21 2zag s PRO 605 Ca -0.00 0.85 -0.02 0.00 0.04 0.00 0.00 61.00 61.87 2zag s PRO 605 Cb -0.12 -3.38 0.12 0.00 0.04 0.00 0.00 34.50 31.15 2zag s PRO 605 CO -0.13 0.25 0.22 -0.51 0.04 0.00 0.00 177.00 176.87 2zag s LEU 606 N 0.17 5.16 0.70 -3.56 1.43 0.31 -4.56 118.68 118.33 2zag s LEU 606 Ca 0.35 -2.18 -0.15 0.00 -1.03 0.00 0.00 54.13 51.11 2zag s LEU 606 Cb -0.18 -1.80 0.02 0.00 0.03 0.00 0.00 46.19 44.26 2zag s LEU 606 CO 0.19 -0.49 1.18 -2.84 0.23 0.00 0.00 176.35 174.62 2zag s PRO 607 N 0.91 2.36 0.21 1.29 0.02 -1.23 0.60 135.00 139.16 2zag s PRO 607 Ca 0.10 1.67 -0.30 0.00 0.02 0.00 0.00 61.00 62.49 2zag s PRO 607 Cb -0.22 -1.87 -0.09 0.00 0.02 0.00 0.00 34.50 32.34 2zag s PRO 607 CO -0.04 -1.64 1.24 1.03 -0.33 0.00 0.00 177.00 177.25 2zag s ARG 608 N -3.91 4.45 -0.37 5.54 1.81 -1.22 -1.08 118.95 124.16 2zag s ARG 608 Ca 0.73 1.97 0.01 0.00 -1.72 0.00 0.00 55.73 56.72 2zag s ARG 608 Cb -0.27 -3.20 0.15 0.00 -0.45 0.00 0.00 34.95 31.18 2zag s ARG 608 CO 0.43 -0.14 0.25 -0.47 -0.68 0.00 0.00 175.30 174.70 2zag s TYR 609 N -0.20 0.87 0.00 -0.53 5.04 0.37 -4.86 117.35 118.05 2zag s TYR 609 Ca 0.53 -1.85 0.00 0.00 -2.44 0.00 0.00 57.07 53.31 2zag s TYR 609 Cb -0.35 -0.95 0.00 0.00 0.35 0.00 0.00 41.96 41.01 2zag s TYR 609 CO 0.39 -0.83 0.00 0.41 -1.34 0.00 0.00 175.55 174.19 2zag n GLY 610 N 3.68 3.20 1.20 8.97 0.00 -1.26 -0.75 105.19 120.23 2zag n GLY 610 Ca 0.17 -0.08 0.08 0.00 0.00 0.00 0.00 46.02 46.19 2zag n GLY 610 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2zag n GLU 611 N 11.31 3.52 -4.39 1.61 4.07 -1.26 -4.95 120.64 130.55 2zag n GLU 611 Ca 0.00 -2.89 -0.20 0.00 -0.06 0.00 0.00 57.16 54.01 2zag n GLU 611 Cb 0.00 -1.93 -0.10 0.00 -0.06 0.00 0.00 31.44 29.35 2zag n GLU 611 CO 0.00 0.00 0.00 0.15 -0.06 0.00 0.00 177.13 177.22 2zag s LYS 612 N -2.65 1.45 -0.19 5.31 1.02 0.07 -3.88 119.74 120.88 2zag s LYS 612 Ca 0.45 -1.68 0.00 0.00 0.02 0.00 0.00 55.97 54.77 2zag s LYS 612 Cb 0.35 -1.21 0.02 0.00 -0.52 0.00 0.00 37.83 36.46 2zag s LYS 612 CO 0.12 0.15 -0.18 0.71 -0.92 0.00 0.00 175.35 175.24 2zag s TYR 613 N -2.93 2.80 -0.02 3.18 1.51 -0.84 0.14 117.35 121.20 2zag s TYR 613 Ca 0.26 -1.54 0.01 0.00 -1.01 0.00 0.00 57.07 54.78 2zag s TYR 613 Cb 0.00 -1.95 0.01 0.00 -0.11 0.00 0.00 41.96 39.92 2zag s TYR 613 CO 0.10 -0.77 -0.04 0.54 -1.11 0.00 0.00 175.55 174.27 2zag s VAL 614 N 1.31 0.35 -0.38 0.71 0.11 -0.24 -1.53 120.40 120.73 2zag s VAL 614 Ca 0.05 -0.12 -0.04 0.00 -2.93 0.00 0.00 61.98 58.94 2zag s VAL 614 Cb -0.13 -0.35 0.09 0.00 -1.53 0.00 0.00 36.38 34.46 2zag s VAL 614 CO -0.12 0.14 0.17 0.21 -3.33 0.00 0.00 175.10 172.17 2zag s ASN 615 N 0.34 5.26 0.16 3.54 3.84 -0.72 -3.52 114.94 123.83 2zag s ASN 615 Ca -0.04 -1.71 -0.16 0.00 0.21 0.00 0.00 52.86 51.17 2zag s ASN 615 Cb -0.07 -1.84 0.03 0.00 -0.55 0.00 0.00 41.25 38.82 2zag s ASN 615 CO -0.00 -0.47 1.82 0.25 -2.79 0.00 0.00 177.10 175.90 2zag h LEU 616 N 8.12 0.47 -1.34 3.21 6.46 -1.92 -0.95 115.31 129.36 2zag h LEU 616 Ca -0.17 -0.01 0.06 0.00 -0.12 0.00 0.00 57.88 57.63 2zag h LEU 616 Cb 1.06 -0.12 -0.05 0.00 -0.73 0.00 0.00 40.66 40.83 2zag h LEU 616 CO 0.67 0.34 0.49 0.22 -0.62 0.00 0.00 178.44 179.54 2zag h TYR 617 N 0.56 0.82 -0.01 1.25 3.20 -1.97 -2.28 116.97 118.54 2zag h TYR 617 Ca 0.16 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.05 2zag h TYR 617 Cb -0.06 -0.27 0.00 0.00 1.54 0.00 0.00 36.73 37.94 2zag h TYR 617 CO -0.05 0.44 -0.37 0.00 -1.64 0.00 0.00 178.16 176.55 2zag n ALA 618 N -2.44 3.32 -3.54 1.82 0.00 -1.04 -4.95 120.51 113.67 2zag n ALA 618 Ca 0.11 -0.54 -0.20 0.00 0.00 0.00 0.00 53.44 52.80 2zag n ALA 618 Cb 0.20 -0.95 0.08 0.00 0.00 0.00 0.00 19.45 18.78 2zag n ALA 618 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2zag n LYS 619 N -0.26 -6.77 -4.68 0.00 5.02 -0.43 -4.43 118.16 106.61 2zag n LYS 619 Ca 0.11 0.80 -0.33 0.00 -2.02 0.00 0.00 58.31 56.87 2zag n LYS 619 Cb 0.42 -5.77 -0.15 0.00 -0.02 0.00 0.00 35.03 29.50 2zag n LYS 619 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2zag s VAL 620 N -3.38 2.62 0.03 -0.18 1.01 -0.81 -0.47 120.40 119.21 2zag s VAL 620 Ca 0.21 -0.80 0.07 0.00 0.00 0.00 0.00 61.98 61.47 2zag s VAL 620 Cb -0.10 -2.09 -0.02 0.00 0.00 0.00 0.00 36.38 34.17 2zag s VAL 620 CO 0.75 0.53 -0.20 -0.63 0.00 0.00 0.00 175.10 175.54 2zag s ILE 621 N 0.66 1.61 -0.19 2.22 1.01 -0.18 -1.76 121.20 124.56 2zag s ILE 621 Ca -0.08 -1.12 -0.01 0.00 0.00 0.00 0.00 60.65 59.44 2zag s ILE 621 Cb -0.16 -1.40 0.05 0.00 0.01 0.00 0.00 42.46 40.97 2zag s ILE 621 CO 0.02 0.24 -0.03 -0.69 0.00 0.00 0.00 174.94 174.48 2zag s VAL 622 N -0.74 1.08 -0.20 2.92 1.01 -0.58 -0.42 120.40 123.47 2zag s VAL 622 Ca 0.07 -0.80 -0.08 0.00 0.00 0.00 0.00 61.98 61.18 2zag s VAL 622 Cb -0.09 -1.37 -0.04 0.00 0.00 0.00 0.00 36.38 34.88 2zag s VAL 622 CO 0.01 -0.04 0.08 -0.62 0.00 0.00 0.00 175.10 174.53 2zag s ASP 623 N 1.62 5.68 -0.44 3.32 -1.08 0.39 -1.99 116.67 124.17 2zag s ASP 623 Ca -0.02 0.07 -0.10 0.00 -0.52 0.00 0.00 52.55 51.98 2zag s ASP 623 Cb -0.17 -1.99 0.09 0.00 -1.46 0.00 0.00 42.92 39.40 2zag s ASP 623 CO -0.07 0.14 0.30 -0.69 0.52 0.00 0.00 175.17 175.37 2zag s VAL 624 N 0.57 4.29 -0.05 1.11 1.01 -1.25 -0.48 120.40 125.59 2zag s VAL 624 Ca 0.04 -1.50 0.01 0.00 0.00 0.00 0.00 61.98 60.54 2zag s VAL 624 Cb -0.13 -3.68 0.02 0.00 0.00 0.00 0.00 36.38 32.59 2zag s VAL 624 CO 0.01 -0.60 -0.07 -0.44 0.00 0.00 0.00 175.10 174.00 2zag s SER 625 N 2.33 1.30 -1.18 3.32 0.01 0.12 -4.87 113.70 114.73 2zag s SER 625 Ca 0.04 -0.19 -0.06 0.00 1.31 0.00 0.00 55.95 57.04 2zag s SER 625 Cb -0.24 -0.60 -0.02 0.00 0.21 0.00 0.00 66.02 65.37 2zag s SER 625 CO 0.01 -0.03 0.83 0.59 0.41 0.00 0.00 173.24 175.05 2zag n ASN 626 N 4.02 -3.71 0.00 2.44 4.13 -1.26 -1.95 115.26 118.93 2zag n ASN 626 Ca -0.23 -0.80 0.00 0.00 1.68 0.00 0.00 54.58 55.23 2zag n ASN 626 Cb 0.51 -4.41 0.00 0.00 -1.54 0.00 0.00 39.78 34.34 2zag n ASN 626 CO 0.00 0.00 0.00 -0.24 0.28 0.00 0.00 177.26 177.30 2zag n SER 627 N -3.04 0.00 -4.70 6.41 2.88 -1.26 -4.92 113.62 108.99 2zag n SER 627 Ca -0.19 0.00 -0.31 0.00 -1.33 0.00 0.00 58.87 57.04 2zag n SER 627 Cb 0.64 -0.88 -0.08 0.00 -0.75 0.00 0.00 64.21 63.14 2zag n SER 627 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2zag s SER 628 N -1.81 5.13 0.00 -3.46 1.04 -0.82 -5.09 113.70 108.69 2zag s SER 628 Ca 0.00 -0.12 0.07 0.00 0.48 0.00 0.00 55.95 56.38 2zag s SER 628 Cb 0.00 -1.27 -0.03 0.00 0.10 0.00 0.00 66.02 64.82 2zag s SER 628 CO 0.00 0.19 -0.22 0.68 0.98 0.00 0.00 173.24 174.87 2zag s VAL 629 N -1.29 2.45 -0.20 5.02 -7.23 -1.26 -0.70 120.40 117.18 2zag s VAL 629 Ca 0.25 -1.12 -0.03 0.00 -1.81 0.00 0.00 61.98 59.28 2zag s VAL 629 Cb -0.12 -1.94 -0.01 0.00 0.56 0.00 0.00 36.38 34.87 2zag s VAL 629 CO 0.18 0.48 -0.06 -0.75 -0.31 0.00 0.00 175.10 174.63 2zag s LYS 630 N -0.97 3.39 -0.18 4.82 2.20 0.37 -4.95 119.74 124.42 2zag s LYS 630 Ca 0.12 -0.63 -0.03 0.00 -0.36 0.00 0.00 55.97 55.07 2zag s LYS 630 Cb -0.10 -2.93 -0.01 0.00 -1.51 0.00 0.00 37.83 33.28 2zag s LYS 630 CO 0.01 -0.09 -0.07 0.08 -0.36 0.00 0.00 175.35 174.92 2zag s VAL 631 N 1.20 3.32 -0.04 4.02 1.01 -1.25 -0.46 120.40 128.19 2zag s VAL 631 Ca 0.02 -0.54 0.05 0.00 0.00 0.00 0.00 61.98 61.52 2zag s VAL 631 Cb -0.14 -2.46 -0.02 0.00 0.00 0.00 0.00 36.38 33.75 2zag s VAL 631 CO -0.02 0.47 -0.18 0.42 0.00 0.00 0.00 175.10 175.79 2zag s THR 632 N 0.95 2.71 -0.38 3.92 -4.23 0.44 -0.16 115.64 118.88 2zag s THR 632 Ca -0.01 -0.86 0.01 0.00 -1.18 0.00 0.00 61.69 59.66 2zag s THR 632 Cb -0.15 -2.03 0.12 0.00 1.34 0.00 0.00 72.50 71.79 2zag s THR 632 CO 0.00 0.59 0.18 -0.69 -0.54 0.00 0.00 174.62 174.16 2zag s VAL 633 N -0.64 1.19 0.00 2.29 1.01 -0.46 -1.01 120.40 122.77 2zag s VAL 633 Ca 0.10 -2.09 0.00 0.00 0.00 0.00 0.00 61.98 59.99 2zag s VAL 633 Cb -0.11 -1.86 0.00 0.00 0.00 0.00 0.00 36.38 34.42 2zag s VAL 633 CO 0.00 -0.81 0.00 0.61 0.00 0.00 0.00 175.10 174.90 2zag n GLY 634 N 4.07 2.11 2.42 4.51 0.00 0.38 -3.19 105.19 115.48 2zag n GLY 634 Ca 0.05 -0.50 -0.30 0.00 0.00 0.00 0.00 46.02 45.27 2zag n GLY 634 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2zag n ASP 635 N 8.69 5.67 -3.95 1.61 8.00 -1.26 -4.99 116.55 130.32 2zag n ASP 635 Ca 0.00 -3.76 -0.09 0.00 0.71 0.00 0.00 54.79 51.65 2zag n ASP 635 Cb 0.00 -0.61 -0.09 0.00 -0.02 0.00 0.00 41.12 40.40 2zag n ASP 635 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 2zag s ARG 636 N -3.69 0.62 -0.17 -1.24 0.52 -1.19 -4.99 118.95 108.80 2zag s ARG 636 Ca 0.52 -0.86 0.00 0.00 -0.52 0.00 0.00 55.73 54.87 2zag s ARG 636 Cb 0.42 0.24 0.01 0.00 0.52 0.00 0.00 34.95 36.14 2zag s ARG 636 CO -0.15 -0.15 -0.17 -2.00 0.02 0.00 0.00 175.30 172.85 2zag s GLU 637 N -2.99 3.10 0.10 3.54 2.12 -1.26 -1.35 118.70 121.96 2zag s GLU 637 Ca -0.02 -0.79 0.10 0.00 0.36 0.00 0.00 54.97 54.62 2zag s GLU 637 Cb 0.01 -2.62 -0.04 0.00 0.26 0.00 0.00 34.13 31.75 2zag s GLU 637 CO -0.06 -0.12 -0.26 0.00 -0.54 0.00 0.00 175.26 174.28 2zag s ASP 639 N -1.79 4.83 0.40 0.00 3.68 0.60 -3.81 116.67 120.58 2zag s ASP 639 Ca 0.12 -1.03 -0.26 0.00 2.13 0.00 0.00 52.55 53.51 2zag s ASP 639 Cb -0.10 -1.75 -0.08 0.00 -1.45 0.00 0.00 42.92 39.53 2zag s ASP 639 CO 0.05 -0.22 1.23 -2.16 0.13 0.00 0.00 175.17 174.20 2zag s PRO 640 N 1.34 4.01 0.00 4.34 0.04 -1.26 0.33 135.00 143.80 2zag s PRO 640 Ca -0.02 1.99 0.00 0.00 0.04 0.00 0.00 61.00 63.01 2zag s PRO 640 Cb -0.18 -2.72 0.00 0.00 0.04 0.00 0.00 34.50 31.64 2zag s PRO 640 CO -0.01 -0.40 0.51 1.28 0.04 0.00 0.00 177.00 178.42 2zag n LEU 641 N 0.10 0.00 -3.80 -3.56 4.77 -0.61 -2.47 117.00 111.44 2zag n LEU 641 Ca 0.04 0.12 -0.13 0.00 -0.03 0.00 0.00 56.01 56.01 2zag n LEU 641 Cb 0.45 -0.12 -0.13 0.00 -2.33 0.00 0.00 43.42 41.29 2zag n LEU 641 CO 0.53 -0.12 -0.19 -0.69 -1.33 0.00 0.00 177.39 175.59 2zag s VAL 643 N -2.01 -0.01 -0.09 4.08 1.01 0.28 -2.12 120.40 121.53 2zag s VAL 643 Ca 0.00 0.05 0.01 0.00 0.00 0.00 0.00 61.98 62.04 2zag s VAL 643 Cb 0.00 -0.25 0.02 0.00 0.00 0.00 0.00 36.38 36.15 2zag s VAL 643 CO 0.00 0.02 -0.11 -0.89 0.00 0.00 0.00 175.10 174.12 2zag s THR 644 N 0.40 1.16 0.06 3.92 2.01 0.19 -1.78 115.64 121.59 2zag s THR 644 Ca -0.03 -0.43 -0.02 0.00 0.31 0.00 0.00 61.69 61.52 2zag s THR 644 Cb -0.04 -1.10 -0.04 0.00 0.01 0.00 0.00 72.50 71.33 2zag s THR 644 CO -0.02 0.37 0.25 -0.36 -0.69 0.00 0.00 174.62 174.17 2zag s PHE 645 N 1.14 3.52 -0.24 4.92 0.40 -0.77 0.08 117.98 127.04 2zag s PHE 645 Ca -0.05 0.36 -0.17 0.00 -0.60 0.00 0.00 56.93 56.47 2zag s PHE 645 Cb -0.14 -1.84 0.07 0.00 0.51 0.00 0.00 43.02 41.61 2zag s PHE 645 CO -0.02 0.57 0.60 -0.08 0.70 0.00 0.00 175.22 176.99 2zag s THR 646 N -1.49 -0.01 0.48 0.64 -1.32 -0.89 -0.04 115.64 113.01 2zag s THR 646 Ca 0.34 0.02 0.19 0.00 -1.21 0.00 0.00 61.69 61.04 2zag s THR 646 Cb -0.13 -0.86 0.36 0.00 -1.51 0.00 0.00 72.50 70.36 2zag s THR 646 CO 0.25 0.01 1.99 -0.65 -2.21 0.00 0.00 174.62 174.00 2zag h PRO 647 N 6.25 0.19 -0.66 7.08 0.11 -1.98 -3.35 132.00 139.63 2zag h PRO 647 Ca -0.31 -0.01 0.09 0.00 0.11 0.00 0.00 66.00 65.88 2zag h PRO 647 Cb 1.19 -0.04 -0.10 0.00 0.11 0.00 0.00 31.00 32.16 2zag h PRO 647 CO 0.17 0.13 -0.31 0.45 -0.21 0.00 0.00 178.00 178.23 2zag n SER 648 N -4.44 -0.54 0.00 -2.05 2.88 -1.26 -4.82 113.62 103.40 2zag n SER 648 Ca 0.10 1.16 0.00 0.00 -1.33 0.00 0.00 58.87 58.80 2zag n SER 648 Cb 0.48 -0.22 0.00 0.00 -0.75 0.00 0.00 64.21 63.72 2zag n SER 648 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2zag n GLY 649 N -1.26 1.21 3.76 0.46 0.00 0.93 -5.03 105.19 105.27 2zag n GLY 649 Ca 0.05 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.69 2zag n GLY 649 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2zag s LYS 650 N -0.44 3.55 -0.06 1.61 2.20 -1.24 -4.76 119.74 120.60 2zag s LYS 650 Ca 0.00 1.97 0.02 0.00 -0.36 0.00 0.00 55.97 57.60 2zag s LYS 650 Cb 0.00 -2.38 0.01 0.00 -1.51 0.00 0.00 37.83 33.95 2zag s LYS 650 CO 0.00 -0.78 -0.11 0.99 -0.36 0.00 0.00 175.35 175.09 2zag s THR 651 N -1.44 1.07 -0.17 3.43 2.01 -1.26 -1.84 115.64 117.45 2zag s THR 651 Ca 0.66 -0.44 -0.01 0.00 0.31 0.00 0.00 61.69 62.20 2zag s THR 651 Cb -0.34 -0.98 -0.01 0.00 0.01 0.00 0.00 72.50 71.19 2zag s THR 651 CO 0.40 0.34 -0.12 -0.63 -0.69 0.00 0.00 174.62 173.93 2zag s ILE 652 N 0.65 2.97 0.27 1.82 1.01 -0.73 -4.97 121.20 122.22 2zag s ILE 652 Ca -0.14 -0.66 -0.14 0.00 0.00 0.00 0.00 60.65 59.71 2zag s ILE 652 Cb -0.15 -2.28 -0.08 0.00 0.01 0.00 0.00 42.46 39.95 2zag s ILE 652 CO 0.03 0.49 0.68 -0.75 0.00 0.00 0.00 174.94 175.39 2zag s LYS 653 N 0.86 3.98 0.13 2.79 2.20 -1.26 -0.56 119.74 127.88 2zag s LYS 653 Ca -0.03 0.58 0.01 0.00 -0.36 0.00 0.00 55.97 56.17 2zag s LYS 653 Cb -0.15 -2.57 -0.00 0.00 -1.51 0.00 0.00 37.83 33.59 2zag s LYS 653 CO 0.00 0.25 0.04 0.41 -0.36 0.00 0.00 175.35 175.69 2zag n GLY 654 N -0.09 3.87 0.01 5.54 0.00 -0.90 -4.92 105.19 108.70 2zag n GLY 654 Ca 0.01 -2.01 0.11 0.00 0.00 0.00 0.00 46.02 44.13 2zag n GLY 654 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2zag n THR 655 N -0.29 0.06 -3.22 2.61 -2.24 -1.25 -4.56 114.28 105.39 2zag n THR 655 Ca -0.02 -0.16 -0.15 0.00 -2.27 0.00 0.00 64.05 61.45 2zag n THR 655 Cb 0.19 0.51 0.08 0.00 -2.10 0.00 0.00 70.33 69.00 2zag n THR 655 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2zag n GLY 656 N 1.42 -0.24 3.39 3.38 0.00 0.15 -4.82 105.19 108.47 2zag n GLY 656 Ca 0.02 0.02 -0.10 0.00 0.00 0.00 0.00 46.02 45.96 2zag n GLY 656 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2zag s THR 657 N -3.30 0.06 0.55 2.61 -4.23 -0.99 0.57 115.64 110.91 2zag s THR 657 Ca 0.04 -1.10 0.03 0.00 -1.18 0.00 0.00 61.69 59.48 2zag s THR 657 Cb -0.02 -1.67 0.03 0.00 1.34 0.00 0.00 72.50 72.18 2zag s THR 657 CO 0.61 -0.26 0.25 0.00 -0.54 0.00 0.00 174.62 174.68 2zag h SER 659 N 0.94 -0.11 -0.41 0.00 0.87 0.70 -3.41 113.55 112.12 2zag h SER 659 Ca -0.39 0.07 0.00 0.00 -1.23 0.00 0.00 61.79 60.24 2zag h SER 659 Cb 1.32 0.13 0.00 0.00 -0.44 0.00 0.00 62.40 63.40 2zag h SER 659 CO 0.63 -0.02 0.00 -0.90 -0.53 0.00 0.00 176.83 176.01 2zag n ASP 660 N -5.16 -0.24 -2.07 6.23 5.68 -1.26 -4.90 116.55 114.83 2zag n ASP 660 Ca 0.01 -0.15 -0.24 0.00 -0.50 0.00 0.00 54.79 53.91 2zag n ASP 660 Cb 0.17 0.00 0.07 0.00 -1.14 0.00 0.00 41.12 40.22 2zag n ASP 660 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2zag n GLY 661 N 2.76 4.77 3.63 6.12 0.00 -1.26 -4.97 105.19 116.24 2zag n GLY 661 Ca 0.00 -1.53 -0.25 0.00 0.00 0.00 0.00 46.02 44.23 2zag n GLY 661 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2zag s ASN 662 N -0.75 4.56 0.43 1.61 0.01 -1.26 -4.99 114.94 114.55 2zag s ASN 662 Ca 0.46 -0.53 -0.18 0.00 -0.71 0.00 0.00 52.86 51.91 2zag s ASN 662 Cb 0.37 -0.88 -0.09 0.00 0.41 0.00 0.00 41.25 41.05 2zag s ASN 662 CO 0.01 0.06 0.90 0.00 -1.51 0.00 0.00 177.10 176.56 2zag s ALA 663 N -1.92 3.13 -0.52 0.60 0.00 -1.26 -0.59 121.76 121.20 2zag s ALA 663 Ca 0.28 0.22 0.04 0.00 0.00 0.00 0.00 51.96 52.50 2zag s ALA 663 Cb -0.08 -3.03 0.17 0.00 0.00 0.00 0.00 23.12 20.18 2zag s ALA 663 CO 0.18 0.05 0.40 0.12 0.00 0.00 0.00 175.76 176.51 2zag s PHE 664 N -2.29 1.97 -1.43 0.00 5.36 0.19 -4.71 117.98 117.07 2zag s PHE 664 Ca 0.59 -2.69 -0.12 0.00 -0.96 0.00 0.00 56.93 53.75 2zag s PHE 664 Cb -0.10 -1.55 -0.04 0.00 -0.34 0.00 0.00 43.02 41.00 2zag s PHE 664 CO 0.21 -0.73 2.52 -2.30 -1.46 0.00 0.00 175.22 173.46 2zag n PRO 665 N 2.53 3.05 -4.27 10.12 -0.02 -1.26 -4.17 135.00 140.97 2zag n PRO 665 Ca 0.26 -2.26 -0.16 0.00 -2.02 0.00 0.00 63.50 59.32 2zag n PRO 665 Cb 0.43 -2.97 -0.10 0.00 -0.02 0.00 0.00 33.50 30.84 2zag n PRO 665 CO 0.00 0.00 0.00 0.71 1.98 0.00 0.00 175.50 178.19 2zag s TYR 666 N 2.91 1.41 0.30 6.00 1.51 -1.26 -1.74 117.35 126.49 2zag s TYR 666 Ca 0.57 -0.67 0.10 0.00 -1.01 0.00 0.00 57.07 56.07 2zag s TYR 666 Cb 0.15 -0.70 -0.05 0.00 -0.11 0.00 0.00 41.96 41.25 2zag s TYR 666 CO -0.06 0.17 -0.10 0.08 -1.11 0.00 0.00 175.55 174.54 2zag s VAL 667 N -3.00 2.64 -0.06 0.71 1.01 0.54 -1.57 120.40 120.67 2zag s VAL 667 Ca 0.17 -2.19 -0.00 0.00 0.00 0.00 0.00 61.98 59.95 2zag s VAL 667 Cb 0.00 -2.57 0.03 0.00 0.00 0.00 0.00 36.38 33.84 2zag s VAL 667 CO 0.03 -0.32 -0.01 -0.22 0.00 0.00 0.00 175.10 174.58 2zag s LEU 668 N -3.60 0.87 -0.15 3.92 2.96 -1.26 -1.90 118.68 119.52 2zag s LEU 668 Ca 0.32 -0.08 -0.02 0.00 -0.22 0.00 0.00 54.13 54.13 2zag s LEU 668 Cb -0.03 -0.40 -0.02 0.00 0.50 0.00 0.00 46.19 46.25 2zag s LEU 668 CO 0.17 -0.14 -0.09 -1.00 -1.32 0.00 0.00 176.35 173.97 2zag s HIS 669 N 1.54 2.91 -0.10 5.38 3.76 -0.33 0.56 115.29 129.01 2zag s HIS 669 Ca -0.02 -0.55 0.02 0.00 -0.15 0.00 0.00 55.06 54.37 2zag s HIS 669 Cb -0.13 -1.91 -0.02 0.00 1.11 0.00 0.00 32.58 31.63 2zag s HIS 669 CO -0.03 -0.18 -0.16 -0.51 -0.85 0.00 0.00 174.74 173.01 2zag s LEU 670 N 0.47 2.57 0.03 0.89 1.43 0.11 -0.85 118.68 123.34 2zag s LEU 670 Ca -0.07 -0.34 0.07 0.00 -1.03 0.00 0.00 54.13 52.76 2zag s LEU 670 Cb -0.15 -1.54 -0.02 0.00 0.03 0.00 0.00 46.19 44.50 2zag s LEU 670 CO 0.04 0.22 -0.20 -0.89 0.23 0.00 0.00 176.35 175.75 2zag s THR 671 N -0.01 1.61 -0.96 5.49 2.01 0.25 -2.10 115.64 121.93 2zag s THR 671 Ca -0.05 -1.10 0.00 0.00 0.31 0.00 0.00 61.69 60.85 2zag s THR 671 Cb -0.14 -1.39 0.00 0.00 0.01 0.00 0.00 72.50 70.98 2zag s THR 671 CO 0.04 0.25 0.74 -2.65 -0.69 0.00 0.00 174.62 172.31 2zag n PRO 672 N 2.03 0.00 0.00 4.92 -0.02 -1.26 -1.74 135.00 138.93 2zag n PRO 672 Ca -0.17 0.27 0.00 0.00 -2.02 0.00 0.00 63.50 61.58 2zag n PRO 672 Cb 0.53 -1.59 0.00 0.00 -0.02 0.00 0.00 33.50 32.42 2zag n PRO 672 CO 0.00 0.00 0.00 -2.37 1.98 0.00 0.00 175.50 175.11 2zag n THR 673 N -1.24 0.00 -3.54 3.45 5.66 -1.26 -4.98 114.28 112.37 2zag n THR 673 Ca 0.00 0.00 -0.08 0.00 -3.05 0.00 0.00 64.05 60.92 2zag n THR 673 Cb 0.09 0.39 -0.02 0.00 -1.55 0.00 0.00 70.33 69.24 2zag n THR 673 CO 0.00 0.00 0.00 -0.51 -3.05 0.00 0.00 175.07 171.51 2zag s ILE 674 N -2.00 0.00 0.22 1.09 2.07 -0.71 -3.43 121.20 118.45 2zag s ILE 674 Ca 0.00 -0.09 0.07 0.00 -1.41 0.00 0.00 60.65 59.22 2zag s ILE 674 Cb 0.00 -1.14 -0.05 0.00 0.13 0.00 0.00 42.46 41.40 2zag s ILE 674 CO 0.00 0.00 -0.11 -0.83 -1.91 0.00 0.00 174.94 172.09 2zag s GLY 675 N -2.55 1.53 -0.05 1.50 0.00 0.20 -0.58 107.32 107.37 2zag s GLY 675 Ca 0.06 -1.72 -0.01 0.00 0.00 0.00 0.00 44.72 43.04 2zag s GLY 675 CO -0.08 -1.77 0.02 0.14 0.00 0.00 0.00 173.10 171.42 2zag s VAL 676 N -3.01 0.17 -0.48 1.40 1.01 -0.03 0.11 120.40 119.57 2zag s VAL 676 Ca 0.24 0.22 -0.16 0.00 0.00 0.00 0.00 61.98 62.29 2zag s VAL 676 Cb 0.01 -0.35 0.08 0.00 0.00 0.00 0.00 36.38 36.11 2zag s VAL 676 CO 0.08 0.21 0.43 -0.22 0.00 0.00 0.00 175.10 175.60 2zag s LEU 677 N 1.85 5.62 0.06 3.92 2.96 -0.27 -1.19 118.68 131.63 2zag s LEU 677 Ca 0.02 -1.33 0.03 0.00 -0.22 0.00 0.00 54.13 52.63 2zag s LEU 677 Cb -0.12 -2.21 -0.04 0.00 0.50 0.00 0.00 46.19 44.32 2zag s LEU 677 CO -0.04 -0.69 0.03 0.00 -1.32 0.00 0.00 176.35 174.33 2zag s ALA 678 N 1.73 3.39 0.86 5.97 0.00 -0.80 -2.30 121.76 130.61 2zag s ALA 678 Ca 0.05 -1.02 -0.11 0.00 0.00 0.00 0.00 51.96 50.88 2zag s ALA 678 Cb -0.24 -1.33 0.11 0.00 0.00 0.00 0.00 23.12 21.66 2zag s ALA 678 CO 0.07 0.70 1.11 -0.47 0.00 0.00 0.00 175.76 177.17 2zag s TYR 679 N -1.26 2.09 0.26 0.00 5.04 -0.57 -0.34 117.35 122.56 2zag s TYR 679 Ca 0.25 1.61 0.03 0.00 -2.44 0.00 0.00 57.07 56.52 2zag s TYR 679 Cb -0.12 -3.19 0.34 0.00 0.35 0.00 0.00 41.96 39.35 2zag s TYR 679 CO 0.17 -2.39 1.65 0.10 -1.34 0.00 0.00 175.55 173.74 2zag h TYR 680 N -1.56 0.47 0.00 4.97 -0.00 -1.67 -2.67 116.97 116.52 2zag h TYR 680 Ca -0.45 -0.13 -0.01 0.00 0.00 0.00 0.00 58.73 58.14 2zag h TYR 680 Cb 1.26 -0.10 -0.00 0.00 0.00 0.00 0.00 36.73 37.88 2zag h TYR 680 CO 0.52 0.74 -0.05 0.87 -0.00 0.00 0.00 178.16 180.24 2zag h LYS 681 N 0.33 0.00 -0.00 0.10 1.57 -1.91 -2.29 116.57 114.37 2zag h LYS 681 Ca 0.03 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.81 2zag h LYS 681 Cb 0.85 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.16 2zag h LYS 681 CO 0.07 0.05 -0.41 1.33 -0.57 0.00 0.00 179.45 179.92 2zag n VAL 682 N -3.21 2.16 -0.20 0.50 0.24 -1.14 -4.76 118.33 111.92 2zag n VAL 682 Ca -0.00 -3.08 0.11 0.00 -2.04 0.00 0.00 64.34 59.33 2zag n VAL 682 Cb 0.28 -0.24 0.41 0.00 -1.47 0.00 0.00 33.84 32.82 2zag n VAL 682 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2zag h ALA 683 N 0.83 1.87 -0.16 2.33 0.00 -1.06 -2.42 119.26 120.66 2zag h ALA 683 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2zag h ALA 683 Cb 1.01 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.67 2zag h ALA 683 CO 0.00 -0.05 0.00 0.25 0.00 0.00 0.00 179.25 179.45 2zag n THR 684 N -4.51 2.12 -1.55 0.00 -2.24 -1.26 -5.00 114.28 101.84 2zag n THR 684 Ca 0.14 -2.02 -0.50 0.00 -2.27 0.00 0.00 64.05 59.40 2zag n THR 684 Cb 0.40 -0.24 -0.04 0.00 -2.10 0.00 0.00 70.33 68.35 2zag n THR 684 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2zag n ALA 685 N -0.87 -1.42 0.15 6.98 0.00 -0.91 -4.52 120.51 119.91 2zag n ALA 685 Ca 0.19 0.48 0.17 0.00 0.00 0.00 0.00 53.44 54.28 2zag n ALA 685 Cb 0.79 -1.94 0.76 0.00 0.00 0.00 0.00 19.45 19.06 2zag n ALA 685 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 2zag h ASN 686 N 3.02 0.00 -0.82 0.00 2.35 -0.19 0.69 115.58 120.63 2zag h ASN 686 Ca -0.42 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.30 2zag h ASN 686 Cb 1.37 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 39.70 2zag h ASN 686 CO 0.68 0.00 0.41 0.15 -1.65 0.00 0.00 177.43 177.01 2zag h PHE 687 N 0.00 1.17 -0.57 1.19 3.04 -0.67 -1.29 116.94 119.80 2zag h PHE 687 Ca 0.13 -0.05 -0.01 0.00 3.98 0.00 0.00 57.97 62.02 2zag h PHE 687 Cb 0.61 -0.37 -0.03 0.00 2.56 0.00 0.00 35.95 38.72 2zag h PHE 687 CO 0.00 0.84 0.30 0.82 -2.02 0.00 0.00 178.31 178.26 2zag h ILE 688 N 1.17 1.18 0.16 1.41 2.04 -1.10 0.70 117.51 123.06 2zag h ILE 688 Ca 0.29 -0.46 -0.01 0.00 1.00 0.00 0.00 64.86 65.68 2zag h ILE 688 Cb 0.10 0.41 0.00 0.00 -0.74 0.00 0.00 36.82 36.60 2zag h ILE 688 CO -0.04 0.20 -0.08 0.11 0.00 0.00 0.00 178.15 178.34 2zag h LYS 689 N 0.80 -0.21 -0.24 2.37 1.57 -1.30 -2.03 116.57 117.53 2zag h LYS 689 Ca 0.20 0.01 -0.09 0.00 -1.87 0.00 0.00 60.65 58.91 2zag h LYS 689 Cb 0.04 0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.38 2zag h LYS 689 CO -0.03 0.19 -0.23 -0.07 -0.57 0.00 0.00 179.45 178.74 2zag h LEU 690 N -0.69 0.44 0.05 2.94 4.07 -1.09 -2.27 115.31 118.75 2zag h LEU 690 Ca -0.02 -0.14 -0.29 0.00 0.08 0.00 0.00 57.88 57.50 2zag h LEU 690 Cb 0.50 -0.12 -0.03 0.00 1.08 0.00 0.00 40.66 42.09 2zag h LEU 690 CO 0.04 0.68 -1.60 0.00 -1.08 0.00 0.00 178.44 176.48 2zag n ALA 691 N -2.48 0.84 0.08 1.53 0.00 0.22 -4.61 120.51 116.08 2zag n ALA 691 Ca -0.00 -0.55 0.05 0.00 0.00 0.00 0.00 53.44 52.94 2zag n ALA 691 Cb 0.39 -0.58 0.11 0.00 0.00 0.00 0.00 19.45 19.36 2zag n ALA 691 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2zag n PHE 692 N -4.06 0.27 -2.99 0.00 3.01 -0.79 -4.96 117.46 107.95 2zag n PHE 692 Ca -0.33 -0.30 -0.18 0.00 1.01 0.00 0.00 57.45 57.64 2zag n PHE 692 Cb 0.83 -0.02 0.04 0.00 -0.01 0.00 0.00 39.48 40.32 2zag n PHE 692 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2zag n GLY 693 N 0.54 -0.28 3.17 1.37 0.00 -0.85 -4.96 105.19 104.17 2zag n GLY 693 Ca 0.09 -0.02 -0.40 0.00 0.00 0.00 0.00 46.02 45.70 2zag n GLY 693 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2zag s VAL 694 N -3.10 4.28 -0.40 1.61 1.01 -1.15 -4.94 120.40 117.70 2zag s VAL 694 Ca 0.30 -2.71 0.18 0.00 0.00 0.00 0.00 61.98 59.76 2zag s VAL 694 Cb -0.13 -3.74 0.19 0.00 0.00 0.00 0.00 36.38 32.69 2zag s VAL 694 CO 0.37 -0.91 1.56 -0.81 0.00 0.00 0.00 175.10 175.32 2zag n PRO 695 N 3.77 0.12 -1.53 2.72 -0.04 -1.26 -3.79 135.00 134.98 2zag n PRO 695 Ca 0.08 0.56 -0.56 0.00 -0.04 0.00 0.00 63.50 63.54 2zag n PRO 695 Cb 0.41 -1.86 -0.07 0.00 -0.04 0.00 0.00 33.50 31.94 2zag n PRO 695 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2zag n ALA 696 N -1.73 -2.58 -3.14 0.55 0.00 -1.26 -4.68 120.51 107.67 2zag n ALA 696 Ca -0.00 0.57 -0.12 0.00 0.00 0.00 0.00 53.44 53.88 2zag n ALA 696 Cb 0.07 -1.88 -0.10 0.00 0.00 0.00 0.00 19.45 17.54 2zag n ALA 696 