#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 5at1 s ASN 2 N 0.00 2.94 0.23 0.00 2.20 0.23 -4.93 114.94 115.62 5at1 s ASN 2 Ca 0.00 1.69 -0.07 0.00 -0.94 0.00 0.00 52.86 53.54 5at1 s ASN 2 Cb 0.00 -2.32 0.40 0.00 -2.00 0.00 0.00 41.25 37.33 5at1 s ASN 2 CO 0.00 -3.00 1.70 -0.65 -2.94 0.00 0.00 177.10 172.20 5at1 h PRO 3 N -1.80 0.27 -0.39 3.55 0.11 -1.95 -3.07 132.00 128.72 5at1 h PRO 3 Ca -0.50 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.60 5at1 h PRO 3 Cb 1.28 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.33 5at1 h PRO 3 CO 0.50 0.18 0.00 1.28 -0.21 0.00 0.00 178.00 179.75 5at1 n LEU 4 N -5.14 2.08 -4.71 2.35 4.77 -1.26 -4.89 117.00 110.20 5at1 n LEU 4 Ca 0.12 -1.04 -0.42 0.00 -0.03 0.00 0.00 56.01 54.64 5at1 n LEU 4 Cb 0.40 -0.26 -0.03 0.00 -2.33 0.00 0.00 43.42 41.20 5at1 n LEU 4 CO 0.14 0.51 1.11 -0.47 -1.33 0.00 0.00 177.39 177.35 5at1 s TYR 5 N -1.50 3.13 -1.40 -1.77 6.14 -1.16 -2.30 117.35 118.49 5at1 s TYR 5 Ca 0.25 0.85 0.00 0.00 0.64 0.00 0.00 57.07 58.81 5at1 s TYR 5 Cb 0.13 -3.74 0.00 0.00 0.42 0.00 0.00 41.96 38.78 5at1 s TYR 5 CO 0.17 -2.66 0.00 1.04 0.64 0.00 0.00 175.55 174.74 5at1 n GLN 6 N 4.17 -1.32 -3.49 4.97 6.02 0.55 -4.96 117.38 123.31 5at1 n GLN 6 Ca 0.12 0.79 -0.34 0.00 -0.01 0.00 0.00 57.00 57.56 5at1 n GLN 6 Cb 0.42 -5.02 -0.05 0.00 1.02 0.00 0.00 30.24 26.60 5at1 n GLN 6 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.06 176.26 5at1 s LYS 7 N -3.09 3.82 -0.27 -1.09 2.20 -0.97 -4.73 119.74 115.62 5at1 s LYS 7 Ca 0.00 0.27 -0.27 0.00 -0.36 0.00 0.00 55.97 55.61 5at1 s LYS 7 Cb 0.00 -2.93 0.01 0.00 -1.51 0.00 0.00 37.83 33.40 5at1 s LYS 7 CO 0.00 0.50 0.96 -1.01 -0.36 0.00 0.00 175.35 175.44 5at1 s HIS 8 N -1.48 3.27 -0.62 4.03 3.76 -1.26 -4.81 115.29 118.18 5at1 s HIS 8 Ca 0.37 1.23 -0.22 0.00 -0.15 0.00 0.00 55.06 56.28 5at1 s HIS 8 Cb -0.14 -3.31 0.06 0.00 1.11 0.00 0.00 32.58 30.31 5at1 s HIS 8 CO 0.19 -0.54 0.91 0.42 -0.85 0.00 0.00 174.74 174.87 5at1 s ILE 9 N 3.19 4.42 -0.03 0.60 1.09 -1.19 -4.82 121.20 124.45 5at1 s ILE 9 Ca 0.40 -0.26 0.03 0.00 -1.10 0.00 0.00 60.65 59.72 5at1 s ILE 9 Cb -0.14 -4.60 -0.04 0.00 -1.06 0.00 0.00 42.46 36.62 5at1 s ILE 9 CO 0.09 -1.30 0.00 -0.38 -0.10 0.00 0.00 174.94 173.26 5at1 n ILE 10 N 5.94 0.23 -3.86 2.92 5.41 -1.26 -2.50 119.36 126.23 5at1 n ILE 10 Ca -0.03 -0.13 -0.11 0.00 1.00 0.00 0.00 62.75 63.47 5at1 n ILE 10 Cb 0.46 -0.87 -0.11 0.00 -0.71 0.00 0.00 39.64 38.41 5at1 n ILE 10 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 176.55 176.00 5at1 s SER 11 N -3.58 -0.02 0.27 4.38 0.15 -1.26 -4.65 113.70 108.98 5at1 s SER 11 Ca -0.02 -0.04 -0.04 0.00 0.70 0.00 0.00 55.95 56.55 5at1 s SER 11 Cb 0.01 0.23 0.34 0.00 -1.71 0.00 0.00 66.02 64.89 5at1 s SER 11 CO 0.13 -0.23 1.91 0.40 1.20 0.00 0.00 173.24 176.65 5at1 h ILE 12 N 4.58 1.23 -0.93 6.45 1.08 -1.94 -2.43 117.51 125.56 5at1 h ILE 12 Ca -0.28 -0.52 0.10 0.00 -0.39 0.00 0.00 64.86 63.76 5at1 h ILE 12 Cb 1.20 0.06 -0.08 0.00 -3.07 0.00 0.00 36.82 34.93 5at1 h ILE 12 CO 0.41 0.25 0.57 -1.13 -0.69 0.00 0.00 178.15 177.56 5at1 h ASN 13 N 1.16 0.85 0.27 1.72 -0.73 -1.94 -0.00 115.58 116.91 5at1 h ASN 13 Ca 0.30 0.04 0.00 0.00 1.87 0.00 0.00 56.30 58.51 5at1 h ASN 13 Cb -0.04 -0.13 0.00 0.00 0.27 0.00 0.00 38.32 38.42 5at1 h ASN 13 CO -0.06 0.48 0.00 0.47 -0.37 0.00 0.00 177.43 177.95 5at1 n ASP 14 N -4.65 0.00 -4.61 1.15 8.00 -0.91 -4.79 116.55 110.73 5at1 n ASP 14 Ca 0.16 -0.30 -0.34 0.00 0.71 0.00 0.00 54.79 55.02 5at1 n ASP 14 Cb 0.30 -0.18 -0.11 0.00 -0.02 0.00 0.00 41.12 41.11 5at1 