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2zag s SER 697 N 0.18 -0.10 -0.02 0.00 0.15 -1.26 -4.75 113.70 107.89 2zag s SER 697 Ca 0.88 0.05 -0.26 0.00 0.70 0.00 0.00 55.95 57.32 2zag s SER 697 Cb -1.14 0.31 -0.20 0.00 -1.71 0.00 0.00 66.02 63.27 2zag s SER 697 CO 0.53 -0.31 1.26 0.71 1.20 0.00 0.00 173.24 176.63 2zag h THR 698 N 4.30 1.38 -2.75 6.45 1.35 -1.93 -3.41 112.91 118.30 2zag h THR 698 Ca -0.29 -1.14 -0.56 0.00 -0.55 0.00 0.00 66.41 63.88 2zag h THR 698 Cb 1.19 2.15 -0.02 0.00 -1.73 0.00 0.00 68.15 69.74 2zag h THR 698 CO 0.39 0.29 1.00 -0.63 -0.25 0.00 0.00 175.52 176.32 2zag s ILE 699 N -4.26 3.86 0.33 6.82 -1.09 -1.26 -4.97 121.20 120.64 2zag s ILE 699 Ca -0.16 1.06 -0.28 0.00 -2.23 0.00 0.00 60.65 59.04 2zag s ILE 699 Cb 0.02 -3.68 -0.10 0.00 -1.58 0.00 0.00 42.46 37.12 2zag s ILE 699 CO 0.67 -0.09 1.20 -2.16 -1.23 0.00 0.00 174.94 173.33 2zag s PRO 700 N 3.72 4.39 0.00 2.79 0.04 -1.26 -2.58 135.00 142.09 2zag s PRO 700 Ca 0.65 1.98 0.00 0.00 0.04 0.00 0.00 61.00 63.67 2zag s PRO 700 Cb -0.29 -3.02 0.00 0.00 0.04 0.00 0.00 34.50 31.23 2zag s PRO 700 CO 0.23 -0.07 0.00 0.41 0.04 0.00 0.00 177.00 177.61 2zag n GLY 701 N 0.90 2.90 0.23 0.56 0.00 -1.26 -4.89 105.19 103.63 2zag n GLY 701 Ca 0.01 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.98 2zag n GLY 701 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2zag h PHE 702 N 0.00 0.62 -0.27 1.61 3.57 -1.89 -2.76 116.94 117.83 2zag h PHE 702 Ca 0.00 0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.47 2zag h PHE 702 Cb 0.00 -0.20 -0.01 0.00 2.79 0.00 0.00 35.95 38.53 2zag h PHE 702 CO 0.00 0.35 -0.04 1.03 -2.23 0.00 0.00 178.31 177.42 2zag h SER 703 N 0.66 0.50 -0.54 0.41 0.87 -1.83 0.38 113.55 113.99 2zag h SER 703 Ca 0.23 -0.35 0.03 0.00 -1.23 0.00 0.00 61.79 60.47 2zag h SER 703 Cb 0.03 -0.13 -0.04 0.00 -0.44 0.00 0.00 62.40 61.82 2zag h SER 703 CO -0.10 0.72 0.32 0.44 -0.53 0.00 0.00 176.83 177.68 2zag h ASP 704 N 0.26 0.50 0.36 6.23 3.32 -1.91 -2.77 116.42 122.40 2zag h ASP 704 Ca 0.07 0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.12 2zag h ASP 704 Cb 0.49 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.94 2zag h ASP 704 CO 0.02 0.35 -0.32 0.11 -1.72 0.00 0.00 179.24 177.68 2zag h LYS 705 N 0.62 -0.64 -0.92 3.56 1.57 -1.33 -2.96 116.57 116.47 2zag h LYS 705 Ca 0.22 0.04 0.34 0.00 -1.87 0.00 0.00 60.65 59.39 2zag h LYS 705 Cb 0.05 0.15 -0.17 0.00 0.08 0.00 0.00 32.23 32.34 2zag h LYS 705 CO -0.11 -0.43 0.35 -0.11 -0.57 0.00 0.00 179.45 178.58 2zag n LEU 706 N -4.33 0.19 0.06 2.94 7.94 0.11 0.14 117.00 124.05 2zag n LEU 706 Ca -0.08 1.54 0.11 0.00 -1.11 0.00 0.00 56.01 56.46 2zag n LEU 706 Cb 0.30 -0.69 0.44 0.00 0.53 0.00 0.00 43.42 44.00 2zag n LEU 706 CO 0.18 -1.67 0.83 0.49 -1.11 0.00 0.00 177.39 176.11 2zag n PHE 707 N -5.17 0.42 0.28 1.96 3.01 -1.07 -1.33 117.46 115.57 2zag n PHE 707 Ca 0.31 0.15 0.12 0.00 1.01 0.00 0.00 57.45 59.04 2zag n PHE 707 Cb 1.04 -0.74 0.14 0.00 -0.01 0.00 0.00 39.48 39.90 2zag n PHE 707 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 2zag h SER 708 N 0.00 0.00 0.28 4.37 4.64 -0.34 -3.32 113.55 119.18 2zag h SER 708 Ca 0.00 -0.03 -0.33 0.00 -0.47 0.00 0.00 61.79 60.96 2zag h SER 708 Cb 0.40 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.44 2zag h SER 708 CO 0.00 0.02 -1.98 0.59 -0.87 0.00 0.00 176.83 174.59 2zag n ASN 709 N -2.70 0.94 -4.02 4.97 4.13 -0.61 -4.48 115.26 113.49 2zag n ASN 709 Ca 0.03 0.24 -0.31 0.00 1.68 0.00 0.00 54.58 56.21 2zag n ASN 709 Cb 0.51 0.05 -0.15 0.00 -1.54 0.00 0.00 39.78 38.65 2zag n ASN 709 CO 0.00 0.00 0.00 -0.36 0.28 0.00 0.00 177.26 177.18 2zag s PHE 710 N -2.56 3.67 -0.23 3.10 0.40 -0.44 -1.81 117.98 120.10 2zag s PHE 710 Ca -0.11 -2.99 -0.17 0.00 -0.60 0.00 0.00 56.93 53.06 2zag s PHE 710 Cb 0.07 -2.94 -0.03 0.00 0.51 0.00 0.00 43.02 40.63 2zag s PHE 710 CO 0.80 -0.92 0.47 -2.00 0.70 0.00 0.00 175.22 174.27 2zag s GLU 711 N 0.73 4.11 -0.28 0.44 2.12 -0.55 -4.58 118.70 120.69 2zag s GLU 711 Ca 0.12 0.28 -0.29 0.00 0.36 0.00 0.00 54.97 55.43 2zag s GLU 711 Cb -0.20 -3.61 -0.01 0.00 0.26 0.00 0.00 34.13 30.57 2zag s GLU 711 CO -0.06 -0.22 1.46 -1.25 -0.54 0.00 0.00 175.26 174.64 2zag s PRO 712 N 1.89 3.80 -0.13 4.30 0.04 -1.26 0.04 135.00 143.68 2zag s PRO 712 Ca 0.20 1.38 0.14 0.00 0.04 0.00 0.00 61.00 62.76 2zag s PRO 712 Cb -0.15 -3.97 -0.19 0.00 0.04 0.00 0.00 34.50 30.22 2zag s PRO 712 CO 0.09 -1.28 0.10 1.33 0.04 0.00 0.00 177.00 177.28 2zag n VAL 713 N 6.45 0.86 -3.68 -0.36 0.24 -0.01 -4.96 118.33 116.87 2zag n VAL 713 Ca 0.17 -0.59 -0.13 0.00 -2.04 0.00 0.00 64.34 61.75 2zag n VAL 713 Cb 0.46 -0.49 -0.09 0.00 -1.47 0.00 0.00 33.84 32.26 2zag n VAL 713 CO 0.00 0.00 0.00 -0.47 -2.14 0.00 0.00 176.83 174.22 2zag s TYR 714 N -2.48 -0.66 0.44 6.34 6.14 -1.17 -5.01 117.35 120.96 2zag s TYR 714 Ca -0.07 1.55 0.06 0.00 0.64 0.00 0.00 57.07 59.24 2zag s TYR 714 Cb 0.05 0.25 -0.05 0.00 0.42 0.00 0.00 41.96 42.64 2zag s TYR 714 CO 0.62 -0.32 0.10 -1.21 0.64 0.00 0.00 175.55 175.38 2zag s GLU 715 N 0.51 2.13 0.00 4.97 2.02 -1.26 -0.21 118.70 126.85 2zag s GLU 715 Ca -0.02 -2.06 0.00 0.00 0.02 0.00 0.00 54.97 52.91 2zag s GLU 715 Cb -0.04 -1.78 0.00 0.00 0.10 0.00 0.00 34.13 32.40 2zag s GLU 715 CO -0.02 -0.18 0.00 0.45 0.02 0.00 0.00 175.26 175.53 2zag n SER 716 N -1.19 0.00 0.00 -0.19 2.88 -0.97 -4.92 113.62 109.23 2zag n SER 716 Ca -0.06 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.48 2zag n SER 716 Cb 0.66 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.12 2zag n SER 716 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2zag n GLY 717 N 0.00 -0.43 1.54 0.46 0.00 -1.13 -4.63 105.19 100.99 2zag n GLY 717 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.10 2zag n GLY 717 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2zag n ASN 718 N 0.00 4.90 -4.53 1.61 5.03 0.69 -4.91 115.26 118.05 2zag n ASN 718 Ca 0.00 -2.71 -0.34 0.00 0.87 0.00 0.00 54.58 52.40 2zag n ASN 718 Cb 0.00 -0.60 -0.12 0.00 -1.02 0.00 0.00 39.78 38.04 2zag n ASN 718 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 2zag s VAL 719 N -2.33 3.61 -0.07 2.41 1.01 -1.23 0.62 120.40 124.42 2zag s VAL 719 Ca 0.50 -0.50 0.01 0.00 0.00 0.00 0.00 61.98 61.99 2zag s VAL 719 Cb 0.36 -2.50 0.02 0.00 0.00 0.00 0.00 36.38 34.26 2zag s VAL 719 CO 0.18 0.57 -0.09 -0.63 0.00 0.00 0.00 175.10 175.13 2zag s ILE 720 N -0.45 0.97 -0.29 2.22 1.01 -0.31 -2.29 121.20 122.05 2zag s ILE 720 Ca 0.06 -0.35 -0.11 0.00 0.00 0.00 0.00 60.65 60.26 2zag s ILE 720 Cb -0.12 -0.93 -0.03 0.00 0.01 0.00 0.00 42.46 41.39 2zag s ILE 720 CO 0.02 0.33 0.18 0.54 0.00 0.00 0.00 174.94 176.00 2zag s VAL 721 N 0.95 5.02 -0.13 2.92 0.11 0.71 -1.25 120.40 128.74 2zag s VAL 721 Ca -0.10 -0.08 -0.05 0.00 -2.93 0.00 0.00 61.98 58.83 2zag s VAL 721 Cb -0.15 -3.46 -0.04 0.00 -1.53 0.00 0.00 36.38 31.20 2zag s VAL 721 CO 0.00 0.17 0.06 -0.31 -3.33 0.00 0.00 175.10 171.70 2zag s TYR 722 N 1.70 3.33 -0.19 1.54 1.51 0.10 -0.83 117.35 124.51 2zag s TYR 722 Ca 0.06 0.26 -0.21 0.00 -1.01 0.00 0.00 57.07 56.17 2zag s TYR 722 Cb -0.16 -1.92 -0.02 0.00 -0.11 0.00 0.00 41.96 39.74 2zag s TYR 722 CO 0.09 0.46 0.65 0.50 -1.11 0.00 0.00 175.55 176.14 2zag s ARG 723 N -0.55 4.23 0.29 -0.62 3.52 0.11 -0.35 118.95 125.59 2zag s ARG 723 Ca 0.11 0.67 -0.03 0.00 -0.13 0.00 0.00 55.73 56.35 2zag s ARG 723 Cb -0.12 -3.57 -0.04 0.00 -1.56 0.00 0.00 34.95 29.66 2zag s ARG 723 CO 0.02 -0.23 0.53 0.12 -0.81 0.00 0.00 175.30 174.93 2zag s PHE 724 N 1.88 3.49 -0.30 5.12 5.36 0.21 -1.48 117.98 132.25 2zag s PHE 724 Ca 0.30 0.51 -0.12 0.00 -0.96 0.00 0.00 56.93 56.66 2zag s PHE 724 Cb -0.16 -2.00 0.17 0.00 -0.34 0.00 0.00 43.02 40.68 2zag s PHE 724 CO 0.11 0.18 0.91 -0.08 -1.46 0.00 0.00 175.22 174.88 2zag s THR 725 N -2.13 -0.59 0.25 0.12 -1.32 -0.75 -4.83 115.64 106.39 2zag s THR 725 Ca 0.42 0.00 0.34 0.00 -1.21 0.00 0.00 61.69 61.24 2zag s THR 725 Cb -0.10 -1.00 0.34 0.00 -1.51 0.00 0.00 72.50 70.23 2zag s THR 725 CO 0.32 0.00 2.04 1.55 -2.21 0.00 0.00 174.62 176.32 2zag h PRO 726 N 7.71 0.00 -3.77 7.08 0.13 -1.86 -3.39 132.00 137.91 2zag h PRO 726 Ca -0.16 0.00 -0.50 0.00 -0.87 0.00 0.00 66.00 64.47 2zag h PRO 726 Cb 1.13 0.00 -0.39 0.00 0.13 0.00 0.00 31.00 31.87 2zag h PRO 726 CO 0.07 0.00 -0.77 -0.06 -0.23 0.00 0.00 178.00 177.01 2zag s PHE 727 N -3.85 1.08 0.29 1.56 0.40 -1.25 -0.07 117.98 116.12 2zag s PHE 727 Ca -0.03 -0.67 0.03 0.00 -0.60 0.00 0.00 56.93 55.66 2zag s PHE 727 Cb 0.10 -1.02 -0.04 0.00 0.51 0.00 0.00 43.02 42.57 2zag s PHE 727 CO 0.32 -0.51 0.17 0.20 0.70 0.00 0.00 175.22 176.10 2zag s GLY 728 N 1.84 1.96 -0.23 4.36 0.00 -0.42 -4.74 107.32 110.09 2zag s GLY 728 Ca 0.02 -1.79 -0.03 0.00 0.00 0.00 0.00 44.72 42.91 2zag s GLY 728 CO -0.07 -1.54 -0.06 -0.42 0.00 0.00 0.00 173.10 171.01 2zag s ILE 729 N -3.70 3.12 -2.03 0.90 1.01 -1.26 -0.29 121.20 118.96 2zag s ILE 729 Ca 0.37 -0.69 0.24 0.00 0.00 0.00 0.00 60.65 60.57 2zag s ILE 729 Cb 0.05 -2.46 0.08 0.00 0.01 0.00 0.00 42.46 40.14 2zag s ILE 729 CO 0.18 0.36 1.23 0.00 0.00 0.00 0.00 174.94 176.71 2zag n TYR 730 N 4.75 0.00 -3.64 3.97 0.18 -0.52 -4.81 117.16 117.09 2zag n TYR 730 Ca -0.18 0.00 -0.07 0.00 1.88 0.00 0.00 57.90 59.53 2zag n TYR 730 Cb 0.50 -0.03 -0.07 0.00 -0.38 0.00 0.00 39.34 39.36 2zag n TYR 730 CO 0.00 0.00 0.00 0.21 -2.08 0.00 0.00 176.86 174.99 2zag s LYS 731 N -2.45 0.54 -0.13 -3.48 2.20 -1.25 -4.93 119.74 110.24 2zag s LYS 731 Ca 0.21 0.79 0.01 0.00 -0.36 0.00 0.00 55.97 56.62 2zag s LYS 731 Cb 0.19 0.19 0.02 0.00 -1.51 0.00 0.00 37.83 36.71 2zag s LYS 731 CO 0.54 -0.09 -0.16 0.42 -0.36 0.00 0.00 175.35 175.70 2zag s ILE 732 N 0.90 1.62 0.05 5.43 1.01 -1.26 -0.87 121.20 128.08 2zag s ILE 732 Ca -0.04 -0.69 0.07 0.00 0.00 0.00 0.00 60.65 59.99 2zag s ILE 732 Cb -0.05 -1.49 -0.03 0.00 0.01 0.00 0.00 42.46 40.90 2zag s ILE 732 CO -0.11 0.47 -0.15 -1.61 0.00 0.00 0.00 174.94 173.53 2zag s GLU 733 N 1.21 2.13 -0.05 2.79 2.02 -0.51 -0.60 118.70 125.70 2zag s GLU 733 Ca -0.01 -0.96 0.06 0.00 0.02 0.00 0.00 54.97 54.08 2zag s GLU 733 Cb -0.14 -2.25 -0.01 0.00 0.10 0.00 0.00 34.13 31.83 2zag s GLU 733 CO -0.06 0.54 -0.23 -2.00 0.02 0.00 0.00 175.26 173.53 2zag s GLU 734 N -1.59 2.22 -0.42 1.61 2.12 0.18 -0.34 118.70 122.48 2zag s GLU 734 Ca 0.16 -0.82 -0.28 0.00 0.36 0.00 0.00 54.97 54.39 2zag s GLU 734 Cb -0.11 -1.94 -0.01 0.00 0.26 0.00 0.00 34.13 32.33 2zag s GLU 734 CO 0.07 0.37 1.73 1.21 -0.54 0.00 0.00 175.26 178.10 2zag s ASN 735 N -0.19 5.84 -0.95 -1.70 2.47 -0.61 -1.88 114.94 117.92 2zag s ASN 735 Ca -0.01 0.95 -0.07 0.00 0.42 0.00 0.00 52.86 54.15 2zag s ASN 735 Cb -0.12 -2.53 0.24 0.00 -1.45 0.00 0.00 41.25 37.39 2zag s ASN 735 CO 0.02 -1.82 0.88 -0.63 -3.72 0.00 0.00 177.10 171.84 2zag s ILE 736 N 7.10 5.14 -0.25 -5.21 1.01 0.32 -4.81 121.20 124.50 2zag s ILE 736 Ca 0.72 -3.41 -0.14 0.00 0.00 0.00 0.00 60.65 57.82 2zag s ILE 736 Cb -0.18 -4.15 0.02 0.00 0.01 0.00 0.00 42.46 38.16 2zag s ILE 736 CO 0.30 -1.10 0.29 -0.46 0.00 0.00 0.00 174.94 173.97 2zag n ASN 737 N 2.82 -6.69 0.00 3.58 0.23 -1.26 -3.17 115.26 110.77 2zag n ASN 737 Ca 0.20 0.43 0.00 0.00 -0.53 0.00 0.00 54.58 54.68 2zag n ASN 737 Cb 0.39 -2.79 0.00 0.00 -2.08 0.00 0.00 39.78 35.30 2zag n ASN 737 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2zag n GLY 738 N 0.52 2.55 3.35 4.83 0.00 -1.26 -4.96 105.19 110.21 2zag n GLY 738 Ca -0.01 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.68 2zag n GLY 738 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2zag s THR 739 N -0.25 2.89 0.17 2.61 2.01 -1.19 -5.10 115.64 116.78 2zag s THR 739 Ca 0.00 -0.72 -0.30 0.00 0.31 0.00 0.00 61.69 60.98 2zag s THR 739 Cb 0.00 -2.20 -0.07 0.00 0.01 0.00 0.00 72.50 70.24 2zag s THR 739 CO 0.00 0.53 0.96 0.26 -0.69 0.00 0.00 174.62 175.68 2zag s TRP 740 N 0.34 3.87 -0.01 4.92 0.52 -1.26 -0.52 118.94 126.80 2zag s TRP 740 Ca -0.12 1.84 -0.01 0.00 0.02 0.00 0.00 56.10 57.83 2zag s TRP 740 Cb -0.16 -3.04 0.00 0.00 -1.15 0.00 0.00 33.47 29.12 2zag s TRP 740 CO 0.06 0.26 0.02 0.21 0.02 0.00 0.00 176.95 177.53 2zag s LYS 741 N -0.54 0.05 0.19 4.98 2.20 -0.79 -4.92 119.74 120.92 2zag s LYS 741 Ca 0.45 -0.00 -0.30 0.00 -0.36 0.00 0.00 55.97 55.75 2zag s LYS 741 Cb -0.25 0.02 -0.08 0.00 -1.51 0.00 0.00 37.83 36.01 2zag s LYS 741 CO 0.31 -0.01 1.17 -1.14 -0.36 0.00 0.00 175.35 175.32 2zag s GLN 742 N -0.08 4.52 0.21 4.03 0.74 -1.26 0.47 119.66 128.29 2zag s GLN 742 Ca -0.01 1.84 0.09 0.00 0.05 0.00 0.00 55.36 57.33 2zag s GLN 742 Cb -0.01 -3.24 -0.05 0.00 1.10 0.00 0.00 33.01 30.81 2zag s GLN 742 CO -0.00 -0.03 -0.17 0.14 -0.55 0.00 0.00 175.29 174.68 2zag s VAL 743 N -0.17 1.94 0.00 1.34 -7.23 0.23 -4.89 120.40 111.62 2zag s VAL 743 Ca 0.51 -2.18 0.00 0.00 -1.81 0.00 0.00 61.98 58.51 2zag s VAL 743 Cb -0.32 -2.05 0.00 0.00 0.56 0.00 0.00 36.38 34.57 2zag s VAL 743 CO 0.37 -0.47 0.22 -1.22 -0.31 0.00 0.00 175.10 173.69 2zag n TYR 744 N -0.24 0.00 -3.71 2.82 4.02 -1.26 -4.26 117.16 114.52 2zag n TYR 744 Ca -0.09 0.00 -0.12 0.00 -0.01 0.00 0.00 57.90 57.68 2zag n TYR 744 Cb 0.59 0.00 -0.10 0.00 -0.02 0.00 0.00 39.34 39.81 2zag n TYR 744 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 2zag s ASN 745 N -0.36 -0.49 0.31 7.72 2.20 -1.26 -4.48 114.94 118.57 2zag s ASN 745 Ca 0.00 0.92 0.07 0.00 -0.94 0.00 0.00 52.86 52.91 2zag s ASN 745 Cb 0.00 0.90 -0.02 0.00 -2.00 0.00 0.00 41.25 40.13 2zag s ASN 745 CO 0.00 -0.17 0.38 -0.76 -2.94 0.00 0.00 177.10 173.61 2zag s LEU 746 N 0.54 3.93 0.42 3.54 1.43 -0.92 -4.83 118.68 122.79 2zag s LEU 746 Ca -0.02 -0.22 0.07 0.00 -1.03 0.00 0.00 54.13 52.92 2zag s LEU 746 Cb -0.04 -2.60 -0.06 0.00 0.03 0.00 0.00 46.19 43.52 2zag s LEU 746 CO -0.03 -0.31 0.12 0.42 0.23 0.00 0.00 176.35 176.78 2zag s THR 747 N -2.17 2.16 0.33 5.49 -4.23 -1.26 -0.81 115.64 115.15 2zag s THR 747 Ca 0.41 -1.80 -0.25 0.00 -1.18 0.00 0.00 61.69 58.87 2zag s THR 747 Cb -0.08 -2.96 -0.10 0.00 1.34 0.00 0.00 72.50 70.70 2zag s THR 747 CO 0.29 0.00 0.93 -2.84 -0.54 0.00 0.00 174.62 172.46 2zag s PRO 748 N -3.85 4.52 0.00 3.99 0.02 -1.26 -4.82 135.00 133.60 2zag s PRO 748 Ca 0.38 1.27 0.00 0.00 0.02 0.00 0.00 61.00 62.67 2zag s PRO 748 Cb 0.06 -2.72 0.00 0.00 0.02 0.00 0.00 34.50 31.85 2zag s PRO 748 CO 0.20 0.25 0.00 0.41 -0.33 0.00 0.00 177.00 177.53 2zag n GLY 749 N 0.41 0.34 3.73 0.52 0.00 -0.16 -4.91 105.19 105.13 2zag n GLY 749 Ca 0.02 -2.27 -0.42 0.00 0.00 0.00 0.00 46.02 43.36 2zag n GLY 749 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2zag s LYS 750 N -0.20 4.42 0.11 1.61 1.02 -1.26 -1.75 119.74 123.70 2zag s LYS 750 Ca 0.00 1.94 -0.02 0.00 0.02 0.00 0.00 55.97 57.91 2zag s LYS 750 Cb 0.00 -3.25 -0.04 0.00 -0.52 0.00 0.00 37.83 34.02 2zag s LYS 750 CO 0.00 -0.23 0.05 -1.01 -0.92 0.00 0.00 175.35 173.24 2zag s HIS 751 N 0.42 0.74 -0.27 3.18 3.76 0.38 -4.99 115.29 118.51 2zag s HIS 751 Ca 0.57 -1.15 -0.02 0.00 -0.15 0.00 0.00 55.06 54.30 2zag s HIS 751 Cb -0.34 -0.42 0.09 0.00 1.11 0.00 0.00 32.58 33.02 2zag s HIS 751 CO 0.34 -0.50 0.09 -2.00 -0.85 0.00 0.00 174.74 171.83 2zag s GLU 752 N -4.01 0.53 0.30 1.40 2.12 -1.26 -2.08 118.70 115.70 2zag s GLU 752 Ca 0.19 -0.75 0.09 0.00 0.36 0.00 0.00 54.97 54.87 2zag s GLU 752 Cb 0.07 -1.78 -0.05 0.00 0.26 0.00 0.00 34.13 32.64 2zag s GLU 752 CO -0.01 -0.91 0.01 -0.51 -0.54 0.00 0.00 175.26 173.30 2zag s LEU 753 N 1.82 3.10 -0.20 2.70 1.43 -0.41 -1.58 118.68 125.55 2zag s LEU 753 Ca 0.07 -0.79 -0.01 0.00 -1.03 0.00 0.00 54.13 52.37 2zag s LEU 753 Cb -0.17 -1.57 0.06 0.00 0.03 0.00 0.00 46.19 44.54 2zag s LEU 753 CO -0.24 -0.11 -0.00 -0.75 0.23 0.00 0.00 176.35 175.47 2zag s LYS 754 N -3.70 1.07 -0.11 1.70 2.20 0.53 -1.04 119.74 120.39 2zag s LYS 754 Ca 0.33 -0.62 -0.14 0.00 -0.36 0.00 0.00 55.97 55.19 2zag s LYS 754 Cb -0.04 -2.24 -0.05 0.00 -1.51 0.00 0.00 37.83 33.99 2zag s LYS 754 CO 0.20 -0.60 0.32 -0.51 -0.36 0.00 0.00 175.35 174.40 2zag s LEU 755 N 1.68 4.32 -0.46 5.43 1.43 -0.43 -1.42 118.68 129.22 2zag s LEU 755 Ca -0.02 0.65 -0.11 0.00 -1.03 0.00 0.00 54.13 53.61 2zag s LEU 755 Cb -0.17 -2.42 0.10 0.00 0.03 0.00 0.00 46.19 43.72 2zag s LEU 755 CO -0.07 0.18 0.35 -0.31 0.23 0.00 0.00 176.35 176.72 2zag s TYR 756 N -0.07 3.34 0.29 0.29 1.51 -0.05 -1.83 117.35 120.83 2zag s TYR 756 Ca 0.19 -1.54 -0.23 0.00 -1.01 0.00 0.00 57.07 54.48 2zag s TYR 756 Cb -0.14 -3.31 -0.09 0.00 -0.11 0.00 0.00 41.96 38.30 2zag s TYR 756 CO 0.07 -0.92 0.86 0.42 -1.11 0.00 0.00 175.55 174.86 2zag s ILE 757 N 1.46 4.36 -0.14 2.71 -1.09 -1.26 -1.44 121.20 125.79 2zag s ILE 757 Ca 0.04 1.60 -0.00 0.00 -2.23 0.00 0.00 60.65 60.06 2zag s ILE 757 Cb -0.25 -3.94 0.03 0.00 -1.58 0.00 0.00 42.46 36.72 2zag s ILE 757 CO 0.02 0.15 -0.09 -0.55 -1.23 0.00 0.00 174.94 173.25 2zag s SER 758 N -1.65 2.48 -0.32 3.58 0.15 0.61 -4.66 113.70 113.89 2zag s SER 758 Ca 0.48 -0.44 -0.04 0.00 0.70 0.00 0.00 55.95 56.64 2zag s SER 758 Cb -0.18 -0.94 0.04 0.00 -1.71 0.00 0.00 66.02 63.24 2zag s SER 758 CO 0.22 -0.12 0.06 0.00 1.20 0.00 0.00 173.24 174.60 2zag s ALA 759 N 1.63 2.94 -0.54 5.45 0.00 -1.25 -1.31 121.76 128.69 2zag s ALA 759 Ca 0.04 -1.74 -0.20 0.00 0.00 0.00 0.00 51.96 50.07 2zag s ALA 759 Cb -0.13 -2.12 0.07 0.00 0.00 0.00 0.00 23.12 20.94 2zag s ALA 759 CO -0.09 -1.29 0.69 0.12 0.00 0.00 0.00 175.76 175.20 2zag s PHE 760 N 1.34 2.99 0.00 0.00 5.36 0.90 -4.54 117.98 124.04 2zag s PHE 760 Ca -0.03 -0.59 0.00 0.00 -0.96 0.00 0.00 56.93 55.35 2zag s PHE 760 Cb -0.19 -3.75 0.00 0.00 -0.34 0.00 0.00 43.02 38.74 2zag s PHE 760 CO 0.01 -1.16 0.00 0.41 -1.46 0.00 0.00 175.22 173.02 2zag n GLY 761 N 5.20 1.85 3.48 13.12 0.00 -1.26 -4.63 105.19 122.95 2zag n GLY 761 Ca -0.06 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.79 2zag n GLY 761 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2zag s ARG 762 N -0.54 0.98 0.75 1.61 1.70 -1.26 -4.31 118.95 117.87 2zag s ARG 762 Ca 0.00 0.24 -0.11 0.00 -0.47 0.00 0.00 55.73 55.39 2zag s ARG 762 Cb 0.00 0.46 0.05 0.00 -0.57 0.00 0.00 34.95 34.88 2zag s ARG 762 CO 0.00 -0.29 1.09 -0.51 -1.08 0.00 0.00 175.30 174.51 2zag s ASP 763 N -1.09 4.65 -0.20 -2.89 -0.00 -1.26 -4.40 116.67 111.48 2zag s ASP 763 Ca -0.11 1.82 -0.18 0.00 -0.00 0.00 0.00 52.55 54.09 2zag s ASP 763 Cb -0.01 -2.52 -0.03 0.00 -0.00 0.00 0.00 42.92 40.35 2zag s ASP 763 CO 0.08 -1.93 0.50 -0.63 -0.00 0.00 0.00 175.17 173.19 2zag s ILE 764 N -2.85 5.12 -0.17 0.77 1.01 -1.26 -4.96 121.20 118.86 2zag s ILE 764 Ca 0.61 0.91 0.01 0.00 0.00 0.00 0.00 60.65 62.19 2zag s ILE 764 Cb -0.17 -3.82 0.01 0.00 0.01 0.00 0.00 42.46 38.49 2zag s ILE 764 CO 0.54 0.18 -0.20 -1.61 0.00 0.00 0.00 174.94 173.85 2zag s GLU 765 N 1.63 3.02 -0.78 2.79 2.02 -1.26 -3.81 118.70 122.30 2zag s GLU 765 Ca 0.23 -0.83 -0.03 0.00 0.02 0.00 0.00 54.97 54.37 2zag s GLU 765 Cb -0.15 -2.54 0.00 0.00 0.10 0.00 0.00 34.13 31.54 2zag s GLU 765 CO 0.09 -0.14 0.59 0.09 0.02 0.00 0.00 175.26 175.92 2zag n ASN 766 N 4.42 -4.72 -4.43 -0.19 3.02 -0.63 -4.66 115.26 108.08 2zag n ASN 766 Ca -0.21 -0.91 -0.29 0.00 -0.03 0.00 0.00 54.58 53.15 2zag n ASN 766 Cb 0.51 -1.55 -0.08 0.00 -0.61 0.00 0.00 39.78 38.04 2zag n ASN 766 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2zag s ALA 767 N -2.86 3.43 -0.04 5.41 0.00 0.52 -4.77 121.76 123.45 2zag s ALA 767 Ca 0.03 -0.94 -0.02 0.00 0.00 0.00 0.00 51.96 51.02 2zag s ALA 767 Cb -0.00 0.41 0.02 0.00 0.00 0.00 0.00 23.12 23.55 2zag s ALA 767 CO 0.88 -0.19 0.09 0.99 0.00 0.00 0.00 175.76 177.52 2zag s THR 768 N -3.05 -0.03 -0.07 0.00 2.01 -1.01 -2.86 115.64 110.63 2zag s THR 768 Ca 0.17 0.10 0.05 0.00 0.31 0.00 0.00 61.69 62.32 2zag s THR 768 Cb 0.03 -0.14 -0.01 0.00 0.01 0.00 0.00 72.50 72.38 2zag s THR 768 CO 0.10 0.04 -0.24 -1.48 -0.69 0.00 0.00 174.62 172.35 2zag s LEU 769 N 0.59 2.14 0.41 4.42 0.05 -0.51 -0.80 118.68 124.98 2zag s LEU 769 Ca -0.05 -0.50 0.06 0.00 0.05 0.00 0.00 54.13 53.69 2zag s LEU 769 Cb -0.06 -1.40 -0.07 0.00 -2.05 0.00 0.00 46.19 42.60 2zag s LEU 769 CO -0.02 0.22 0.02 -0.31 -0.55 0.00 0.00 176.35 175.71 2zag s TYR 770 N -0.03 2.37 -0.10 3.48 1.51 -0.37 -1.91 117.35 122.31 2zag s TYR 770 Ca -0.07 -0.75 0.02 0.00 -1.01 0.00 0.00 57.07 55.26 2zag s TYR 770 Cb -0.15 -1.69 -0.01 0.00 -0.11 0.00 0.00 41.96 40.00 2zag s TYR 770 CO 0.05 0.36 -0.17 0.42 -1.11 0.00 0.00 175.55 175.10 2zag s ILE 771 N -2.82 2.77 -0.37 2.71 1.01 0.13 -1.05 121.20 123.60 2zag s ILE 771 Ca 0.32 -0.78 -0.10 0.00 0.00 0.00 0.00 60.65 60.09 2zag s ILE 771 Cb 0.09 -2.12 0.03 0.00 0.01 0.00 0.00 42.46 40.48 2zag s ILE 771 CO 0.16 0.55 0.18 -0.31 0.00 0.00 0.00 174.94 175.52 2zag s TYR 772 N 0.03 3.25 0.08 3.97 1.51 0.06 -1.66 117.35 124.59 2zag s TYR 772 Ca -0.06 -1.12 -0.31 0.00 -1.01 0.00 0.00 57.07 54.57 2zag s TYR 772 Cb -0.15 -2.40 -0.07 0.00 -0.11 0.00 0.00 41.96 39.23 2zag s TYR 772 CO 0.05 -0.68 1.43 0.00 -1.11 0.00 0.00 175.55 175.24 2zag s ALA 773 N 1.50 3.61 -0.13 3.71 0.00 -0.69 -2.25 121.76 127.51 2zag s ALA 773 Ca 0.01 1.07 0.03 0.00 0.00 0.00 0.00 51.96 53.07 2zag s ALA 773 Cb -0.19 -3.58 0.01 0.00 0.00 0.00 0.00 23.12 19.36 2zag s ALA 773 CO 0.05 -0.76 -0.22 0.42 0.00 0.00 0.00 175.76 175.25 2zag s ILE 774 N 1.66 2.05 0.00 0.00 -1.09 0.33 0.17 121.20 124.32 2zag s ILE 774 Ca 0.66 -0.98 0.05 0.00 -2.23 0.00 0.00 60.65 58.15 2zag s ILE 774 Cb -0.36 -1.81 -0.02 0.00 -1.58 0.00 0.00 42.46 38.70 2zag s ILE 774 CO 0.29 0.55 -0.16 0.21 -1.23 0.00 0.00 174.94 174.60 2zag s ASN 775 N 0.74 1.92 0.00 3.58 2.47 -0.38 -1.42 114.94 121.85 2zag s ASN 775 Ca -0.09 -0.35 0.00 0.00 0.42 0.00 0.00 52.86 52.84 2zag s ASN 775 Cb -0.16 -0.19 0.00 0.00 -1.45 0.00 0.00 41.25 39.45 2zag s ASN 775 CO -0.00 0.17 0.00 -3.20 -3.72 0.00 0.00 177.10 170.35 2zag n ASN 776 N 2.45 0.00 -0.00 -4.21 2.85 -1.26 -0.18 115.26 114.91 2zag n ASN 776 Ca -0.15 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.32 2zag n ASN 776 Cb 0.54 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.56 2zag n ASN 776 CO 0.00 0.00 0.00 1.21 -2.11 0.00 0.00 177.26 176.36 2zag n GLU 777 N 0.00 0.00 -4.19 1.20 2.13 -1.26 -5.10 120.64 113.42 2zag n GLU 777 Ca 0.00 0.00 -0.23 0.00 0.66 0.00 0.00 57.16 57.59 2zag n GLU 777 Cb 0.00 0.00 -0.06 0.00 0.27 0.00 0.00 31.44 31.65 2zag n GLU 777 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 2zag s LYS 778 N 0.00 2.65 -0.69 5.31 -0.14 0.74 -5.08 119.74 122.54 2zag s LYS 778 Ca 0.00 -1.18 -0.23 0.00 -1.36 0.00 0.00 55.97 53.20 2zag s LYS 778 Cb 0.00 -2.40 0.06 0.00 -1.68 0.00 0.00 37.83 33.81 2zag s LYS 778 CO 0.00 0.40 1.04 0.42 -0.76 0.00 0.00 175.35 176.45 2zag s ILE 779 N -2.13 4.20 0.00 2.17 1.01 -1.26 -1.24 121.20 123.95 2zag s ILE 779 Ca 0.32 -0.24 0.00 0.00 0.00 0.00 0.00 60.65 60.73 2zag s ILE 779 Cb -0.08 -4.74 0.00 0.00 0.01 0.00 0.00 42.46 37.65 2zag s ILE 779 CO 0.22 -1.55 0.86 -0.38 0.00 0.00 0.00 174.94 174.10 2zag n ILE 780 N 6.02 0.00 -4.33 2.92 2.08 0.13 -4.86 119.36 121.32 2zag n ILE 780 Ca -0.01 1.36 -0.25 0.00 0.56 0.00 0.00 62.75 64.41 2zag n ILE 780 Cb 0.46 -2.30 -0.12 0.00 -0.75 0.00 0.00 39.64 36.93 2zag n ILE 780 CO 0.00 0.00 0.00 -0.70 0.56 0.00 0.00 176.55 176.41 2zag s GLU 781 N -2.44 1.23 -0.74 0.38 2.12 -1.24 -4.97 118.70 113.04 2zag s GLU 781 Ca 0.00 -1.27 0.00 0.00 0.36 0.00 0.00 54.97 54.07 2zag s GLU 781 Cb 0.00 -1.52 0.18 0.00 0.26 0.00 0.00 34.13 33.06 2zag s GLU 781 CO 0.00 0.35 0.57 0.15 -0.54 0.00 0.00 175.26 175.78 2zag s LYS 782 N -2.15 2.75 -0.21 4.30 1.02 -1.26 -1.70 119.74 122.49 2zag s LYS 782 Ca 0.11 -3.06 -0.20 0.00 0.02 0.00 0.00 55.97 52.84 2zag s LYS 782 Cb -0.09 -3.69 -0.03 0.00 -0.52 0.00 0.00 37.83 33.50 2zag s LYS 782 CO 0.05 -1.23 0.58 -1.50 -0.92 0.00 0.00 175.35 172.33 2zag s ILE 783 N -0.97 5.05 0.13 2.17 2.07 -0.66 -4.91 121.20 124.08 2zag s ILE 783 Ca 0.23 1.06 -0.30 0.00 -1.41 0.00 0.00 60.65 60.23 2zag s ILE 783 Cb -0.12 -3.89 -0.06 0.00 0.13 0.00 0.00 42.46 38.52 2zag s ILE 783 CO -0.10 0.13 0.98 -0.75 -1.91 0.00 0.00 174.94 173.28 2zag s LYS 784 N 1.89 4.70 0.00 3.50 2.20 -1.26 0.21 119.74 130.99 2zag s LYS 784 Ca 0.26 1.49 0.00 0.00 -0.36 0.00 0.00 55.97 57.36 2zag s LYS 784 Cb -0.16 -3.36 0.00 0.00 -1.51 0.00 0.00 37.83 32.81 2zag s