n ASP 14 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 5at1 s LEU 15 N -2.36 3.36 0.60 0.64 1.43 -0.02 -5.00 118.68 117.33 5at1 s LEU 15 Ca 0.27 0.03 -0.08 0.00 -1.03 0.00 0.00 54.13 53.32 5at1 s LEU 15 Cb 0.16 -1.76 -0.01 0.00 0.03 0.00 0.00 46.19 44.61 5at1 s LEU 15 CO 0.32 0.34 0.94 -0.94 0.23 0.00 0.00 176.35 177.25 5at1 s SER 16 N -0.66 5.78 0.40 2.29 1.04 -1.26 -4.86 113.70 116.43 5at1 s SER 16 Ca 0.10 0.96 0.18 0.00 0.48 0.00 0.00 55.95 57.67 5at1 s SER 16 Cb -0.12 -1.98 1.09 0.00 0.10 0.00 0.00 66.02 65.12 5at1 s SER 16 CO 0.02 -1.01 1.79 -0.09 0.98 0.00 0.00 173.24 174.93 5at1 h ARG 17 N -0.23 0.40 -0.01 4.02 2.43 -1.97 0.74 114.38 119.76 5at1 h ARG 17 Ca -0.45 -0.02 -0.20 0.00 -0.81 0.00 0.00 59.98 58.49 5at1 h ARG 17 Cb 1.24 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 30.69 5at1 h ARG 17 CO 0.62 0.26 -0.87 -0.44 -1.51 0.00 0.00 179.97 178.03 5at1 h ASP 18 N 0.41 0.36 -0.36 -3.80 3.32 -1.98 -2.19 116.42 112.19 5at1 h ASP 18 Ca 0.57 -0.28 -0.06 0.00 0.02 0.00 0.00 57.03 57.27 5at1 h ASP 18 Cb 1.43 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 40.86 5at1 h ASP 18 CO -0.27 1.07 -0.03 0.44 -1.72 0.00 0.00 179.24 178.73 5at1 h ASP 19 N 0.16 0.64 -0.44 6.45 3.45 -1.27 -0.75 116.42 124.67 5at1 h ASP 19 Ca -0.05 -0.33 0.06 0.00 0.43 0.00 0.00 57.03 57.14 5at1 h ASP 19 Cb 1.49 -0.17 -0.05 0.00 -0.56 0.00 0.00 39.33 40.03 5at1 h ASP 19 CO 0.14 0.82 0.12 -0.07 -1.57 0.00 0.00 179.24 178.67 5at1 h LEU 20 N 0.45 0.08 -0.79 1.55 3.38 -1.07 0.40 115.31 119.32 5at1 h LEU 20 Ca 0.10 0.06 -0.08 0.00 0.09 0.00 0.00 57.88 58.05 5at1 h LEU 20 Cb 0.50 0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.30 5at1 h LEU 20 CO 0.02 0.08 0.02 0.78 0.09 0.00 0.00 178.44 179.42 5at1 h ASN 21 N 0.26 0.90 -0.64 -0.43 -0.26 -1.23 -0.04 115.58 114.14 5at1 h ASN 21 Ca 0.21 -0.23 -0.09 0.00 -0.56 0.00 0.00 56.30 55.63 5at1 h ASN 21 Cb 0.24 -0.24 -0.02 0.00 -1.06 0.00 0.00 38.32 37.23 5at1 h ASN 21 CO -0.25 0.95 0.05 0.25 -1.06 0.00 0.00 177.43 177.37 5at1 h LEU 22 N 0.86 1.07 0.13 1.61 5.85 -0.50 -0.14 115.31 124.20 5at1 h LEU 22 Ca 0.16 -0.29 -0.01 0.00 0.84 0.00 0.00 57.88 58.59 5at1 h LEU 22 Cb 0.49 -0.29 0.00 0.00 0.37 0.00 0.00 40.66 41.23 5at1 h LEU 22 CO 0.02 1.09 -0.06 0.58 -0.34 0.00 0.00 178.44 179.73 5at1 h VAL 23 N 1.01 0.93 -0.09 1.05 2.07 -0.14 -1.98 116.25 119.11 5at1 h VAL 23 Ca 0.19 -0.26 -0.03 0.00 0.82 0.00 0.00 66.70 67.42 5at1 h VAL 23 Cb 0.51 1.09 -0.01 0.00 -1.52 0.00 0.00 31.29 31.37 5at1 h VAL 23 CO 0.02 0.06 -0.08 -0.07 0.02 0.00 0.00 177.57 177.53 5at1 h LEU 24 N -0.30 0.12 0.00 2.57 4.07 -0.87 -1.94 115.31 118.96 5at1 h LEU 24 Ca -0.02 -0.02 -0.00 0.00 0.08 0.00 0.00 57.88 57.93 5at1 h LEU 24 Cb 0.24 -0.03 0.00 0.00 1.08 0.00 0.00 40.66 41.95 5at1 h LEU 24 CO 0.03 0.22 -0.00 0.00 -1.08 0.00 0.00 178.44 177.61 5at1 h ALA 25 N 1.80 -0.01 -0.55 1.53 0.00 -0.79 -2.54 119.26 118.70 5at1 h ALA 25 Ca 0.03 -0.29 0.11 0.00 0.00 0.00 0.00 54.91 54.76 5at1 h ALA 25 Cb 0.23 0.00 -0.09 0.00 0.00 0.00 0.00 17.79 17.93 5at1 h ALA 25 CO 0.01 -0.21 0.00 1.15 0.00 0.00 0.00 179.25 180.20 5at1 h THR 26 N -0.58 0.56 -0.76 0.00 2.02 -1.03 -0.80 112.91 112.32 5at1 h THR 26 Ca -0.00 -0.04 0.08 0.00 0.77 0.00 0.00 66.41 67.22 5at1 h THR 26 Cb 0.57 0.43 -0.07 0.00 -1.74 0.00 0.00 68.15 67.35 5at1 h THR 26 CO 0.00 0.02 0.42 0.00 0.37 0.00 0.00 175.52 176.33 5at1 h ALA 27 N 1.50 1.05 0.00 6.16 0.00 -1.41 -0.20 119.26 126.36 5at1 h ALA 27 Ca 0.28 0.03 -0.09 0.00 0.00 0.00 0.00 54.91 55.13 5at1 h ALA 27 Cb 0.44 