LYS 784 CO 0.10 0.23 0.03 0.44 -0.36 0.00 0.00 175.35 175.78 2zag n ILE 785 N 2.61 0.00 -3.60 5.43 -5.35 -0.80 -4.93 119.36 112.72 2zag n ILE 785 Ca 0.02 -0.24 -0.03 0.00 -0.27 0.00 0.00 62.75 62.22 2zag n ILE 785 Cb 0.49 1.05 -0.02 0.00 -1.74 0.00 0.00 39.64 39.42 2zag n ILE 785 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2zag s ALA 786 N -0.44 -2.04 -0.36 -1.28 0.00 -1.13 -4.86 121.76 111.65 2zag s ALA 786 Ca 0.00 1.17 0.00 0.00 0.00 0.00 0.00 51.96 53.13 2zag s ALA 786 Cb 0.00 0.14 0.13 0.00 0.00 0.00 0.00 23.12 23.39 2zag s ALA 786 CO 0.00 -0.76 0.20 -1.21 0.00 0.00 0.00 175.76 173.99 2zag s GLU 787 N -2.59 0.72 -0.18 0.00 2.02 -1.26 -1.42 118.70 115.99 2zag s GLU 787 Ca 0.10 -1.39 -0.29 0.00 0.02 0.00 0.00 54.97 53.41 2zag s GLU 787 Cb 0.00 -1.63 -0.01 0.00 0.10 0.00 0.00 34.13 32.59 2zag s GLU 787 CO -0.05 -1.15 1.27 0.42 0.02 0.00 0.00 175.26 175.78 2zag s ILE 788 N 1.06 4.26 -0.05 -1.63 1.09 -1.14 -4.83 121.20 119.95 2zag s ILE 788 Ca 0.16 1.51 0.13 0.00 -1.10 0.00 0.00 60.65 61.35 2zag s ILE 788 Cb -0.22 -4.00 -0.18 0.00 -1.06 0.00 0.00 42.46 37.00 2zag s ILE 788 CO -0.06 -0.17 0.88 0.77 -0.10 0.00 0.00 174.94 176.26 2zag h SER 789 N 8.34 0.00 -5.46 3.58 4.64 -1.87 0.15 113.55 122.94 2zag h SER 789 Ca -0.27 0.00 0.21 0.00 -0.47 0.00 0.00 61.79 61.26 2zag h SER 789 Cb 1.10 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 63.12 2zag h SER 789 CO 0.98 0.84 0.59 -2.28 -0.87 0.00 0.00 176.83 176.09 2zag s HIS 790 N -2.74 -0.05 -0.10 4.77 5.65 -1.25 -1.60 115.29 119.96 2zag s HIS 790 Ca -0.02 -0.23 0.02 0.00 0.25 0.00 0.00 55.06 55.08 2zag s HIS 790 Cb 0.08 0.63 0.01 0.00 -1.18 0.00 0.00 32.58 32.13 2zag s HIS 790 CO 0.81 -0.72 -0.16 0.34 -0.65 0.00 0.00 174.74 174.36 2zag s ASP 792 N -3.10 2.41 0.13 9.88 2.15 -1.26 -4.95 116.67 121.93 2zag s ASP 792 Ca 0.16 -0.42 0.08 0.00 0.43 0.00 0.00 52.55 52.79 2zag s ASP 792 Cb -0.00 -1.08 0.44 0.00 -0.30 0.00 0.00 42.92 41.97 2zag s ASP 792 CO 0.02 0.03 1.21 0.00 -0.17 0.00 0.00 175.17 176.26 2zag n TYR 793 N 4.09 0.27 -0.58 -5.34 0.18 -1.26 0.42 117.16 114.94 2zag n TYR 793 Ca -0.20 0.14 0.06 0.00 1.88 0.00 0.00 57.90 59.79 2zag n TYR 793 Cb 0.51 -0.69 0.17 0.00 -0.38 0.00 0.00 39.34 38.95 2zag n TYR 793 CO 0.00 0.00 0.00 1.28 -2.08 0.00 0.00 176.86 176.06 2zag n LEU 794 N -1.77 3.05 -2.77 -3.48 4.77 -1.26 -4.64 117.00 110.89 2zag n LEU 794 Ca -0.01 -2.53 -0.10 0.00 -0.03 0.00 0.00 56.01 53.35 2zag n LEU 794 Cb 0.06 -0.34 0.07 0.00 -2.33 0.00 0.00 43.42 40.88 2zag n LEU 794 CO 0.04 0.67 0.19 0.59 -1.33 0.00 0.00 177.39 177.55 2zag n ASN 795 N -0.30 -0.72 -4.43 -1.43 3.02 0.17 -5.13 115.26 106.43 2zag n ASN 795 Ca 0.14 -2.89 -0.34 0.00 -0.03 0.00 0.00 54.58 51.46 2zag n ASN 795 Cb 0.60 0.57 0.10 0.00 -0.61 0.00 0.00 39.78 40.44 2zag n ASN 795 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2zag n GLU 796 N -0.11 -0.03 -3.87 3.52 4.71 -1.17 -4.34 120.64 119.34 2zag n GLU 796 Ca 0.06 0.04 -0.11 0.00 -0.01 0.00 0.00 57.16 57.14 2zag n GLU 796 Cb 0.78 -1.83 -0.11 0.00 -1.01 0.00 0.00 31.44 29.27 2zag n GLU 796 CO 0.00 0.00 0.00 1.52 0.09 0.00 0.00 177.13 178.74 2zag s TYR 797 N -2.18 0.01 0.26 -0.32 -0.85 -1.26 -5.04 117.35 107.97 2zag s TYR 797 Ca 0.60 -0.04 -0.29 0.00 -0.52 0.00 0.00 57.07 56.82 2zag s TYR 797 Cb -0.27 -0.04 -0.09 0.00 0.38 0.00 0.00 41.96 41.94 2zag s TYR 797 CO 0.64 -0.21 0.98 -1.25 -1.52 0.00 0.00 175.55 174.19 2zag s PRO 798 N -0.95 4.77 -0.29 -3.49 0.04 -1.26 -4.36 135.00 129.46 2zag s PRO 798 Ca -0.10 1.55 -0.08 0.00 0.04 0.00 0.00 61.00 62.40 2zag s PRO 798 Cb -0.06 -3.20 -0.01 0.00 0.04 0.00 0.00 34.50 31.27 2zag s PRO 798 CO 0.01 0.41 0.11 0.42 0.04 0.00 0.00 177.00 177.99 2zag s ILE 799 N -1.23 4.39 -0.06 0.56 1.01 -0.76 -4.93 121.20 120.17 2zag s ILE 799 Ca 0.43 -0.40 -0.19 0.00 0.00 0.00 0.00 60.65 60.50 2zag s ILE 799 Cb -0.27 -3.19 -0.05 0.00 0.01 0.00 0.00 42.46 38.97 2zag s ILE 799 CO 0.33 0.15 0.51 0.00 0.00 0.00 0.00 174.94 175.93 2zag s ALA 800 N 1.59 3.51 -0.22 9.38 0.00 -1.26 -1.31 121.76 133.44 2zag s ALA 800 Ca 0.05 -0.12 -0.21 0.00 0.00 0.00 0.00 51.96 51.68 2zag s ALA 800 Cb -0.16 -2.65 0.06 0.00 0.00 0.00 0.00 23.12 20.37 2zag s ALA 800 CO 0.05 0.12 0.59 0.54 0.00 0.00 0.00 175.76 177.06 2zag s VAL 801 N 0.13 0.00 -0.12 0.00 0.11 -0.20 -5.01 120.40 115.30 2zag s VAL 801 Ca 0.27 -0.00 -0.11 0.00 -2.93 0.00 0.00 61.98 59.22 2zag s VAL 801 Cb -0.16 -0.82 -0.05 0.00 -1.53 0.00 0.00 36.38 33.82 2zag s VAL 801 CO 0.13 -0.00 0.23 0.20 -3.33 0.00 0.00 175.10 172.33 2zag s ASN 802 N 0.30 6.46 -0.01 3.54 -0.87 -1.26 -1.28 114.94 121.82 2zag s ASN 802 Ca -0.00 0.55 -0.10 0.00 -1.57 0.00 0.00 52.86 51.74 2zag s ASN 802 Cb -0.04 -2.14 0.01 0.00 -0.02 0.00 0.00 41.25 39.06 2zag s ASN 802 CO 0.01 0.28 0.20 0.68 -2.57 0.00 0.00 177.10 175.70 2zag s VAL 803 N -0.48 0.07 -0.15 1.60 -7.23 -0.89 -4.99 120.40 108.33 2zag s VAL 803 Ca 0.16 -0.55 -0.00 0.00 -1.81 0.00 0.00 61.98 59.78 2zag s VAL 803 Cb -0.13 -0.47 -0.01 0.00 0.56 0.00 0.00 36.38 36.33 2zag s VAL 803 CO 0.05 -0.30 -0.14 -0.89 -0.31 0.00 0.00 175.10 173.51 2zag s THR 804 N -1.21 2.81 -0.09 5.32 2.01 -1.26 -0.47 115.64 122.75 2zag s THR 804 Ca -0.13 -0.72 0.01 0.00 0.31 0.00 0.00 61.69 61.16 2zag s THR 804 Cb -0.06 -2.19 -0.02 0.00 0.01 0.00 0.00 72.50 70.23 2zag s THR 804 CO 0.02 0.51 -0.13 -0.76 -0.69 0.00 0.00 174.62 173.58 2zag s LEU 805 N 0.76 2.79 1.11 4.42 1.43 -0.72 -4.90 118.68 123.57 2zag s LEU 805 Ca -0.06 -0.24 -0.17 0.00 -1.03 0.00 0.00 54.13 52.64 2zag s LEU 805 Cb -0.15 -1.60 0.24 0.00 0.03 0.00 0.00 46.19 44.71 2zag s LEU 805 CO 0.01 0.25 1.14 -2.16 0.23 0.00 0.00 176.35 175.82 2zag s PRO 806 N -0.18 -0.49 0.14 1.29 0.04 -1.26 -0.98 135.00 133.56 2zag s PRO 806 Ca 0.00 0.03 -0.31 0.00 0.04 0.00 0.00 61.00 60.76 2zag s PRO 806 Cb -0.13 -1.67 -0.10 0.00 0.04 0.00 0.00 34.50 32.64 2zag s PRO 806 CO 0.03 -3.24 1.60 -0.80 0.04 0.00 0.00 177.00 174.63 2zag s ASN 807 N -3.95 6.58 0.27 6.66 0.02 -1.26 -4.68 114.94 118.58 2zag s ASN 807 Ca 0.70 2.60 -0.14 0.00 -1.02 0.00 0.00 52.86 55.00 2zag s ASN 807 Cb -0.11 -2.59 0.01 0.00 0.02 0.00 0.00 41.25 38.58 2zag s ASN 807 CO 0.56 -0.85 0.55 0.00 0.02 0.00 0.00 177.10 177.38 2zag s ALA 808 N 1.52 -0.37 -0.14 0.60 0.00 -1.26 -4.90 121.76 117.21 2zag s ALA 808 Ca 0.71 -0.82 0.17 0.00 0.00 0.00 0.00 51.96 52.02 2zag s ALA 808 Cb -0.43 1.01 -0.24 0.00 0.00 0.00 0.00 23.12 23.46 2zag s ALA 808 CO 0.32 -0.89 0.33 0.25 0.00 0.00 0.00 175.76 175.76 2zag n THR 809 N -0.42 1.35 -3.72 0.00 -2.24 -0.51 -4.71 114.28 104.03 2zag n THR 809 Ca -0.02 -0.81 -0.07 0.00 -2.27 0.00 0.00 64.05 60.88 2zag n THR 809 Cb 0.61 -0.62 -0.02 0.00 -2.10 0.00 0.00 70.33 68.20 2zag n THR 809 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2zag s SER 810 N -5.63 -0.32 -0.01 3.42 1.04 -0.64 -2.13 113.70 109.44 2zag s SER 810 Ca -0.08 -0.39 0.02 0.00 0.48 0.00 0.00 55.95 55.98 2zag s SER 810 Cb 0.07 0.63 -0.00 0.00 0.10 0.00 0.00 66.02 66.82 2zag s SER 810 CO 0.83 -1.12 -0.08 -0.31 0.98 0.00 0.00 173.24 173.55 2zag s TYR 811 N -3.69 0.70 -0.07 5.02 1.51 -0.28 -0.51 117.35 120.04 2zag s TYR 811 Ca 0.09 -0.14 0.02 0.00 -1.01 0.00 0.00 57.07 56.03 2zag s TYR 811 Cb -0.04 -0.47 -0.03 0.00 -0.11 0.00 0.00 41.96 41.32 2zag s TYR 811 CO 0.01 -0.03 -0.13 1.03 -1.11 0.00 0.00 175.55 175.32 2zag s ARG 812 N -0.08 2.69 -0.41 -0.62 0.52 -0.95 -0.34 118.95 119.75 2zag s ARG 812 Ca 0.02 -0.66 -0.12 0.00 -0.52 0.00 0.00 55.73 54.45 2zag s ARG 812 Cb -0.04 -2.46 0.05 0.00 0.52 0.00 0.00 34.95 33.02 2zag s ARG 812 CO -0.00 0.57 0.27 -0.06 0.02 0.00 0.00 175.30 176.10 2zag s PHE 813 N -0.58 3.27 0.05 -0.53 0.40 0.59 -0.76 117.98 120.41 2zag s PHE 813 Ca 0.08 -1.09 0.02 0.00 -0.60 0.00 0.00 56.93 55.34 2zag s PHE 813 Cb -0.11 -2.75 -0.04 0.00 0.51 0.00 0.00 43.02 40.63 2zag s PHE 813 CO 0.01 -0.73 0.06 0.08 0.70 0.00 0.00 175.22 175.34 2zag s VAL 814 N 1.54 4.48 -0.01 -0.44 1.01 -0.21 -3.36 120.40 123.41 2zag s VAL 814 Ca 0.03 -0.66 0.06 0.00 0.00 0.00 0.00 61.98 61.41 2zag s VAL 814 Cb -0.21 -3.10 -0.02 0.00 0.00 0.00 0.00 36.38 33.05 2zag s VAL 814 CO 0.06 0.22 -0.20 -0.22 0.00 0.00 0.00 175.10 174.96 2zag s LEU 815 N -2.08 2.04 -0.09 3.92 0.20 -0.14 -1.23 118.68 121.30 2zag s LEU 815 Ca 0.26 -0.37 0.01 0.00 0.69 0.00 0.00 54.13 54.72 2zag s LEU 815 Cb -0.12 -1.04 0.02 0.00 -0.43 0.00 0.00 46.19 44.62 2zag s LEU 815 CO 0.18 0.25 -0.11 -0.69 -0.29 0.00 0.00 176.35 175.69 2zag s VAL 816 N -0.48 1.17 0.35 1.68 1.01 0.02 -0.27 120.40 123.88 2zag s VAL 816 Ca 0.08 -0.44 -0.15 0.00 0.00 0.00 0.00 61.98 61.47 2zag s VAL 816 Cb -0.08 -1.11 0.06 0.00 0.00 0.00 0.00 36.38 35.25 2zag s VAL 816 CO -0.01 0.38 0.77 0.00 0.00 0.00 0.00 175.10 176.25 2zag n GLN 817 N 4.36 1.02 -2.58 2.72 10.64 -1.03 -2.42 117.38 130.09 2zag n GLN 817 Ca -0.18 -2.02 -0.36 0.00 -1.83 0.00 0.00 57.00 52.61 2zag n GLN 817 Cb 0.51 2.54 -0.04 0.00 -0.86 0.00 0.00 30.24 32.39 2zag n GLN 817 CO 0.00 0.00 0.00 0.15 -1.83 0.00 0.00 177.06 175.38 2zag s LYS 818 N -2.08 4.17 -0.12 2.61 1.02 -1.26 -0.13 119.74 123.96 2zag s LYS 818 Ca 0.16 1.46 -0.33 0.00 0.02 0.00 0.00 55.97 57.28 2zag s LYS 818 Cb -0.04 -2.50 0.13 0.00 -0.52 0.00 0.00 37.83 34.89 2zag s LYS 818 CO 0.11 -0.12 1.24 0.20 -0.92 0.00 0.00 175.35 175.86 2zag s GLY 819 N -1.64 -0.34 0.63 -3.33 0.00 -0.73 -4.88 107.32 97.03 2zag s GLY 819 Ca 0.58 1.21 -0.18 0.00 0.00 0.00 0.00 44.72 46.34 2zag s GLY 819 CO 0.26 0.36 1.20 2.56 0.00 0.00 0.00 173.10 177.47 2zag s PRO 820 N -2.42 2.77 0.26 2.90 0.04 -1.26 -2.65 135.00 134.63 2zag s PRO 820 Ca 0.11 1.78 -0.11 0.00 0.04 0.00 0.00 61.00 62.82 2zag s PRO 820 Cb 0.02 -1.91 -0.00 0.00 0.04 0.00 0.00 34.50 32.64 2zag s PRO 820 CO -0.04 -1.35 0.47 0.96 0.04 0.00 0.00 177.00 177.07 2zag s ILE 821 N -1.74 0.00 0.03 0.56 -5.25 0.10 -4.89 121.20 110.00 2zag s ILE 821 Ca 0.76 -1.44 0.00 0.00 -0.99 0.00 0.00 60.65 58.98 2zag s ILE 821 Cb -0.29 -2.28 0.00 0.00 2.95 0.00 0.00 42.46 42.84 2zag s ILE 821 CO 0.37 0.00 0.00 0.61 -1.79 0.00 0.00 174.94 174.13 2zag n GLY 822 N -0.40 -2.66 2.83 6.27 0.00 -1.26 -4.22 105.19 105.75 2zag n GLY 822 Ca -0.01 -1.42 -0.24 0.00 0.00 0.00 0.00 46.02 44.34 2zag n GLY 822 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2zag s VAL 823 N -3.12 0.63 -0.11 1.61 1.01 -0.63 -4.93 120.40 114.85 2zag s VAL 823 Ca 0.00 -0.04 -0.29 0.00 0.00 0.00 0.00 61.98 61.65 2zag s VAL 823 Cb 0.00 -0.73 -0.07 0.00 0.00 0.00 0.00 36.38 35.59 2zag s VAL 823 CO 0.00 0.30 2.09 -0.76 0.00 0.00 0.00 175.10 176.73 2zag s LEU 824 N 1.82 3.87 0.25 3.92 1.43 -1.26 -1.84 118.68 126.88 2zag s LEU 824 Ca 0.04 2.20 0.25 0.00 -1.03 0.00 0.00 54.13 55.60 2zag s LEU 824 Cb -0.12 -3.52 0.69 0.00 0.03 0.00 0.00 46.19 43.27 2zag s LEU 824 CO -0.06 -1.56 1.72 -0.07 0.23 0.00 0.00 176.35 176.61 2zag h LEU 825 N 13.11 0.00 -8.18 1.79 3.38 -1.68 -3.39 115.31 120.34 2zag h LEU 825 Ca -0.44 -0.01 -0.05 0.00 0.09 0.00 0.00 57.88 57.47 2zag h LEU 825 Cb 1.24 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.92 2zag h LEU 825 CO 0.95 0.00 0.03 -1.81 0.09 0.00 0.00 178.44 177.71 2zag s ASP 826 N -4.87 0.02 -0.03 -0.43 -0.00 -1.26 -4.70 116.67 105.40 2zag s ASP 826 Ca 0.10 -0.96 -0.29 0.00 -0.00 0.00 0.00 52.55 51.39 2zag s ASP 826 Cb 0.11 0.68 -0.08 0.00 -0.00 0.00 0.00 42.92 43.63 2zag s ASP 826 CO 0.62 -1.31 2.03 0.00 -0.00 0.00 0.00 175.17 176.51 2zag s ALA 827 N -3.58 3.36 0.71 5.23 0.00 -1.26 -4.75 121.76 121.48 2zag s ALA 827 Ca 0.19 1.18 -0.16 0.00 0.00 0.00 0.00 51.96 53.17 2zag s ALA 827 Cb -0.03 -3.90 0.03 0.00 0.00 0.00 0.00 23.12 19.21 2zag s ALA 827 CO 0.10 -1.89 1.25 -1.25 0.00 0.00 0.00 175.76 173.98 2zag s PRO 828 N 4.95 2.20 -0.07 0.00 0.04 -1.26 -4.80 135.00 136.05 2zag s PRO 828 Ca 0.91 1.93 0.05 0.00 0.04 0.00 0.00 61.00 63.93 2zag s PRO 828 Cb -0.40 -1.82 -0.01 0.00 0.04 0.00 0.00 34.50 32.31 2zag s PRO 828 CO 0.40 -1.83 -0.25 0.15 0.04 0.00 0.00 177.00 175.51 2zag s LYS 829 N -3.69 2.73 -0.21 4.56 1.02 0.22 -1.67 119.74 122.70 2zag s LYS 829 Ca 0.78 -0.89 0.02 0.00 0.02 0.00 0.00 55.97 55.90 2zag s LYS 829 Cb -0.34 -2.21 0.04 0.00 -0.52 0.00 0.00 37.83 34.80 2zag s LYS 829 CO 0.44 0.30 -0.16 0.08 -0.92 0.00 0.00 175.35 175.09 2zag s VAL 830 N 0.03 2.06 -1.36 3.17 1.01 0.32 0.12 120.40 125.75 2zag s VAL 830 Ca -0.10 -1.20 -0.07 0.00 0.00 0.00 0.00 61.98 60.62 2zag s VAL 830 Cb -0.15 -2.00 0.02 0.00 0.00 0.00 0.00 36.38 34.25 2zag s VAL 830 CO 0.06 0.30 1.02 0.59 0.00 0.00 0.00 175.10 177.06 2zag n ASN 831 N 4.56 -4.16 -2.55 3.32 3.02 0.68 -2.75 115.26 117.38 2zag n ASN 831 Ca -0.18 -0.66 -0.11 0.00 -0.03 0.00 0.00 54.58 53.60 2zag n ASN 831 Cb 0.47 -4.62 0.06 0.00 -0.61 0.00 0.00 39.78 35.07 2zag n ASN 831 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2zag n GLY 832 N -1.67 -0.09 3.64 7.41 0.00 -1.26 -5.03 105.19 108.20 2zag n GLY 832 Ca -0.10 -0.09 -0.08 0.00 0.00 0.00 0.00 46.02 45.74 2zag n GLY 832 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2zag s GLU 833 N -4.82 0.55 0.35 1.61 2.12 -1.11 -5.13 118.70 112.26 2zag s GLU 833 Ca 0.01 0.74 -0.28 0.00 0.36 0.00 0.00 54.97 55.81 2zag s GLU 833 Cb -0.00 0.22 -0.10 0.00 0.26 0.00 0.00 34.13 34.51 2zag s GLU 833 CO 0.47 -0.08 1.28 0.96 -0.54 0.00 0.00 175.26 177.34 2zag s ILE 834 N 0.68 2.79 0.06 -3.70 -0.00 -1.26 0.12 121.20 119.88 2zag s ILE 834 Ca -0.02 0.76 -0.06 0.00 -0.00 0.00 0.00 60.65 61.34 2zag s ILE 834 Cb -0.05 -3.48 -0.01 0.00 -0.00 0.00 0.00 42.46 38.92 2zag s ILE 834 CO -0.09 0.16 0.10 -0.13 -0.00 0.00 0.00 174.94 174.98 2zag s ARG 835 N -1.90 0.70 0.06 0.37 1.81 -0.67 -4.86 118.95 114.46 2zag s ARG 835 Ca 0.51 -0.96 -0.33 0.00 -1.72 0.00 0.00 55.73 53.23 2zag s ARG 835 Cb -0.38 0.27 -0.12 0.00 -0.45 0.00 0.00 34.95 34.27 2zag s ARG 835 CO 0.50 -0.19 1.80 0.45 -0.68 0.00 0.00 175.30 177.19 2zag n SER 836 N 0.26 3.65 -0.71 0.23 2.88 -1.26 -4.06 113.62 114.61 2zag n SER 836 Ca -0.16 1.00 0.00 0.00 -1.33 0.00 0.00 58.87 58.38 2zag n SER 836 Cb 0.61 -1.46 0.00 0.00 -0.75 0.00 0.00 64.21 62.60 2zag n SER 836 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 2zag n PRO 837 N 5.57 0.63 -0.06 -1.46 -0.04 -1.26 -0.88 135.00 137.51 2zag n PRO 837 Ca 0.19 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.65 2zag n PRO 837 Cb 0.33 -1.26 0.00 0.00 -0.04 0.00 0.00 33.50 32.53 2zag n PRO 837 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2zag n THR 838 N 0.39 0.00 -2.69 0.52 -2.24 -1.26 -4.72 114.28 104.27 2zag n THR 838 Ca 0.00 0.00 -0.07 0.00 -2.27 0.00 0.00 64.05 61.71 2zag n THR 838 Cb 0.22 0.42 0.10 0.00 -2.10 0.00 0.00 70.33 68.97 2zag n THR 838 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2zag n ASN 839 N 0.00 -1.80 0.24 3.42 4.13 -0.06 -2.09 115.26 119.10 2zag n ASN 839 Ca 0.00 -2.41 0.11 0.00 1.68 0.00 0.00 54.58 53.96 2zag n ASN 839 Cb 0.51 1.09 0.59 0.00 -1.54 0.00 0.00 39.78 40.43 2zag n ASN 839 CO 0.00 0.00 0.00 -0.29 0.28 0.00 0.00 177.26 177.25 2zag h ILE 840 N 1.77 0.59 -3.08 2.41 2.10 -0.78 -3.37 117.51 117.15 2zag h ILE 840 Ca -0.32 -0.84 -0.19 0.00 1.08 0.00 0.00 64.86 64.59 2zag h ILE 840 Cb 1.27 1.55 -0.29 0.00 -1.09 0.00 0.00 36.82 38.27 2zag h ILE 840 CO -0.08 0.18 -0.48 -0.76 -1.08 0.00 0.00 178.15 175.93 2zag s LEU 841 N -7.07 0.64 0.00 2.19 1.43 -1.26 -4.95 118.68 109.66 2zag s LEU 841 Ca -0.01 0.49 -0.02 0.00 -1.03 0.00 0.00 54.13 53.56 2zag s LEU 841 Cb 0.12 0.73 0.03 0.00 0.03 0.00 0.00 46.19 47.10 2zag s LEU 841 CO 0.61 -0.14 0.13 0.54 0.23 0.00 0.00 176.35 177.72 2zag n ARG 842 N 3.84 -1.09 0.00 1.70 1.74 -1.26 -4.95 116.66 116.65 2zag n ARG 842 Ca -0.22 -0.20 0.00 0.00 -0.77 0.00 0.00 57.85 56.67 2zag n ARG 842 Cb 0.55 -0.18 0.00 0.00 -1.02 0.00 0.00 32.46 31.81 2zag n ARG 842 CO 0.00 0.00 0.00 -1.91 -1.52 0.00 0.00 177.63 174.20 2zag n GLU 843 N -1.79 0.00 0.00 5.56 4.07 -1.26 -3.84 120.64 123.37 2zag n GLU 843 Ca 0.02 0.00 0.13 0.00 -0.06 0.00 0.00 57.16 57.25 2zag n GLU 843 Cb 0.07 -0.35 0.41 0.00 -0.06 0.00 0.00 31.44 31.50 2zag n GLU 843 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2zag n GLY 844 N 0.00 -0.22 3.40 8.31 0.00 -1.25 -4.28 105.19 111.15 2zag n GLY 844 Ca 0.00 -0.45 -0.38 0.00 0.00 0.00 0.00 46.02 45.19 2zag n GLY 844 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2zag n GLU 845 N -0.14 0.34 -4.22 1.61 2.13 -1.25 -4.38 120.64 114.73 2zag n GLU 845 Ca 0.15 0.14 -0.13 0.00 0.66 0.00 0.00 57.16 57.98 2zag n GLU 845 Cb 0.37 -1.51 -0.10 0.00 0.27 0.00 0.00 31.44 30.47 2zag n GLU 845 CO 0.00 0.00 0.00 -1.12 -0.41 0.00 0.00 177.13 175.60 2zag s SER 846 N -1.15 0.97 0.00 4.31 0.01 -1.26 -1.93 113.70 114.66 2zag s SER 846 Ca 0.65 -1.19 0.00 0.00 1.31 0.00 0.00 55.95 56.72 2zag s SER 846 Cb -0.45 0.17 0.00 0.00 0.21 0.00 0.00 66.02 65.95 2zag s SER 846 CO 0.58 -0.62 0.00 0.61 0.41 0.00 0.00 173.24 174.22 2zag n GLY 847 N -0.21 1.50 3.70 3.44 0.00 0.45 -4.98 105.19 109.09 2zag n GLY 847 Ca -0.06 -1.10 -0.39 0.00 0.00 0.00 0.00 46.02 44.47 2zag n GLY 847 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2zag s GLU 848 N -2.00 4.31 -0.33 1.61 -1.05 -1.26 -1.43 118.70 118.55 2zag s GLU 848 Ca 0.00 0.52 -0.09 0.00 -0.15 0.00 0.00 54.97 55.25 2zag s GLU 848 Cb 0.00 -3.48 0.01 0.00 -0.44 0.00 0.00 34.13 30.22 2zag s GLU 848 CO 0.00 0.04 0.14 0.42 0.95 0.00 0.00 175.26 176.81 2zag s ILE 849 N 0.99 4.37 -0.20 1.83 1.01 -0.13 -0.23 121.20 128.83 2zag s ILE 849 Ca 0.27 -0.66 -0.11 0.00 0.00 0.00 0.00 60.65 60.16 2zag s ILE 849 Cb -0.16 -3.31 -0.05 0.00 0.01 0.00 0.00 42.46 38.96 2zag s ILE 849 CO 0.11 -0.03 0.17 -0.70 0.00 0.00 0.00 174.94 174.49 2zag s GLU 850 N 1.55 4.18 -0.23 2.79 2.12 0.33 -2.71 118.70 126.72 2zag s GLU 850 Ca 0.03 -0.17 -0.08 0.00 0.36 0.00 0.00 54.97 55.11 2zag s GLU 850 Cb -0.18 -3.45 0.11 0.00 0.26 0.00 0.00 34.13 30.87 2zag s GLU 850 CO 0.05 0.23 0.50 -0.48 -0.54 0.00 0.00 175.26 175.02 2zag s LEU 851 N 0.54 -0.82 0.16 2.70 0.05 -0.86 0.73 118.68 121.18 2zag s LEU 851 Ca 0.09 1.19 -0.26 0.00 0.05 0.00 0.00 54.13 55.20 2zag s LEU 851 Cb -0.12 1.69 -0.08 0.00 -2.05 0.00 0.00 46.19 45.63 2zag s LEU 851 CO 0.00 -0.23 0.81 -1.59 -0.55 0.00 0.00 176.35 174.79 2zag s LYS 852 N 2.71 4.61 0.02 1.48 0.00 -1.26 -2.15 119.74 125.16 2zag s LYS 852 Ca -0.03 1.21 0.04 0.00 0.00 0.00 0.00 55.97 57.20 2zag s LYS 852 Cb -0.12 -3.28 -0.02 0.00 0.00 0.00 0.00 37.83 34.41 2zag s LYS 852 CO -0.15 0.52 -0.12 0.08 0.00 0.00 0.00 175.35 175.68 2zag s VAL 853 N -0.98 0.94 0.05 1.79 1.01 0.34 -1.87 120.40 121.68 2zag s VAL 853 Ca 0.37 -0.78 0.08 0.00 0.00 0.00 0.00 61.98 61.65 2zag s VAL 853 Cb -0.23 -0.84 -0.03 0.00 0.00 0.00 0.00 36.38 35.27 2zag s VAL 853 CO 0.27 0.06 -0.21 -0.83 0.00 0.00 0.00 175.10 174.39 2zag s GLY 854 N -0.82 1.52 0.13 4.51 0.00 -0.76 -0.49 107.32 111.40 2zag s GLY 854 Ca 0.02 -1.24 -0.09 0.00 0.00 0.00 0.00 44.72 43.41 2zag s GLY 854 CO 0.01 -1.14 0.23 -1.34 0.00 0.00 0.00 173.10 170.86 2zag s VAL 855 N -0.90 0.11 -0.35 1.40 -7.23 -1.01 -1.61 120.40 110.80 2zag s VAL 855 Ca 0.14 -1.29 0.07 0.00 -1.81 0.00 0.00 61.98 59.08 2zag s VAL 855 Cb -0.10 -1.59 0.55 0.00 0.56 0.00 0.00 36.38 35.79 2zag s VAL 855 CO 0.04 -0.48 1.60 0.47 -0.31 0.00 0.00 175.10 176.43 2zag n ASP 856 N -0.13 3.11 -3.63 4.85 8.00 -1.26 -1.08 116.55 126.40 2zag n ASP 856 Ca -0.11 -3.75 -0.00 0.00 0.71 0.00 0.00 54.79 51.64 2zag n ASP 856 Cb 0.63 -0.69 0.00 0.00 -0.02 0.00 0.00 41.12 41.04 2zag n ASP 856 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 2zag s LYS 857 N -3.31 0.75 -0.19 -1.24 2.20 -1.26 -4.94 119.74 111.75 2zag s LYS 857 Ca 0.49 -0.45 -0.14 0.00 -0.36 0.00 0.00 55.97 55.51 2zag s LYS 857 Cb 0.43 0.23 -0.04 0.00 -1.51 0.00 0.00 37.83 36.94 2zag s LYS 857 CO 0.03 -0.35 0.30 -0.51 -0.36 0.00 0.00 175.35 174.46 2zag s ASP 858 N -3.29 6.38 -0.03 1.43 -0.00 -1.26 -2.64 116.67 117.26 2zag s ASP 858 Ca 0.20 0.44 0.04 0.00 -0.00 0.00 0.00 52.55 53.23 2zag s ASP 858 Cb 0.01 -2.18 -0.00 0.00 -0.00 0.00 0.00 42.92 40.74 2zag s ASP 858 CO 0.00 0.04 -0.14 -0.31 -0.00 0.00 0.00 175.17 174.76 2zag s TYR 859 N 0.80 1.39 -0.50 4.23 1.51 0.34 -4.99 117.35 120.13 2zag s TYR 859 Ca 0.16 -0.35 -0.14 0.00 -1.01 0.00 0.00 57.07 55.73 2zag s TYR 859 Cb -0.13 -0.93 0.11 0.00 -0.11 0.00 0.00 41.96 40.89 2zag s TYR 859 CO 0.05 -0.11 0.42 0.99 -1.11 0.00 0.00 175.55 175.80 2zag s THR 860 N -0.03 4.91 0.27 -0.71 2.01 -1.26 0.53 115.64 121.36 2zag s THR 860 Ca -0.01 -1.46 0.04 0.00 0.31 0.00 0.00 61.69 60.57 2zag s THR 860 Cb -0.09 -4.11 -0.06 0.00 0.01 0.00 0.00 72.50 68.25 2zag s THR 860 CO 0.01 -0.76 0.00 0.00 -0.69 0.00 0.00 174.62 173.18 2zag s ALA 861 N 1.54 2.06 0.20 7.40 0.00 0.78 -4.60 121.76 129.15 2zag s ALA 861 Ca 0.04 -1.87 0.06 0.00 0.00 0.00 0.00 51.96 50.18 2zag s ALA 861 Cb -0.27 0.49 -0.04 0.00 0.00 0.00 0.00 23.12 23.30 2zag s ALA 861 CO 0.03 -0.23 0.17 -0.51 0.00 0.00 0.00 175.76 175.22 2zag s ASP 862 N -3.38 5.57 -0.07 0.00 -0.00 0.19 -0.69 116.67 118.29 2zag s ASP 862 Ca 0.31 -0.16 0.04 0.00 -0.00 0.00 0.00 52.55 52.74 2zag s ASP 862 Cb 0.06 -1.45 -0.02 0.00 -0.00 0.00 0.00 42.92 41.51 2zag s ASP 862 CO 0.11 0.02 -0.20 -0.22 -0.00 0.00 0.00 175.17 174.89 2zag s LEU 863 N -3.43 2.39 0.26 1.23 2.96 -1.03 -0.45 118.68 120.63 2zag s LEU 863 Ca 0.32 -0.38 0.02 0.00 -0.22 0.00 0.00 54.13 53.87 2zag s LEU 863 Cb -0.09 -1.47 -0.04 0.00 0.50 0.00 0.00 46.19 45.09 2zag s LEU 863 CO 0.24 0.27 0.14 -0.31 -1.32 0.00 0.00 176.35 175.36 2zag s TYR 864 N -0.27 1.48 -0.34 5.38 1.51 -0.62 -1.47 117.35 123.01 2zag s TYR 864 Ca 0.00 -1.32 -0.06 0.00 -1.01 0.00 0.00 57.07 54.69 2zag s TYR 864 Cb -0.13 -0.79 0.05 0.00 -0.11 0.00 0.00 41.96 40.98 2zag s TYR 864 CO 0.03 -0.50 0.11 -0.51 -1.11 0.00 0.00 175.55 173.56 2zag s LEU 865 N -3.30 4.37 -0.20 -1.29 1.43 0.13 -1.11 118.68 118.71 2zag s LEU 865 Ca 0.37 -1.25 -0.04 0.00 -1.03 0.00 0.00 54.13 52.19 2zag s LEU 865 Cb 0.06 -1.85 -0.01 0.00 0.03 0.00 0.00 46.19 44.42 2zag s LEU 865 CO 0.15 -0.35 -0.04 -0.60 0.23 0.00 0.00 176.35 175.75 2zag s ARG 866 N 1.36 3.45 -0.10 1.70 3.52 -0.42 0.32 118.95 128.79 2zag s ARG 866 Ca -0.01 -0.60 -0.16 0.00 -0.13 0.00 0.00 55.73 54.83 2zag s ARG 866 Cb -0.20 -2.98 -0.05 0.00 -1.56 0.00 0.00 34.95 30.16 2zag s ARG 866 CO 0.02 -0.08 0.39 0.00 -0.81 0.00 0.00 175.30 174.82 2zag s ALA 867 N 1.19 3.58 -0.16 6.12 0.00 0.45 -1.94 121.76 131.00 2zag s ALA 867 Ca 0.02 -0.29 0.00 0.00 0.00 0.00 0.00 51.96 51.70 2zag s ALA 867 Cb -0.14 -2.48 0.03 0.00 0.00 0.00 0.00 23.12 20.53 2zag s ALA 867 CO -0.01 0.18 -0.11 0.99 0.00 0.00 0.00 175.76 176.81 2zag s THR 868 N 0.04 1.51 -0.24 0.00 2.01 -0.53 -0.00 115.64 118.43 2zag s THR 868 Ca 0.22 -0.74 -0.10 0.00 0.31 0.00 0.00 61.69 61.39 2zag s THR 868 Cb -0.15 -1.51 -0.05 0.00 0.01 0.00 0.00 72.50 70.81 2zag s THR 868 CO 0.09 0.32 0.15 -0.36 -0.69 0.00 0.00 174.62 174.13 2zag s PHE 869 N 1.49 3.28 -0.28 4.92 0.08 0.25 -1.04 117.98 126.68 2zag s PHE 869 Ca 0.02 0.15 0.03 0.00 0.12 0.00 0.00 56.93 57.25 2zag s PHE 869 Cb -0.14 -2.26 0.07 0.00 -0.57 0.00 0.00 43.02 40.12 2zag s PHE 869 CO -0.09 0.02 -0.05 0.42 -0.10 0.00 0.00 175.22 175.41 2zag s ILE 870 N 1.11 2.07 0.26 0.64 1.01 0.80 -0.68 121.20 126.41 2zag s ILE 870 Ca 0.07 -1.77 0.02 0.00 0.00 0.00 0.00 60.65 58.96 2zag s ILE 870 Cb -0.14 -2.31 -0.05 0.00 0.01 0.00 0.00 42.46 39.97 2zag s ILE 870 CO 0.05 -0.22 0.08 -0.72 0.00 0.00 0.00 174.94 174.12 2zag s TYR 871 N 1.10 1.57 0.05 3.97 -0.85 -0.56 -0.79 117.35 121.85 2zag s TYR 871 Ca -0.02 -1.12 0.07 0.00 -0.52 0.00 0.00 57.07 55.48 2zag s TYR 871 Cb -0.19 -0.94 -0.03 0.00 0.38 0.00 0.00 41.96 41.18 2zag s TYR 871 CO -0.07 -0.26 -0.18 -0.51 -1.52 0.00 0.00 175.55 173.02 2zag s LEU 872 N -3.33 2.65 -0.20 -3.49 1.43 0.97 0.13 118.68 116.84 2zag s LEU 872 Ca 0.36 -0.44 0.01 0.00 -1.03 0.00 0.00 54.13 53.02 2zag s LEU 872 Cb 0.08 -1.54 0.05 0.00 0.03 0.00 0.00 46.19 44.81 2zag s LEU 872 CO 0.13 0.24 -0.08 -0.69 0.23 0.00 0.00 176.35 176.18 2zag s VAL 873 N -0.97 1.51 0.12 -1.59 1.01 0.18 -1.91 120.40 118.74 2zag s VAL 873 Ca 0.15 -1.01 -0.32 0.00 0.00 0.00 0.00 61.98 60.80 2zag s VAL 873 Cb -0.11 -1.67 -0.11 0.00 0.00 0.00 0.00 36.38 34.49 2zag s VAL 873 CO 0.06 0.07 1.80 -1.14 0.00 0.00 0.00 175.10 175.90 2zag n ARG 874 N 4.71 2.65 -0.22 2.72 0.63 0.19 -2.16 116.66 125.18 2zag n ARG 874 Ca -0.13 0.96 0.07 0.00 -0.92 0.00 0.00 57.85 57.84 2zag n ARG 874 Cb 0.46 -2.83 0.20 0.00 0.45 0.00 0.00 32.46 30.73 2zag n ARG 874 CO 0.00 0.00 0.00 0.36 -2.51 0.00 0.00 177.63 175.48 2zag n LYS 875 N 5.28 2.75 -3.70 -0.14 2.85 -0.81 -4.93 118.16 119.46 2zag n LYS 875 Ca 0.18 -2.20 0.00 0.00 -1.05 0.00 0.00 58.31 55.24 2zag n LYS 875 Cb 0.35 -1.36 -0.00 0.00 -0.65 0.00 0.00 35.03 33.37 2zag n LYS 875 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 177.40 175.81 2zag s SER 876 N -1.01 -0.08 0.00 -5.58 1.04 -1.26 -4.92 113.70 101.89 2zag s SER 876 Ca 0.30 -0.25 0.00 0.00 0.48 0.00 0.00 55.95 56.49 2zag s SER 876 Cb 0.16 0.27 0.00 0.00 0.10 0.00 0.00 66.02 66.55 2zag s SER 876 CO 0.21 -0.50 0.00 0.61 0.98 0.00 0.00 173.24 174.54 2zag n GLY 877 N -0.53 -0.55 0.08 7.32 0.00 -1.26 -4.17 105.19 106.08 2zag n GLY 877 Ca -0.07 -1.64 -0.06 0.00 0.00 0.00 0.00 46.02 44.26 2zag n GLY 877 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2zag h LYS 878 N 0.00 0.00 -3.61 1.61 2.10 -1.95 -3.48 116.57 111.24 2zag h LYS 878 Ca 0.00 0.00 -0.10 0.00 -2.00 0.00 0.00 60.65 58.55 2zag h LYS 878 Cb 0.00 0.00 -0.07 0.00 -0.90 0.00 0.00 32.23 31.26 2zag h LYS 878 CO 0.00 0.67 -0.04 0.16 -2.00 0.00 0.00 179.45 178.24 2zag s ASP 879 N -6.35 0.17 0.58 7.07 -4.77 -1.26 -5.04 116.67 107.07 2zag s ASP 879 Ca -0.01 -1.08 0.39 0.00 -3.30 0.00 0.00 52.55 48.55 2zag s ASP 879 Cb 0.09 0.66 2.10 0.00 -1.09 0.00 0.00 42.92 44.68 2zag s ASP 879 CO 0.81 -1.29 2.19 0.78 0.70 0.00 0.00 175.17 178.36 2zag h ASN 880 N 2.15 0.00 0.79 2.11 2.35 -1.93 -2.64 115.58 118.41 2zag h ASN 880 Ca -0.27 0.00 -0.14 0.00 -0.55 0.00 0.00 56.30 55.34 2zag h ASN 880 Cb 1.25 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.59 2zag h ASN 880 CO 0.36 0.00 -1.30 -0.33 -1.65 0.00 0.00 177.43 174.51 2zag h GLU 881 N 0.00 0.00 -6.39 0.81 3.07 -1.99 -3.47 114.58 106.61 2zag h GLU 881 Ca 0.00 0.00 -0.62 0.00 -0.50 0.00 0.00 59.36 58.24 2zag h GLU 881 Cb 0.03 0.00 0.05 0.00 -0.84 0.00 0.00 28.75 27.98 2zag h GLU 881 CO 0.00 0.24 0.81 -3.47 -1.40 0.00 0.00 179.01 175.19 2zag n ASP 882 N -2.87 2.86 0.13 1.42 4.64 -1.00 -4.81 116.55 116.93 2zag n ASP 882 Ca -0.08 1.06 0.11 0.00 -1.38 0.00 0.00 54.79 54.51 2zag n ASP 882 Cb 0.79 -1.35 0.49 0.00 -1.04 0.00 0.00 41.12 40.00 2zag n ASP 882 CO 0.00 0.00 0.00 -1.22 -0.82 0.00 0.00 177.20 175.16 2zag n TYR 883 N 4.09 0.69 0.50 -0.67 4.02 -1.26 -1.70 117.16 122.82 2zag n TYR 883 Ca 0.19 0.31 0.09 0.00 -0.01 0.00 0.00 57.90 58.48 2zag n TYR 883 Cb 0.26 -0.99 0.40 0.00 -0.02 0.00 0.00 39.34 38.99 2zag n TYR 883 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 176.86 175.60 2zag n ASP 884 N -2.16 0.28 -4.74 7.72 10.43 -1.26 -2.00 116.55 124.82 2zag n ASP 884 Ca 0.01 0.56 -0.41 0.00 2.57 0.00 0.00 54.79 57.52 2zag n ASP 884 Cb 0.14 -0.62 -0.04 0.00 1.84 0.00 0.00 41.12 42.44 2zag n ASP 884 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 2zag s ALA 885 N -3.12 3.43 0.10 2.24 0.00 -0.69 -4.18 121.76 119.54 2zag s ALA 885 Ca 0.07 0.94 0.08 0.00 0.00 0.00 0.00 51.96 53.05 2zag s ALA 885 Cb 0.10 -3.39 -0.03 0.00 0.00 0.00 0.00 23.12 19.79 2zag s ALA 885 CO 0.34 -0.33 -0.20 0.00 0.00 0.00 0.00 175.76 175.57 2zag s ALA 886 N -0.36 1.75 -0.22 0.00 0.00 -1.26 -1.11 121.76 120.55 2zag s ALA 886 Ca 0.51 -1.21 0.01 0.00 0.00 0.00 0.00 51.96 51.26 2zag s ALA 886 Cb -0.33 -0.24 0.05 0.00 0.00 0.00 0.00 23.12 22.61 2zag s ALA 886 CO 0.38 0.35 -0.08 -0.06 0.00 0.00 0.00 175.76 176.35 2zag s PHE 887 N -1.15 2.47 -0.30 0.00 0.08 -1.26 -1.92 117.98 115.89 2zag s PHE 887 Ca 0.06 -1.72 -0.29 0.00 0.12 0.00 0.00 56.93 55.10 2zag s PHE 887 Cb -0.10 -1.63 -0.00 0.00 -0.57 0.00 0.00 43.02 40.72 2zag s PHE 887 CO 0.04 -0.77 1.33 -2.00 -0.10 0.00 0.00 175.22 173.72 2zag s GLU 888 N 1.37 3.89 0.24 0.44 2.56 -0.92 -3.37 118.70 122.92 2zag s GLU 888 Ca -0.04 1.25 -0.25 0.00 0.00 0.00 0.00 54.97 55.93 2zag s GLU 888 Cb -0.18 -3.90 -0.09 0.00 2.00 0.00 0.00 34.13 31.97 2zag s GLU 888 CO -0.07 -1.16 0.85 -1.25 -0.56 0.00 0.00 175.26 173.08 2zag s PRO 889 N 4.25 4.57 0.00 4.30 0.04 -1.26 -0.65 135.00 146.24 2zag s PRO 889 Ca 0.57 1.22 0.00 0.00 0.04 0.00 0.00 61.00 62.83 2zag s PRO 889 Cb -0.17 -3.03 0.00 0.00 0.04 0.00 0.00 34.50 31.34 2zag s PRO 889 CO 0.24 0.43 0.00 1.04 0.04 0.00 0.00 177.00 178.75 2zag n GLN 890 N 1.05 2.01 0.00 4.56 6.02 0.34 -4.96 117.38 126.41 2zag n GLN 890 Ca -0.02 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.97 2zag n GLN 890 Cb 0.49 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.75 2zag n GLN 890 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 2zag n ASP 892 N -0.30 0.00 -4.26 1.08 10.43 0.14 -1.50 116.55 122.14 2zag n ASP 892 Ca 0.00 0.00 -0.33 0.00 2.57 0.00 0.00 54.79 57.03 2zag n ASP 892 Cb 0.00 0.00 -0.16 0.00 1.84 0.00 0.00 41.12 42.80 2zag n ASP 892 CO 0.00 0.00 0.00 0.54 -1.07 0.00 0.00 177.20 176.67 2zag s VAL 893 N 0.00 2.45 -0.10 2.53 0.11 -1.26 0.84 120.40 124.97 2zag s VAL 893 Ca 0.00 -0.87 -0.10 0.00 -2.93 0.00 0.00 61.98 58.08 2zag s VAL 893 Cb 0.00 -1.99 0.03 0.00 -1.53 0.00 0.00 36.38 32.89 2zag s VAL 893 CO 0.00 0.54 0.28 0.72 -3.33 0.00 0.00 175.10 173.31 2zag s PHE 894 N 0.54 -0.29 -0.30 1.54 -0.71 1.00 -4.99 117.98 114.76 2zag s PHE 894 Ca -0.12 0.69 -0.29 0.00 -1.04 0.00 0.00 56.93 56.17 2zag s PHE 894 Cb -0.16 0.10 0.01 0.00 -1.21 0.00 0.00 43.02 41.75 2zag s PHE 894 CO 0.04 -0.17 1.22 -0.06 -1.34 0.00 0.00 175.22 174.91 2zag s PHE 895 N -0.00 2.86 0.07 3.49 0.40 -1.26 -0.41 117.98 123.12 2zag s PHE 895 Ca -0.01 0.98 0.12 0.00 -0.60 0.00 0.00 56.93 57.42 2zag s PHE 895 Cb -0.02 -3.83 0.14 0.00 0.51 0.00 0.00 43.02 39.82 2zag s PHE 895 CO 0.01 -1.37 1.47 0.82 0.70 0.00 0.00 175.22 176.85 2zag h ILE 896 N 5.86 1.24 -1.28 0.64 2.04 -0.50 -3.48 117.51 122.04 2zag h ILE 896 Ca -0.24 -2.47 0.27 0.00 1.00 0.00 0.00 64.86 63.42 2zag h ILE 896 Cb 1.08 2.43 -0.21 0.00 -0.74 0.00 0.00 36.82 39.38 2zag h ILE 896 CO 1.03 0.65 0.88 0.28 0.00 0.00 0.00 178.15 180.99 2zag s THR 897 N -3.11 0.00 -0.25 -0.27 -1.32 -1.15 -4.96 115.64 104.58 2zag s THR 897 Ca 0.01 0.00 -0.10 0.00 -1.21 0.00 0.00 61.69 60.39 2zag s THR 897 Cb 0.10 -1.00 -0.05 0.00 -1.51 0.00 0.00 72.50 70.04 2zag s THR 897 CO 0.76 0.00 0.15 -0.75 -2.21 0.00 0.00 174.62 172.57 2zag s LYS 898 N -2.03 3.95 -0.04 7.08 2.20 -1.26 -0.69 119.74 128.95 2zag s LYS 898 Ca 0.10 -0.33 0.13 0.00 -0.36 0.00 0.00 55.97 55.51 2zag s LYS 898 Cb -0.01 -3.52 -0.20 0.00 -1.51 0.00 0.00 37.83 32.59 2zag s LYS 898 CO -0.04 -0.05 0.25 0.44 -0.36 0.00 0.00 175.35 175.60 2zag n ILE 899 N 4.59 0.15 -4.24 5.43 -5.35 -0.54 -4.98 119.36 114.42 2zag n ILE 899 Ca -0.15 -0.35 -0.13 0.00 -0.27 0.00 0.00 62.75 61.85 2zag n ILE 899 Cb 0.52 0.04 -0.10 0.00 -1.74 0.00 0.00 39.64 38.36 2zag n ILE 899 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 2zag s GLY 900 N -3.73 1.33 0.03 3.28 0.00 -1.07 -4.66 107.32 102.50 2zag s GLY 900 Ca -0.05 -1.65 -0.24 0.00 0.00 0.00 0.00 44.72 42.78 2zag s GLY 900 CO 0.55 -1.51 0.55 1.85 0.00 0.00 0.00 173.10 174.55 2zag s GLU 901 N -3.99 1.04 -0.65 2.90 2.12 -1.26 -2.45 118.70 116.42 2zag s GLU 901 Ca 0.29 -0.15 0.00 0.00 0.36 0.00 0.00 54.97 55.46 2zag s GLU 901 Cb 0.07 0.48 0.00 0.00 0.26 0.00 0.00 34.13 34.94 2zag s GLU 901 CO 0.07 -0.37 0.00 0.09 -0.54 0.00 0.00 175.26 174.51 2zag n ASN 902 N 0.49 -2.11 -4.68 -1.70 3.02 -1.02 -4.88 115.26 104.38 2zag n ASN 902 Ca -0.18 0.24 -0.42 0.00 -0.03 0.00 0.00 54.58 54.18 2zag n ASN 902 Cb 0.60 -2.05 -0.03 0.00 -0.61 0.00 0.00 39.78 37.69 2zag n ASN 902 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2zag s ILE 903 N -1.90 3.40 -0.86 2.41 1.01 0.14 -4.64 121.20 120.76 2zag s ILE 903 Ca 0.00 0.77 -0.09 0.00 0.00 0.00 0.00 60.65 61.33 2zag s ILE 903 Cb 0.00 -3.50 0.22 0.00 0.01 0.00 0.00 42.46 39.19 2zag s ILE 903 CO 0.00 -0.01 0.78 -1.10 0.00 0.00 0.00 174.94 174.60 2zag s GLN 904 N 2.79 3.47 0.48 2.79 -0.21 -1.25 -0.15 119.66 127.57 2zag s GLN 904 Ca 0.70 -2.77 -0.23 0.00 0.02 0.00 0.00 55.36 53.08 2zag s GLN 904 Cb -0.35 -4.24 -0.07 0.00 1.00 0.00 0.00 33.01 29.35 2zag s GLN 904 CO 0.29 -1.25 1.25 -0.51 -2.12 0.00 0.00 175.29 172.95 2zag s LEU 905 N -0.43 3.99 0.07 2.90 1.43 0.19 -4.81 118.68 122.01 2zag s LEU 905 Ca 0.22 2.50 0.08 0.00 -1.03 0.00 0.00 54.13 55.90 2zag s LEU 905 Cb -0.12 -4.21 -0.03 0.00 0.03 0.00 0.00 46.19 41.86 2zag s LEU 905 CO -0.08 -1.13 -0.19 -0.54 0.23 0.00 0.00 176.35 174.64 2zag s LYS 906 N -2.71 1.93 -0.47 1.70 3.01 -1.26 -0.50 119.74 121.44 2zag s LYS 906 Ca 0.65 -1.07 -0.42 0.00 -1.01 0.00 0.00 55.97 54.12 2zag s LYS 906 Cb -0.34 -2.14 -0.18 0.00 -1.01 0.00 0.00 37.83 34.17 2zag s LYS 906 CO 0.41 0.51 2.15 -1.91 0.51 0.00 0.00 175.35 177.02 2zag n GLU 907 N 1.30 0.21 0.00 1.68 2.13 -1.08 -4.49 120.64 120.38 2zag n GLU 907 Ca -0.16 0.06 0.00 0.00 0.66 0.00 0.00 57.16 57.71 2zag n GLU 907 Cb 0.52 -1.68 0.00 0.00 0.27 0.00 0.00 31.44 30.55 2zag n GLU 907 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2zag n GLY 908 N 7.32 0.64 3.73 8.31 0.00 -0.24 -4.92 105.19 120.03 2zag n GLY 908 Ca 0.52 -2.05 -0.30 0.00 0.00 0.00 0.00 46.02 44.20 2zag n GLY 908 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2zag s GLU 909 N -0.81 1.34 -0.28 1.61 2.02 -1.26 -2.41 118.70 118.91 2zag s GLU 909 Ca 0.00 0.78 -0.16 0.00 0.02 0.00 0.00 54.97 55.60 2zag s GLU 909 Cb 0.00 -1.82 0.11 0.00 0.10 0.00 0.00 34.13 32.52 2zag s GLU 909 CO 0.00 -2.17 0.82 -0.80 0.02 0.00 0.00 175.26 173.13 2zag s ASN 910 N -3.50 -0.75 -0.10 -0.19 0.01 0.35 -4.75 114.94 106.01 2zag s ASN 910 Ca 0.63 1.20 -0.02 0.00 -0.71 0.00 0.00 52.86 53.96 2zag s ASN 910 Cb -0.17 1.30 -0.03 0.00 0.41 0.00 0.00 41.25 42.76 2zag s ASN 910 CO 0.56 -0.19 -0.00 -0.89 -1.51 0.00 0.00 177.10 175.07 2zag s THR 911 N 1.47 4.26 -0.08 1.60 2.01 -1.26 0.13 115.64 123.76 2zag s THR 911 Ca -0.09 -0.26 -0.02 0.00 0.31 0.00 0.00 61.69 61.63 2zag s THR 911 Cb -0.04 -2.81 0.03 0.00 0.01 0.00 0.00 72.50 69.69 2zag s THR 911 CO -0.17 0.58 0.01 -0.69 -0.69 0.00 0.00 174.62 173.65 2zag s VAL 912 N -0.62 0.37 -0.09 3.82 1.01 -0.91 -4.97 120.40 119.00 2zag s VAL 912 Ca 0.10 0.07 -0.01 0.00 0.00 0.00 0.00 61.98 62.14 2zag s VAL 912 Cb -0.12 -0.56 -0.03 0.00 0.00 0.00 0.00 36.38 35.67 2zag s VAL 912 CO 0.02 0.21 -0.05 -0.54 0.00 0.00 0.00 175.10 174.74 2zag s LYS 913 N 1.97 3.03 -0.03 2.72 1.02 -1.26 -2.03 119.74 125.16 2zag s LYS 913 Ca 0.04 -0.52 -0.22 0.00 0.02 0.00 0.00 55.97 55.29 2zag s LYS 913 Cb -0.13 -2.70 0.04 0.00 -0.52 0.00 0.00 37.83 34.53 2zag s LYS 913 CO -0.05 0.55 0.47 0.08 -0.92 0.00 0.00 175.35 175.48 2zag s VAL 914 N -0.49 0.03 0.19 3.17 1.01 -1.10 -4.98 120.40 118.23 2zag s VAL 914 Ca 0.08 -0.26 -0.18 0.00 0.00 0.00 0.00 61.98 61.61 2zag s VAL 914 Cb -0.12 -0.78 -0.08 0.00 0.00 0.00 0.00 36.38 35.40 2zag s VAL 914 CO 0.02 -0.15 0.66 -0.60 0.00 0.00 0.00 175.10 175.03 2zag s ARG 915 N -1.25 4.16 -0.09 2.72 3.52 -1.26 -0.96 118.95 125.80 2zag s ARG 915 Ca -0.12 0.74 -0.19 0.00 -0.13 0.00 0.00 55.73 56.03 2zag s ARG 915 Cb -0.03 -2.92 0.04 0.00 -1.56 0.00 0.00 34.95 30.48 2zag s ARG 915 CO 0.07 0.44 0.45 0.00 -0.81 0.00 0.00 175.30 175.44 2zag s ALA 916 N -1.48 -1.14 -0.03 6.12 0.00 -0.52 -4.82 121.76 119.89 2zag s ALA 916 Ca 0.40 0.93 0.01 0.00 0.00 0.00 0.00 51.96 53.30 2zag s ALA 916 Cb -0.16 -0.28 0.02 0.00 0.00 0.00 0.00 23.12 22.70 2zag s ALA 916 CO 0.20 -0.27 -0.02 -2.00 0.00 0.00 0.00 175.76 173.68 2zag s GLU 917 N -0.67 0.50 -0.45 0.00 2.12 -1.26 -0.41 118.70 118.52 2zag s GLU 917 Ca -0.08 -0.01 -0.18 0.00 0.36 0.00 0.00 54.97 55.07 2zag s GLU 917 Cb -0.03 -0.60 0.04 0.00 0.26 0.00 0.00 34.13 33.80 2zag s GLU 917 CO 0.04 -0.10 0.49 -1.17 -0.54 0.00 0.00 175.26 173.98 2zag s LEU 918 N 0.91 5.00 -0.41 2.70 2.96 -0.81 -4.98 118.68 124.04 2zag s LEU 918 Ca -0.10 -0.83 -0.36 0.00 -0.22 0.00 0.00 54.13 52.61 2zag s LEU 918 Cb -0.13 -2.38 -0.16 0.00 0.50 0.00 0.00 46.19 44.02 2zag s LEU 918 CO -0.01 -0.68 1.67 -2.65 -1.32 0.00 0.00 176.35 173.36 2zag