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 5at1 h ALA 27 CO -0.46 0.07 -0.45 0.00 0.00 0.00 0.00 179.25 178.40 5at1 h ALA 28 N 1.41 1.17 0.11 0.00 0.00 -0.73 -1.73 119.26 119.49 5at1 h ALA 28 Ca 0.36 -0.41 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 5at1 h ALA 28 Cb 0.30 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.01 5at1 h ALA 28 CO -0.23 0.56 -0.05 0.87 0.00 0.00 0.00 179.25 180.41 5at1 h LYS 29 N 0.00 -0.14 -0.57 0.00 1.57 -0.31 -2.88 116.57 114.23 5at1 h LYS 29 Ca -0.00 0.01 0.05 0.00 -1.87 0.00 0.00 60.65 58.84 5at1 h LYS 29 Cb 0.84 0.03 -0.03 0.00 0.08 0.00 0.00 32.23 33.15 5at1 h LYS 29 CO 0.06 0.31 0.38 -0.07 -0.57 0.00 0.00 179.45 179.55 5at1 h LEU 30 N -0.66 0.50 -0.05 2.94 3.38 -1.07 0.95 115.31 121.30 5at1 h LEU 30 Ca -0.01 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.95 5at1 h LEU 30 Cb 0.51 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.15 5at1 h LEU 30 CO 0.02 0.33 0.03 0.50 0.09 0.00 0.00 178.44 179.42 5at1 h LYS 31 N 0.57 0.06 -0.23 1.13 3.64 -1.36 -2.92 116.57 117.47 5at1 h LYS 31 Ca 0.24 -0.00 -0.14 0.00 -1.27 0.00 0.00 60.65 59.47 5at1 h LYS 31 Cb 0.23 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.04 5at1 h LYS 31 CO -0.07 0.04 -0.41 0.00 -2.27 0.00 0.00 179.45 176.74 5at1 h ALA 32 N 1.02 0.36 -3.25 5.00 0.00 -0.96 -3.39 119.26 118.04 5at1 h ALA 32 Ca 0.02 -0.46 -0.61 0.00 0.00 0.00 0.00 54.91 53.86 5at1 h ALA 32 Cb -0.01 -0.06 -0.40 0.00 0.00 0.00 0.00 17.79 17.32 5at1 h ALA 32 CO -0.00 0.47 -0.74 -0.80 0.00 0.00 0.00 179.25 178.17 5at1 s ASN 33 N -6.67 4.13 0.12 0.00 0.01 0.19 -5.10 114.94 107.63 5at1 s ASN 33 Ca -0.12 -2.02 -0.31 0.00 -0.71 0.00 0.00 52.86 49.70 5at1 s ASN 33 Cb 0.08 -1.10 -0.08 0.00 0.41 0.00 0.00 41.25 40.56 5at1 s ASN 33 CO 0.84 -0.37 1.39 -2.16 -1.51 0.00 0.00 177.10 175.29 5at1 s PRO 34 N 1.11 4.32 -0.57 -0.60 0.04 -1.10 -4.04 135.00 134.16 5at1 s PRO 34 Ca 0.12 2.08 -0.06 0.00 0.04 0.00 0.00 61.00 63.18 5at1 s PRO 34 Cb -0.20 -3.24 0.15 0.00 0.04 0.00 0.00 34.50 31.25 5at1 s PRO 34 CO -0.15 -0.43 0.41 -0.65 0.04 0.00 0.00 177.00 176.22 5at1 s GLN 35 N 1.01 2.55 0.00 4.56 1.11 -1.26 -4.97 119.66 122.66 5at1 s GLN 35 Ca 0.64 -2.20 0.26 0.00 0.01 0.00 0.00 55.36 54.07 5at1 s GLN 35 Cb -0.37 -3.83 1.53 0.00 -1.01 0.00 0.00 33.01 29.33 5at1 s GLN 35 CO 0.31 -1.17 1.91 -0.35 0.01 0.00 0.00 175.29 176.00 5at1 n PRO 36 N 4.10 0.86 -1.51 2.91 -0.04 -1.26 -3.60 135.00 136.46 5at1 n PRO 36 Ca 0.03 0.00 0.04 0.00 -0.04 0.00 0.00 63.50 63.52 5at1 n PRO 36 Cb 0.40 -1.46 0.04 0.00 -0.04 0.00 0.00 33.50 32.44 5at1 n PRO 36 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 5at1 n GLU 37 N -0.96 0.28 -0.03 0.54 1.02 -1.26 -2.44 120.64 117.79 5at1 n GLU 37 Ca 0.19 -2.23 -0.15 0.00 -0.02 0.00 0.00 57.16 54.95 5at1 n GLU 37 Cb 0.09 -0.27 -0.10 0.00 -0.02 0.00 0.00 31.44 31.14 5at1 n GLU 37 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 5at1 h LEU 38 N 1.12 0.30 -3.02 -4.62 5.85 -1.57 -3.12 115.31 110.24 5at1 h LEU 38 Ca -0.20 -0.67 -0.16 0.00 0.84 0.00 0.00 57.88 57.69 5at1 h LEU 38 Cb 1.78 -0.09 -0.10 0.00 0.37 0.00 0.00 40.66 42.62 5at1 h LEU 38 CO 0.10 0.93 0.20 0.18 -0.34 0.00 0.00 178.44 179.51 5at1 n LEU 39 N -4.50 4.83 -4.71 2.25 4.77 0.11 -4.93 117.00 114.83 5at1 n LEU 39 Ca -0.09 -2.50 -0.42 0.00 -0.03 0.00 0.00 56.01 52.97 5at1 n LEU 39 Cb 0.48 -0.67 -0.03 0.00 -2.33 0.00 0.00 43.42 40.86 5at1 n LEU 39 CO 0.40 0.67 1.38 -0.75 -1.33 0.00 0.00 177.39 177.76 5at1 s LYS 40 N -2.22 4.14 0.00 3.23 2.20 -1.15 -1.36 119.74 124.58 5at1 s LYS 40 Ca 0.38 2.57 0.00 0.00 -0.36 0.00 0.00 55.97 58.56 5at1 s LYS 40 Cb 0.30 -3.21 0.00 0.00 -1.51 0.00 0.00 37.83 33.41 5at1 s LYS 40 CO 0.09 -0.76 0.00 0.72 -0.36 0.00 0.00 175.35 175.05 5at1 n HIS 41 N 4.39 0.00 -2.82 4.03 8.25 -1.26 -5.03 115.22 122.79 5at1 n HIS 41 Ca 0.16 0.00 -0.32 0.00 -0.26 0.00 0.00 57.72 57.30 5at1 n HIS 41 Cb 0.36 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.42 5at1 n HIS 41 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 5at1 s LYS 42 N -0.25 3.98 -0.11 -0.41 3.01 -0.47 -4.99 119.74 120.50 5at1 s LYS 42 Ca 0.00 0.79 0.03 0.00 -1.01 0.00 0.00 55.97 55.77 5at1 s LYS 42 Cb 0.00 -2.29 -0.00 0.00 -1.01 0.00 0.00 37.83 34.52 5at1 s LYS 42 CO 0.00 -0.04 -0.21 0.08 0.51 0.00 0.00 175.35 175.69 5at1 s VAL 43 N -2.28 2.33 0.04 3.17 1.01 -1.26 -2.01 120.40 121.40 5at1 s VAL 43 Ca 0.56 -0.92 0.08 0.00 0.00 0.00 0.00 61.98 61.70 5at1 s VAL 43 Cb -0.10 -1.92 -0.03 0.00 0.00 0.00 0.00 36.38 34.33 5at1 s VAL 43 CO 0.23 0.55 -0.21 -0.63 0.00 0.00 0.00 175.10 175.04 5at1 s ILE 44 N 0.41 2.57 -0.16 2.22 1.01 0.93 -1.99 121.20 126.19 5at1 s ILE 44 Ca -0.15 -1.26 -0.11 0.00 0.00 0.00 0.00 60.65 59.12 5at1 s ILE 44 Cb -0.17 -2.06 -0.05 0.00 0.01 0.00 0.00 42.46 40.19 5at1 s ILE 44 CO 0.07 0.34 0.22 0.00 0.00 0.00 0.00 174.94 175.57 5at1 s ALA 45 N -0.89 3.68 -0.59 9.38 0.00 -0.72 -0.31 121.76 132.31 5at1 s ALA 45 Ca 0.14 -0.56 -0.01 0.00 0.00 0.00 0.00 51.96 51.53 5at1 s ALA 45 Cb -0.10 -2.25 0.15 0.00 0.00 0.00 0.00 23.12 20.92 5at1 s ALA 45 CO 0.04 0.21 0.38 0.45 0.00 0.00 0.00 175.76 176.85 5at1 s SER 46 N 0.12 4.97 -1.01 0.00 0.15 0.86 -1.44 113.70 117.36 5at1 s SER 46 Ca 0.13 -2.88 -0.14 0.00 0.70 0.00 0.00 55.95 53.76 5at1 s SER 46 Cb -0.12 -1.79 0.20 0.00 -1.71 0.00 0.00 66.02 62.60 5at1 s SER 46 CO 0.02 -0.33 1.10 0.00 1.20 0.00 0.00 173.24 175.23 5at1 s PHE 48 N 0.77 3.06 -0.63 0.00 0.40 0.80 -2.03 117.98 120.34 5at1 s PHE 48 Ca 0.31 -1.13 0.26 0.00 -0.60 0.00 0.00 56.93 55.76 5at1 s PHE 48 Cb -0.07 -4.13 0.83 0.00 0.51 0.00 0.00 43.02 40.16 5at1 s PHE 48 CO -0.07 -1.39 1.76 0.74 0.70 0.00 0.00 175.22 176.96 5at1 h PHE 49 N 8.99 0.00 -4.44 0.36 -1.00 -1.11 -2.74 116.94 117.00 5at1 h PHE 49 Ca -0.11 0.00 -0.70 0.00 2.81 0.00 0.00 57.97 59.97 5at1 h PHE 49 Cb 1.06 0.00 -0.29 0.00 3.61 0.00 0.00 35.95 40.33 5at1 h PHE 49 CO 0.98 0.00 -0.87 -2.00 -1.61 0.00 0.00 178.31 174.81 5at1 s GLU 50 N -3.17 2.23 -0.00 1.51 2.12 -1.19 -1.60 118.70 118.60 5at1 s GLU 50 Ca 0.09 -0.90 -0.02 0.00 0.36 0.00 0.00 54.97 54.50 5at1 s GLU 50 Cb 0.11 -2.10 -0.04 0.00 0.26 0.00 0.00 34.13 32.36 5at1 s GLU 50 CO 0.56 0.54 0.14 0.00 -0.54 0.00 0.00 175.26 175.96 5at1 s ALA 51 N -0.55 3.81 -0.21 6.30 0.00 -1.26 -4.53 121.76 125.32 5at1 s ALA 51 Ca 0.08 -0.81 -0.05 0.00 0.00 0.00 0.00 51.96 51.18 5at1 s ALA 51 Cb -0.11 -1.76 0.11 0.00 0.00 0.00 0.00 23.12 21.36 5at1 s ALA 51 CO -0.00 0.73 0.40 -1.12 0.00 0.00 0.00 175.76 175.77 5at1 s SER 52 N -1.89 -0.04 0.01 0.00 0.01 -1.26 -4.98 113.70 105.55 5at1 s SER 52 Ca 0.26 0.66 -0.19 0.00 1.31 0.00 0.00 55.95 57.99 5at1 s SER 52 Cb -0.12 1.23 -0.24 0.00 0.21 0.00 0.00 66.02 67.10 5at1 s SER 52 CO 0.17 -0.26 1.09 0.71 0.41 0.00 0.00 173.24 175.36 5at1 h THR 53 N 6.18 1.41 -0.09 1.44 1.35 -1.98 -2.82 112.91 118.40 5at1 h THR 53 Ca -0.17 -2.15 0.04 0.00 -0.55 0.00 0.00 66.41 63.58 5at1 h THR 53 Cb 1.13 2.63 -0.06 0.00 -1.73 0.00 0.00 68.15 70.13 5at1 h THR 53 CO 0.18 0.63 -0.28 -0.09 -0.25 0.00 0.00 175.52 175.72 5at1 h ARG 54 N -0.06 -0.36 -0.87 4.72 2.43 -1.98 0.75 114.38 119.01 5at1 h ARG 54 Ca -0.09 0.02 -0.02 0.00 -0.81 0.00 