n PRO 919 N 5.70 0.00 -1.57 0.98 -0.02 -1.26 -3.74 135.00 135.09 2zag n PRO 919 Ca -0.08 0.00 -0.45 0.00 -2.02 0.00 0.00 63.50 60.96 2zag n PRO 919 Cb 0.46 -1.23 -0.04 0.00 -0.02 0.00 0.00 33.50 32.68 2zag n PRO 919 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 2zag n GLU 920 N 5.61 1.77 0.00 -0.52 4.07 -1.26 -2.20 120.64 128.11 2zag n GLU 920 Ca 0.41 0.49 0.00 0.00 -0.06 0.00 0.00 57.16 58.00 2zag n GLU 920 Cb -0.04 -3.06 0.00 0.00 -0.06 0.00 0.00 31.44 28.28 2zag n GLU 920 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2zag n GLY 921 N 5.93 3.84 3.30 8.31 0.00 -1.26 -4.94 105.19 120.36 2zag n GLY 921 Ca 0.32 -0.61 -0.29 0.00 0.00 0.00 0.00 46.02 45.44 2zag n GLY 921 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2zag n VAL 922 N 0.00 0.00 0.00 1.61 0.24 -0.94 -2.16 118.33 117.09 2zag n VAL 922 Ca 0.00 -0.20 0.00 0.00 -2.04 0.00 0.00 64.34 62.10 2zag n VAL 922 Cb 0.00 -0.97 0.00 0.00 -1.47 0.00 0.00 33.84 31.40 2zag n VAL 922 CO 0.00 0.00 0.00 -0.38 -2.14 0.00 0.00 176.83 174.31 2zag n ILE 923 N -5.49 0.00 0.40 1.34 2.08 -1.26 -3.93 119.36 112.49 2zag n ILE 923 Ca 0.09 0.00 0.13 0.00 0.56 0.00 0.00 62.75 63.52 2zag n ILE 923 Cb 0.57 0.00 0.51 0.00 -0.75 0.00 0.00 39.64 39.97 2zag n ILE 923 CO 0.00 0.00 0.00 -1.28 0.56 0.00 0.00 176.55 175.83 2zag h SER 924 N 0.00 0.00 0.15 4.38 0.87 -1.98 -1.14 113.55 115.84 2zag h SER 924 Ca 0.00 0.00 -0.24 0.00 -1.23 0.00 0.00 61.79 60.32 2zag h SER 924 Cb 0.00 0.00 0.02 0.00 -0.44 0.00 0.00 62.40 61.98 2zag h SER 924 CO 0.00 0.00 -1.11 -1.28 -0.53 0.00 0.00 176.83 173.91 2zag h SER 925 N 0.00 0.51 -0.23 6.23 0.87 -1.55 -2.97 113.55 116.41 2zag h SER 925 Ca 0.00 -0.92 -0.03 0.00 -1.23 0.00 0.00 61.79 59.61 2zag h SER 925 Cb 0.42 -0.17 -0.01 0.00 -0.44 0.00 0.00 62.40 62.20 2zag h SER 925 CO 0.00 1.52 0.04 0.22 -0.53 0.00 0.00 176.83 178.08 2zag h TYR 926 N -0.26 0.41 -0.61 2.24 3.20 -1.79 -1.73 116.97 118.42 2zag h TYR 926 Ca -0.21 -0.05 0.12 0.00 3.14 0.00 0.00 58.73 61.73 2zag h TYR 926 Cb 1.77 -0.11 -0.12 0.00 1.54 0.00 0.00 36.73 39.82 2zag h TYR 926 CO 0.16 0.50 -0.15 -0.22 -1.64 0.00 0.00 178.16 176.82 2zag h LYS 927 N 0.19 0.00 -0.26 1.82 3.64 -1.31 0.50 116.57 121.15 2zag h LYS 927 Ca 0.07 -0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 59.42 2zag h LYS 927 Cb 0.31 -0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.11 2zag h LYS 927 CO 0.00 0.00 0.00 -0.44 -2.27 0.00 0.00 179.45 176.75 2zag h ASP 928 N 0.00 0.36 -0.38 4.20 5.19 -1.32 -0.61 116.42 123.86 2zag h ASP 928 Ca 0.30 -0.05 -0.10 0.00 -0.62 0.00 0.00 57.03 56.56 2zag h ASP 928 Cb 0.45 -0.09 -0.02 0.00 0.18 0.00 0.00 39.33 39.85 2zag h ASP 928 CO -0.63 0.42 -0.11 -0.08 -3.12 0.00 0.00 179.24 175.72 2zag h GLU 929 N 0.38 0.83 -0.05 3.56 4.81 0.76 -1.51 114.58 123.36 2zag h GLU 929 Ca 0.09 -0.28 -0.02 0.00 -0.13 0.00 0.00 59.36 59.01 2zag h GLU 929 Cb 0.25 -0.06 -0.00 0.00 0.63 0.00 0.00 28.75 29.56 2zag h GLU 929 CO 0.01 0.90 -0.05 -0.07 -0.73 0.00 0.00 179.01 179.07 2zag h LEU 930 N 0.75 0.13 -2.57 1.64 3.38 0.04 -0.42 115.31 118.26 2zag h LEU 930 Ca 0.12 -0.49 0.00 0.00 0.09 0.00 0.00 57.88 57.60 2zag h LEU 930 Cb 0.61 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.33 2zag h LEU 930 CO 0.04 0.59 0.00 1.56 0.09 0.00 0.00 178.44 180.72 2zag h GLN 931 N -0.34 0.00 0.01 1.13 1.08 -1.03 0.27 115.11 116.23 2zag h GLN 931 Ca 0.01 0.00 -0.31 0.00 -1.45 0.00 0.00 58.65 56.90 2zag h GLN 931 Cb 0.56 0.00 -0.05 0.00 -0.05 0.00 0.00 27.48 27.93 2zag h GLN 931 CO 0.01 0.00 -1.85 -2.13 -0.95 0.00 0.00 178.83 173.91 2zag n ARG 932 N -2.85 0.65 0.12 1.46 0.63 -0.58 -2.52 116.66 113.57 2zag n ARG 932 Ca -0.03 0.25 -0.24 0.00 -0.92 0.00 0.00 57.85 56.91 2zag n ARG 932 Cb 0.06 -1.74 -0.16 0.00 0.45 0.00 0.00 32.46 31.08 2zag n ARG 932 CO 0.00 0.00 0.00 -0.22 -2.51 0.00 0.00 177.63 174.90 2zag h LYS 933 N 0.01 0.48 -0.01 -0.14 3.64 0.73 -3.39 116.57 117.88 2zag h LYS 933 Ca -0.34 -0.81 0.00 0.00 -1.27 0.00 0.00 60.65 58.22 2zag h LYS 933 Cb 2.05 0.30 0.00 0.00 -0.41 0.00 0.00 32.23 34.17 2zag h LYS 933 CO 0.07 1.39 -0.01 0.66 -2.27 0.00 0.00 179.45 179.29 2zag n TYR 934 N -3.80 0.00 -1.37 1.91 4.02 0.76 -5.09 117.16 113.60 2zag n TYR 934 Ca -0.17 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.72 2zag n TYR 934 Cb 1.04 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 40.36 2zag n TYR 934 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2zag n GLY 935 N 0.60 1.97 0.00 2.72 0.00 -1.05 -1.11 105.19 108.32 2zag n GLY 935 Ca 0.06 -0.27 0.10 0.00 0.00 0.00 0.00 46.02 45.91 2zag n GLY 935 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2zag n ASP 936 N -0.52 0.00 -0.10 1.61 5.68 -1.26 -1.93 116.55 120.03 2zag n ASP 936 Ca 0.00 -0.31 0.15 0.00 -0.50 0.00 0.00 54.79 54.13 2zag n ASP 936 Cb 0.00 -0.15 0.78 0.00 -1.14 0.00 0.00 41.12 40.61 2zag n ASP 936 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 2zag n LYS 937 N -1.15 0.93 -3.67 0.11 5.02 -0.27 -4.77 118.16 114.36 2zag n LYS 937 Ca 0.12 -0.19 -0.37 0.00 -2.02 0.00 0.00 58.31 55.84 2zag n LYS 937 Cb 0.12 -1.50 -0.06 0.00 -0.02 0.00 0.00 35.03 33.57 2zag n LYS 937 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 2zag s LEU 938 N -2.21 4.44 -0.22 -0.35 2.96 -0.81 -0.64 118.68 121.85 2zag s LEU 938 Ca 0.39 0.74 -0.03 0.00 -0.22 0.00 0.00 54.13 55.00 2zag s LEU 938 Cb 0.21 -2.36 0.11 0.00 0.50 0.00 0.00 46.19 44.65 2zag s LEU 938 CO 0.40 0.36 0.27 -0.63 -1.32 0.00 0.00 176.35 175.44 2zag s ILE 939 N -1.06 -0.42 -0.05 6.68 1.01 -0.80 -5.00 121.20 121.56 2zag s ILE 939 Ca 0.20 -0.14 -0.26 0.00 0.00 0.00 0.00 60.65 60.45 2zag s ILE 939 Cb -0.15 -0.75 -0.03 0.00 0.01 0.00 0.00 42.46 41.55 2zag s ILE 939 CO 0.09 -0.20 0.81 -0.63 0.00 0.00 0.00 174.94 175.01 2zag s ILE 940 N 2.40 4.97 -0.22 2.92 1.01 -1.26 -0.02 121.20 130.99 2zag s ILE 940 Ca 0.09 1.69 0.09 0.00 0.00 0.00 0.00 60.65 62.51 2zag s ILE 940 Cb -0.15 -4.15 -0.21 0.00 0.01 0.00 0.00 42.46 37.95 2zag s ILE 940 CO -0.15 0.20 -0.04 0.54 0.00 0.00 0.00 174.94 175.49 2zag n ARG 941 N 3.92 0.67 -3.64 2.79 5.12 0.03 -4.95 116.66 120.61 2zag n ARG 941 Ca 0.02 0.10 -0.09 0.00 -1.93 0.00 0.00 57.85 55.95 2zag n ARG 941 Cb 0.51 -1.54 -0.07 0.00 -1.16 0.00 0.00 32.46 30.20 2zag n ARG 941 CO 0.00 0.00 0.00 0.20 -1.93 0.00 0.00 177.63 175.90 2zag s GLY 942 N -6.00 -0.12 -0.04 -0.13 0.00 -0.34 -4.83 107.32 95.85 2zag s GLY 942 Ca -0.23 2.71 0.06 0.00 0.00 0.00 0.00 44.72 47.27 2zag s GLY 942 CO 0.71 1.82 -0.23 -0.42 0.00 0.00 0.00 173.10 174.98 2zag s ILE 943 N 0.19 1.90 0.07 0.90 1.01 -1.26 -0.14 121.20 123.86 2zag s ILE 943 Ca 0.03 -0.99 0.06 0.00 0.00 0.00 0.00 60.65 59.75 2zag s ILE 943 Cb -0.05 -1.60 -0.03 0.00 0.01 0.00 0.00 42.46 40.80 2zag s ILE 943 CO -0.07 0.53 -0.17 -0.13 0.00 0.00 0.00 174.94 175.11 2zag s ARG 944 N -0.27 1.00 -0.23 2.79 0.52 -0.20 -4.95 118.95 117.61 2zag s ARG 944 Ca 0.01 -0.99 -0.03 0.00 -0.52 0.00 0.00 55.73 54.21 2zag s ARG 944 Cb -0.12 -1.11 0.07 0.00 0.52 0.00 0.00 34.95 34.32 2zag s ARG 944 CO 0.02 0.26 0.06 0.08 0.02 0.00 0.00 175.30 175.74 2zag s VAL 945 N -1.11 0.51 0.15 3.52 1.01 -0.89 -1.46 120.40 122.14 2zag s VAL 945 Ca 0.02 -0.76 0.05 0.00 0.00 0.00 0.00 61.98 61.30 2zag s VAL 945 Cb -0.09 -1.15 -0.04 0.00 0.00 0.00 0.00 36.38 35.09 2zag s VAL 945 CO 0.03 -0.38 -0.12 -1.61 0.00 0.00 0.00 175.10 173.02 2zag s GLU 946 N 1.84 1.10 -0.13 2.72 2.02 -0.82 -2.13 118.70 123.30 2zag s GLU 946 Ca 0.03 -1.42 -0.26 0.00 0.02 0.00 0.00 54.97 53.33 2zag s GLU 946 Cb -0.17 -0.77 -0.02 0.00 0.10 0.00 0.00 34.13 33.27 2zag s GLU 946 CO -0.15 0.12 0.84 -1.25 0.02 0.00 0.00 175.26 174.83 2zag s PRO 947 N -3.48 4.36 -0.11 0.39 0.04 -1.26 -1.31 135.00 133.63 2zag s PRO 947 Ca 0.16 1.07 0.00 0.00 0.04 0.00 0.00 61.00 62.27 2zag s PRO 947 Cb 0.00 -3.53 0.02 0.00 0.04 0.00 0.00 34.50 31.03 2zag s PRO 947 CO 0.02 -0.22 -0.11 0.08 0.04 0.00 0.00 177.00 176.82 2zag s VAL 948 N 1.75 1.22 -0.34 -0.36 1.01 -0.27 -4.94 120.40 118.47 2zag s VAL 948 Ca 0.40 -0.43 -0.22 0.00 0.00 0.00 0.00 61.98 61.74 2zag s VAL 948 Cb -0.17 -1.18 0.00 0.00 0.00 0.00 0.00 36.38 35.03 2zag s VAL 948 CO 0.16 0.40 0.70 -0.36 0.00 0.00 0.00 175.10 175.99 2zag s PHE 949 N 1.45 3.16 -0.13 5.22 0.40 -1.26 -1.59 117.98 125.23 2zag s PHE 949 Ca 0.01 0.53 -0.05 0.00 -0.60 0.00 0.00 56.93 56.82 2zag s PHE 949 Cb -0.13 -3.19 -0.04 0.00 0.51 0.00 0.00 43.02 40.17 2zag s PHE 949 CO -0.07 -0.61 0.04 0.42 0.70 0.00 0.00 175.22 175.70 2zag s ILE 950 N 2.83 4.60 0.34 0.64 -1.09 0.41 -0.73 121.20 128.21 2zag s ILE 950 Ca 0.28 -0.12 -0.04 0.00 -2.23 0.00 0.00 60.65 58.53 2zag s ILE 950 Cb -0.14 -3.00 0.01 0.00 -1.58 0.00 0.00 42.46 37.75 2zag s ILE 950 CO 0.14 0.55 0.50 0.00 -1.23 0.00 0.00 174.94 174.90 2zag s ALA 951 N -0.38 0.60 -0.12 9.38 0.00 -1.08 -0.64 121.76 129.51 2zag s ALA 951 Ca 0.08 -1.42 -0.23 0.00 0.00 0.00 0.00 51.96 50.39 2zag s ALA 951 Cb -0.12 1.11 -0.03 0.00 0.00 0.00 0.00 23.12 24.08 2zag s ALA 951 CO 0.02 -0.81 0.70 -1.21 0.00 0.00 0.00 175.76 174.46 2zag s GLU 952 N -3.04 4.35 0.15 0.00 0.41 -1.26 -1.77 118.70 117.53 2zag s GLU 952 Ca 0.29 0.82 0.06 0.00 -0.41 0.00 0.00 54.97 55.73 2zag s GLU 952 Cb -0.01 -3.51 -0.04 0.00 -1.78 0.00 0.00 34.13 28.79 2zag s GLU 952 CO 0.19 -0.09 -0.13 -1.59 -0.49 0.00 0.00 175.26 173.15 2zag s LYS 953 N 1.37 1.10 0.15 1.61 -2.85 0.81 -4.92 119.74 117.00 2zag s LYS 953 Ca 0.35 -1.37 -0.18 0.00 -1.00 0.00 0.00 55.97 53.77 2zag s LYS 953 Cb -0.17 -0.86 -0.07 0.00 -2.06 0.00 0.00 37.83 34.66 2zag s LYS 953 CO 0.15 0.15 0.62 -1.21 0.10 0.00 0.00 175.35 175.15 2zag s GLU 954 N -3.18 4.16 -0.13 1.78 2.02 -1.26 -2.47 118.70 119.61 2zag s GLU 954 Ca 0.14 0.72 -0.01 0.00 0.02 0.00 0.00 54.97 55.84 2zag s GLU 954 Cb -0.02 -3.02 0.03 0.00 0.10 0.00 0.00 34.13 31.22 2zag s GLU 954 CO 0.03 0.50 -0.06 0.71 0.02 0.00 0.00 175.26 176.47 2zag s TYR 955 N -1.37 1.43 0.66 1.61 1.51 0.63 -4.96 117.35 116.87 2zag s TYR 955 Ca 0.37 -0.78 -0.11 0.00 -1.01 0.00 0.00 57.07 55.54 2zag s TYR 955 Cb -0.17 -1.20 -0.01 0.00 -0.11 0.00 0.00 41.96 40.47 2zag s TYR 955 CO 0.20 -0.53 1.06 -1.17 -1.11 0.00 0.00 175.55 174.01 2zag s LEU 956 N 1.72 3.08 0.03 -1.29 2.96 -1.26 -0.96 118.68 122.95 2zag s LEU 956 Ca 0.03 1.29 -0.21 0.00 -0.22 0.00 0.00 54.13 55.02 2zag s LEU 956 Cb -0.13 -4.22 -0.06 0.00 0.50 0.00 0.00 46.19 42.28 2zag s LEU 956 CO -0.08 -1.09 0.60 -0.22 -1.32 0.00 0.00 176.35 174.24 2zag s LEU 958 N -5.27 4.46 -0.11 -0.68 2.96 -1.21 -4.84 118.68 114.00 2zag s LEU 958 Ca 0.56 1.23 0.02 0.00 -0.22 0.00 0.00 54.13 55.72 2zag s LEU 958 Cb -0.11 -2.94 -0.01 0.00 0.50 0.00 0.00 46.19 43.62 2zag s LEU 958 CO 0.53 0.16 -0.16 -0.70 -1.32 0.00 0.00 176.35 174.86 2zag s GLU 959 N -0.53 3.14 0.15 1.98 2.12 -1.26 -0.30 118.70 123.99 2zag s GLU 959 Ca 0.31 -0.73 0.10 0.00 0.36 0.00 0.00 54.97 55.00 2zag s GLU 959 Cb -0.19 -2.51 -0.04 0.00 0.26 0.00 0.00 34.13 31.65 2zag s GLU 959 CO 0.18 0.29 -0.23 0.14 -0.54 0.00 0.00 175.26 175.10 2zag s VAL 960 N 0.14 2.05 0.54 3.70 -7.23 0.54 -4.96 120.40 115.18 2zag s VAL 960 Ca -0.08 -1.81 -0.17 0.00 -1.81 0.00 0.00 61.98 58.11 2zag s VAL 960 Cb -0.15 -1.88 -0.06 0.00 0.56 0.00 0.00 36.38 34.85 2zag s VAL 960 CO 0.05 -0.09 1.04 -0.55 -0.31 0.00 0.00 175.10 175.24 2zag s SER 961 N -2.31 6.12 -0.24 4.85 0.15 -1.26 -1.12 113.70 119.88 2zag s SER 961 Ca 0.14 1.81 -0.08 0.00 0.70 0.00 0.00 55.95 58.52 2zag s SER 961 Cb -0.09 -2.54 -0.04 0.00 -1.71 0.00 0.00 66.02 61.65 2zag s SER 961 CO 0.07 -0.94 0.10 0.00 1.20 0.00 0.00 173.24 173.67 2zag s ALA 962 N -2.33 3.31 0.00 5.45 0.00 -0.90 -2.16 121.76 125.13 2zag s ALA 962 Ca 0.64 -1.02 0.00 0.00 0.00 0.00 0.00 51.96 51.58 2zag s ALA 962 Cb -0.15 -2.13 0.00 0.00 0.00 0.00 0.00 23.12 20.84 2zag s ALA 962 CO 0.30 -0.33 0.00 0.43 0.00 0.00 0.00 175.76 176.17 2zag n SER 963 N 4.59 1.44 -0.89 0.00 7.64 0.01 -4.83 113.62 121.57 2zag n SER 963 Ca -0.16 -0.87 0.12 0.00 1.01 0.00 0.00 58.87 58.98 2zag n SER 963 Cb 0.52 0.00 0.16 0.00 -1.01 0.00 0.00 64.21 63.88 2zag n SER 963 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03