0.00 59.98 59.09 5at1 h ARG 54 Cb 1.41 0.08 -0.04 0.00 -0.42 0.00 0.00 29.97 31.00 5at1 h ARG 54 CO 0.14 -0.24 0.48 1.15 -1.51 0.00 0.00 179.97 179.98 5at1 h THR 55 N -0.37 1.25 -0.27 0.20 2.02 -1.99 0.44 112.91 114.19 5at1 h THR 55 Ca 0.09 -0.62 -0.15 0.00 0.77 0.00 0.00 66.41 66.49 5at1 h THR 55 Cb 0.50 0.08 -0.01 0.00 -1.74 0.00 0.00 68.15 66.99 5at1 h THR 55 CO -0.30 0.28 -0.45 -0.09 0.37 0.00 0.00 175.52 175.33 5at1 h ARG 56 N 1.21 0.69 0.00 6.66 2.43 -1.15 -0.36 114.38 123.86 5at1 h ARG 56 Ca 0.31 -0.38 -0.07 0.00 -0.81 0.00 0.00 59.98 59.02 5at1 h ARG 56 Cb 0.03 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.59 5at1 h ARG 56 CO -0.05 1.00 -0.67 -0.07 -1.51 0.00 0.00 179.97 178.67 5at1 h LEU 57 N 0.55 0.00 -0.27 3.80 3.38 0.12 -0.87 115.31 122.02 5at1 h LEU 57 Ca 0.03 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.90 5at1 h LEU 57 Cb 1.00 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.74 5at1 h LEU 57 CO 0.09 0.29 -0.23 0.28 0.09 0.00 0.00 178.44 178.96 5at1 h SER 58 N 0.00 0.67 -0.10 -0.43 0.02 0.17 -2.60 113.55 111.28 5at1 h SER 58 Ca -0.04 -0.46 -0.10 0.00 -0.84 0.00 0.00 61.79 60.36 5at1 h SER 58 Cb 1.25 -0.19 0.00 0.00 0.14 0.00 0.00 62.40 63.60 5at1 h SER 58 CO 0.03 0.99 -0.31 -0.26 -1.14 0.00 0.00 176.83 176.14 5at1 h PHE 59 N 0.36 0.50 -0.16 3.45 0.05 -0.97 0.10 116.94 120.28 5at1 h PHE 59 Ca 0.05 -0.20 -0.11 0.00 3.82 0.00 0.00 57.97 61.52 5at1 h PHE 59 Cb 0.79 -0.09 -0.01 0.00 2.00 0.00 0.00 35.95 38.64 5at1 h PHE 59 CO 0.07 0.92 -0.40 1.96 -0.18 0.00 0.00 178.31 180.69 5at1 h GLN 60 N -0.06 0.36 -0.32 1.51 4.20 -1.27 -0.76 115.11 118.77 5at1 h GLN 60 Ca -0.01 -0.17 -0.11 0.00 0.06 0.00 0.00 58.65 58.41 5at1 h GLN 60 Cb 0.93 -0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.70 5at1 h GLN 60 CO 0.07 0.71 -0.24 1.15 -0.67 0.00 0.00 178.83 179.84 5at1 h THR 61 N 0.30 1.29 -0.48 -0.54 2.02 -1.38 -0.63 112.91 113.50 5at1 h THR 61 Ca 0.03 -1.39 0.09 0.00 0.77 0.00 0.00 66.41 65.92 5at1 h THR 61 Cb 0.84 1.47 -0.08 0.00 -1.74 0.00 0.00 68.15 68.64 5at1 h THR 61 CO 0.07 0.45 -0.00 0.28 0.37 0.00 0.00 175.52 176.68 5at1 h SER 62 N 0.50 -0.21 0.24 4.18 0.02 -0.54 0.48 113.55 118.23 5at1 h SER 62 Ca 0.06 0.11 -0.01 0.00 -0.84 0.00 0.00 61.79 61.12 5at1 h SER 62 Cb 0.80 0.20 0.00 0.00 0.14 0.00 0.00 62.40 63.54 5at1 h SER 62 CO 0.06 -0.07 -0.12 0.24 -1.14 0.00 0.00 176.83 175.80 5at1 h MET 63 N 0.11 -0.32 -0.58 3.45 2.07 -1.00 -2.64 114.93 116.02 5at1 h MET 63 Ca 0.24 0.02 -0.03 0.00 -2.07 0.00 0.00 59.70 57.86 5at1 h MET 63 Cb 0.36 0.07 -0.03 0.00 -1.87 0.00 0.00 31.60 30.14 5at1 h MET 63 CO -0.40 -0.22 0.22 0.45 1.07 0.00 0.00 176.91 178.03 5at1 h HIS 64 N -0.34 0.85 0.00 -0.22 3.86 -0.71 -1.79 115.15 116.81 5at1 h HIS 64 Ca -0.03 -0.05 0.00 0.00 -1.16 0.00 0.00 60.37 59.13 5at1 h HIS 64 Cb 0.26 -0.26 0.00 0.00 1.06 0.00 0.00 27.41 28.47 5at1 h HIS 64 CO -0.07 0.66 0.00 -2.13 0.86 0.00 0.00 177.93 177.26 5at1 n ARG 65 N -4.32 0.11 -0.09 2.45 3.00 0.17 -0.68 116.66 117.30 5at1 n ARG 65 Ca 0.05 0.20 0.03 0.00 -0.00 0.00 0.00 57.85 58.13 5at1 n ARG 65 Cb 0.17 -1.50 0.04 0.00 0.00 0.00 0.00 32.46 31.17 5at1 n ARG 65 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91 5at1 n LEU 66 N -1.27 1.37 -2.30 6.15 4.77 -0.87 -4.03 117.00 120.82 5at1 n LEU 66 Ca 0.04 -1.70 -0.15 0.00 -0.03 0.00 0.00 56.01 54.16 5at1 n LEU 66 Cb 0.06 -0.11 0.04 0.00 -2.33 0.00 0.00 43.42 41.08 5at1 n LEU 66 CO 0.06 0.41 0.09 0.61 -1.33 0.00 0.00 177.39 177.22 5at1 n GLY 67 N -0.56 -0.06 3.76 -0.72 0.00 0.14 0.09 105.19 107.84 5at1 n GLY 67 Ca 0.04 -0.12 -0.30 0.00 0.00 0.00 0.00 46.02 45.63 5at1 n GLY 67 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 5at1 s ALA 68 N -3.09 3.51 0.32 4.61 0.00 -0.73 -2.94 121.76 123.44 5at1 s ALA 68 Ca 0.30 -1.04 -0.14 0.00 0.00 0.00 0.00 51.96 51.07 5at1 s ALA 68 Cb -0.13 -1.38 -0.09 0.00 0.00 0.00 0.00 23.12 21.52 5at1 s ALA 68 CO 0.37 0.73 0.73 -1.12 0.00 0.00 0.00 175.76 176.47 5at1 s SER 69 N -2.40 6.75 0.02 0.00 0.01 -0.85 -4.03 113.70 113.20 5at1 s SER 69 Ca 0.29 1.25 0.07 0.00 1.31 0.00 0.00 55.95 58.86 5at1 s SER 69 Cb -0.12 -2.36 -0.02 0.00 0.21 0.00 0.00 66.02 63.73 5at1 s SER 69 CO 0.21 -0.21 -0.20 -0.69 0.41 0.00 0.00 173.24 172.76 5at1 s VAL 70 N -2.00 1.63 0.05 3.43 1.01 -1.26 -0.05 120.40 123.22 5at1 s VAL 70 Ca 0.54 -1.07 0.04 0.00 0.00 0.00 0.00 61.98 61.49 5at1 s VAL 70 Cb -0.10 -1.39 -0.02 0.00 0.00 0.00 0.00 36.38 34.86 5at1 s VAL 70 CO 0.18 0.29 -0.13 0.68 0.00 0.00 0.00 175.10 176.13 5at1 s VAL 71 N -0.68 1.01 -1.01 2.92 -7.23 0.58 -4.88 120.40 111.10 5at1 s VAL 71 Ca 0.07 -1.10 0.00 0.00 -1.81 0.00 0.00 61.98 59.15 5at1 s VAL 71 Cb -0.08 -0.95 0.00 0.00 0.56 0.00 0.00 36.38 35.91 5at1 s VAL 71 CO 0.01 -0.13 0.00 0.61 -0.31 0.00 0.00 175.10 175.28 5at1 n GLY 72 N 1.64 -0.91 3.70 2.32 0.00 -1.26 -0.10 105.19 110.58 5at1 n GLY 72 Ca -0.20 -0.79 -0.08 0.00 0.00 0.00 0.00 46.02 44.95 5at1 n GLY 72 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 5at1 s PHE 73 N -3.00 -0.29 0.28 1.61 -0.12 -0.39 -4.93 117.98 111.13 5at1 s PHE 73 Ca 0.00 -0.06 0.02 0.00 -0.05 0.00 0.00 56.93 56.84 5at1 s PHE 73 Cb 0.00 0.65 -0.05 0.00 -0.63 0.00 0.00 43.02 42.99 5at1 s PHE 73 CO 0.00 -1.04 0.12 -1.54 -0.05 0.00 0.00 175.22 172.71 5at1 s SER 74 N -2.85 1.33 0.00 1.98 1.04 -1.21 -0.14 113.70 113.85 5at1 s SER 74 Ca 0.08 -1.45 0.00 0.00 0.48 0.00 0.00 55.95 55.06 5at1 s SER 74 Cb -0.04 0.24 0.00 0.00 0.10 0.00 0.00 66.02 66.33 5at1 s SER 74 CO -0.00 -0.79 0.00 -0.67 0.98 0.00 0.00 173.24 172.76 5at1 n ASP 75 N -0.63 0.00 -1.54 7.02 4.64 -1.03 -4.88 116.55 120.13 5at1 n ASP 75 Ca 0.00 0.00 -0.20 0.00 -1.38 0.00 0.00 54.79 53.21 5at1 n ASP 75 Cb 0.66 0.00 -0.08 0.00 -1.04 0.00 0.00 41.12 40.65 5at1 n ASP 75 CO 0.00 0.00 0.00 -1.20 -0.82 0.00 0.00 177.20 175.18 5at1 n SER 76 N 0.00 -5.38 0.00 1.67 7.64 -0.63 -4.68 113.62 112.24 5at1 n SER 76 Ca 0.00 0.49 0.00 0.00 1.01 0.00 0.00 58.87 60.37 5at1 n SER 76 Cb 0.00 -4.71 0.00 0.00 -1.01 0.00 0.00 64.21 58.49 5at1 n SER 76 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 5at1 n ALA 77 N 1.31 0.00 -2.69 -0.43 0.00 -1.26 -5.03 120.51 112.41 5at1 n ALA 77 Ca -0.20 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 52.84 5at1 n ALA 77 Cb 0.66 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 20.07 5at1 n ALA 77 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 5at1 s ASN 78 N 2.00 6.96 0.02 0.00 3.04 -1.26 -4.96 114.94 120.74 5at1 s ASN 78 Ca 0.00 1.16 -0.24 0.00 0.04 0.00 0.00 52.86 53.82 5at1 s ASN 78 Cb 0.00 -2.43 -0.13 0.00 -1.54 0.00 0.00 41.25 37.15 5at1 s ASN 78 CO 0.00 -0.26 1.15 0.74 -3.04 0.00 0.00 177.10 175.69 5at1 h THR 79 N 4.99 0.00 0.00 -5.21 2.02 -1.90 -3.49 112.91 109.32 5at1 h THR 79 Ca -0.35 -0.17 0.00 0.00 0.77 0.00 0.00 66.41 66.66 5at1 h THR 79 Cb 1.17 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.58 5at1 h THR 79 CO 0.79 0.00 0.00 -1.20 0.37 0.00 0.00 175.52 175.48 5at1 n SER 80 N -4.79 0.00 -0.06 4.18 7.64 -1.26 -4.95 113.62 114.38 5at1 n SER 80 Ca -0.11 0.00 0.25 0.00 1.01 0.00 0.00 58.87 60.02 5at1 n SER 80 Cb 0.34 0.00 0.63 0.00 -1.01 0.00 0.00 64.21 64.17 5at1 n SER 80 CO 0.00 0.00 0.00 0.17 -3.01 0.00 0.00 175.04 172.20 5at1 h LEU 81 N 0.00 0.00 -8.40 -3.43 -0.00 -2.01 -3.34 115.31 98.13 5at1 h LEU 81 Ca 0.00 0.00 -0.45 0.00 -0.00 0.00 0.00 57.88 57.43 5at1 h LEU 81 Cb 0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 40.66 40.62 5at1 h LEU 81 CO 0.00 0.00 1.18 -0.83 -0.00 0.00 0.00 178.44 178.79 5at1 s GLY 82 N -3.71 0.28 0.00 0.17 0.00 -1.26 -3.11 107.32 99.69 5at1 s GLY 82 Ca -0.04 -0.98 0.00 0.00 0.00 0.00 0.00 44.72 43.70 5at1 s GLY 82 CO 0.53 3.35 0.00 1.17 0.00 0.00 0.00 173.10 178.15 5at1 n LYS 83 N 9.11 0.00 -2.38 2.90 3.00 -1.26 -3.46 118.16 126.07 5at1 n LYS 83 Ca 0.24 0.00 -0.40 0.00 -0.00 0.00 0.00 58.31 58.15 5at1 n LYS 83 Cb 0.50 0.00 -0.03 0.00 0.00 0.00 0.00 35.03 35.50 5at1 n LYS 83 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.40 177.61 5at1 s LYS 84 N 0.00 3.01 0.00 1.64 2.47 -1.18 -4.17 119.74 121.51 5at1 s LYS 84 Ca 0.00 0.06 0.00 0.00 -1.56 0.00 0.00 55.97 54.47 5at1 s LYS 84 Cb 0.00 -4.25 0.00 0.00 -1.46 0.00 0.00 37.83 32.12 5at1 s LYS 84 CO 0.00 -2.33 0.00 0.41 0.16 0.00 0.00 175.35 173.59 5at1 n GLY 85 N 5.48 1.06 3.60 5.54 0.00 -1.26 -4.86 105.19 114.75 5at1 n GLY 85 Ca 0.09 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.68 5at1 n GLY 85 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 5at1 s GLU 86 N 0.00 3.28 0.53 1.61 2.56 -1.26 -4.92 118.70 120.50 5at1 s GLU 86 Ca 0.00 1.71 -0.19 0.00 0.00 0.00 0.00 54.97 56.49 5at1 s GLU 86 Cb 0.00 -4.27 -0.07 0.00 2.00 0.00 0.00 34.13 31.80 5at1 s GLU 86 CO 0.00 -1.93 1.08 0.95 -0.56 0.00 0.00 175.26 174.80 5at1 s THR 87 N 7.40 3.51 0.33 -1.70 -4.23 -1.26 -4.71 115.64 114.97 5at1 s THR 87 Ca 0.88 0.90 0.09 0.00 -1.18 0.00 0.00 61.69 62.38 5at1 s THR 87 Cb -0.27 -3.36 0.32 0.00 1.34 0.00 0.00 72.50 70.53 5at1 s THR 87 CO 0.34 -0.24 1.81 0.25 -0.54 0.00 0.00 174.62 176.25 5at1 h LEU 88 N 1.23 0.70 -0.40 4.79 5.85 -1.99 -1.24 115.31 124.25 5at1 h LEU 88 Ca -0.49 0.07 0.08 0.00 0.84 0.00 0.00 57.88 58.38 5at1 h LEU 88 Cb 1.24 -0.06 -0.07 0.00 0.37 0.00 0.00 40.66 42.14 5at1 h LEU 88 CO 0.58 0.28 -0.08 0.00 -0.34 0.00 0.00 178.44 178.87 5at1 h ALA 89 N 1.62 0.28 0.00 1.25 0.00 -1.93 -0.88 119.26 119.61 5at1 h ALA 89 Ca 0.54 0.15 -0.09 0.00 0.00 0.00 0.00 54.91 55.50 5at1 h ALA 89 Cb 0.91 0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.97 5at1 h ALA 89 CO -0.31 -0.44 -0.44 -0.44 0.00 0.00 0.00 179.25 177.62 5at1 h ASP 90 N 0.02 0.00 -0.19 0.00 3.45 -1.63 0.15 116.42 118.22 5at1 h ASP 90 Ca 0.19 0.00 -0.11 0.00 0.43 0.00 0.00 57.03 57.54 5at1 h ASP 90 Cb 0.29 0.00 -0.00 0.00 -0.56 0.00 0.00 39.33 39.06 5at1 h ASP 90 CO -0.40 0.44 -0.32 0.74 -1.57 0.00 0.00 179.24 178.14 5at1 h THR 91 N 0.00 1.34 -0.06 0.35 2.02 -0.83 -1.75 112.91 113.98 5at1 h THR 91 Ca -0.00 -1.54 -0.04 0.00 0.77 0.00 0.00 66.41 65.60 5at1 h THR 91 Cb 0.83 1.86 0.00 0.00 -1.74 0.00 0.00 68.15 69.10 5at1 h THR 91 CO 0.06 0.47 -0.12 0.40 0.37 0.00 0.00 175.52 176.70 5at1 h ILE 92 N 0.22 1.42 -0.99 3.11 1.08 -0.83 0.59 117.51 122.10 5at1 h ILE 92 Ca 0.01 -1.45 0.23 0.00 -0.39 0.00 0.00 64.86 63.27 5at1 h ILE 92 Cb 0.90 2.24 -0.09 0.00 -3.07 0.00 0.00 36.82 36.81 5at1 h ILE 92 CO 0.07 0.40 0.63 0.28 -0.69 0.00 0.00 178.15 178.85 5at1 h SER 93 N -0.32 0.53 0.01 1.72 0.02 -0.66 -0.12 113.55 114.74 5at1 h SER 93 Ca 0.00 0.08 -0.00 0.00 -0.84 0.00 0.00 61.79 61.03 5at1 h SER 93 Cb 0.71 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.24 5at1 h SER 93 CO 0.03 0.16 -0.01 0.58 -1.14 0.00 0.00 176.83 176.45 5at1 h VAL 94 N 0.50 0.46 -0.12 2.27 2.07 -1.17 -3.38 116.25 116.87 5at1 h VAL 94 Ca 0.56 -1.32 0.03 0.00 0.82 0.00 0.00 66.70 66.79 5at1 h VAL 94 Cb 1.26 0.86 -0.00 0.00 -1.52 0.00 0.00 31.29 31.88 5at1 h VAL 94 CO -0.29 0.15 0.11 0.40 0.02 0.00 0.00 177.57 177.96 5at1 h ILE 95 N -1.00 0.67 0.00 4.57 2.04 -0.05 -1.36 117.51 122.38 5at1 h ILE 95 Ca -0.00 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.86 5at1 h ILE 95 Cb 0.26 0.92 0.00 0.00 -0.74 0.00 0.00 36.82 37.26 5at1 h ILE 95 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 178.15 176.61 5at1 n SER 96 N -4.09 0.00 -0.43 1.72 3.41 -0.13 -0.99 113.62 113.11 5at1 n SER 96 Ca -0.00 -0.29 0.14 0.00 -0.26 0.00 0.00 58.87 58.46 5at1 n SER 96 Cb 0.22 -0.17 0.46 0.00 -0.26 0.00 0.00 64.21 64.45 5at1 n SER 96 CO 0.00 0.00 0.00 1.07 -0.16 0.00 0.00 175.04 175.95 5at1 n THR 97 N -1.17 0.00 -0.01 6.66 5.66 -0.51 -4.59 114.28 120.31 5at1 n THR 97 Ca 0.13 -0.23 -0.03 0.00 -3.05 0.00 0.00 64.05 60.87 5at1 n THR 97 Cb 0.14 0.52 -0.01 0.00 -1.55 0.00 0.00 70.33 69.42 5at1 n THR 97 CO 0.00 0.00 0.00 -1.22 -3.05 0.00 0.00 175.07 170.80 5at1 n TYR 98 N -0.01 0.00 -3.22 1.09 4.01 -0.16 -5.11 117.16 113.77 5at1 n TYR 98 Ca 0.17 0.00 -0.19 0.00 -0.16 0.00 0.00 57.90 57.72 5at1 n TYR 98 Cb 0.36 -0.10 0.00 0.00 -0.31 0.00 0.00 39.34 39.29 5at1 n TYR 98 CO 0.00 0.00 0.00 0.14 -0.46 0.00 0.00 176.86 176.54 5at1 s VAL 99 N -2.05 2.76 -0.24 -0.72 -7.23 -1.06 -4.93 120.40 106.92 5at1 s VAL 99 Ca -0.04 -1.12 0.22 0.00 -1.81 0.00 0.00 61.98 59.23 5at1 s VAL 99 Cb 0.01 -2.88 -0.25 0.00 0.56 0.00 0.00 36.38 33.82 5at1 s VAL 99 CO 0.05 0.00 0.68 0.47 -0.31 0.00 0.00 175.10 175.99 5at1 n ASP 100 N -1.79 0.32 -3.50 4.85 8.00 -0.84 -4.84 116.55 118.73 5at1 n ASP 100 Ca 0.07 -0.09 -0.11 0.00 0.71 0.00 0.00 54.79 55.36 5at1 n ASP 100 Cb 0.60 1.51 -0.03 0.00 -0.02 0.00 0.00 41.12 43.18 5at1 n ASP 100 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 5at1 s ALA 101 N -3.40 -1.79 -0.24 2.24 0.00 -1.26 -4.35 121.76 112.98 5at1 s ALA 101 Ca -0.04 1.08 0.02 0.00 0.00 0.00 0.00 51.96 53.02 5at1 s ALA 101 Cb 0.14 0.20 0.05 0.00 0.00 0.00 0.00 23.12 23.51 5at1 s ALA 101 CO 0.87 -0.57 -0.10 0.42 0.00 0.00 0.00 175.76 176.39 5at1 s ILE 102 N -2.47 1.87 -0.21 0.00 1.01 -0.68 -1.75 121.20 118.97 5at1 s ILE 102 Ca -0.00 -1.35 -0.13 0.00 0.00 0.00 0.00 60.65 59.17 5at1 s ILE 102 Cb -0.01 -2.00 -0.05 0.00 0.01 0.00 0.00 42.46 40.42 5at1 s ILE 102 CO -0.04 0.02 0.26 -0.69 0.00 0.00 0.00 174.94 174.49 5at1 s VAL 103 N 1.26 5.30 -0.00 2.92 1.01 -0.52 -0.06 120.40 130.30 5at1 s VAL 103 Ca -0.06 0.43 0.00 0.00 0.00 0.00 0.00 61.98 62.36 5at1 s VAL 103 Cb -0.19 -3.60 0.00 0.00 0.00 0.00 0.00 36.38 32.60 5at1 s VAL 103 CO -0.06 0.33 -0.00 0.00 0.00 0.00 0.00 175.10 175.36 5at1 s MET 104 N 0.96 0.06 -0.05 2.72 0.00 0.09 -0.62 119.30 122.46 5at1 s MET 104 Ca 0.13 -0.00 0.05 0.00 0.00 0.00 0.00 55.69 55.87 5at1 s MET 104 Cb -0.14 -0.09 -0.02 0.00 0.00 0.00 0.00 34.83 34.59 5at1 s MET 104 CO 0.05 -0.01 -0.19 0.50 0.00 0.00 0.00 175.02 175.37 5at1 s ARG 105 N 0.12 2.51 -0.05 3.16 3.52 -0.86 -1.36 118.95 125.99 5at1 s ARG 105 Ca -0.01 -0.79 -0.14 0.00 -0.13 0.00 0.00 55.73 54.66 5at1 s ARG 105 Cb -0.02 -2.28 0.03 0.00 -1.56 0.00 0.00 34.95 31.12 5at1 s ARG 105 CO -0.00 0.51 0.32 -1.58 -0.81 0.00 0.00 175.30 173.74 5at1 s HIS 106 N -0.47 -0.24 -0.61 5.12 2.46 -0.44 -0.59 115.29 120.52 5at1 s HIS 106 Ca 0.06 0.47 0.16 0.00 0.47 0.00 0.00 55.06 56.22 5at1 s HIS 106 Cb -0.12 0.10 0.74 0.00 -0.13 0.00 0.00 32.58 33.18 5at1 s HIS 106 CO 0.01 -0.32 1.48 -0.35 -2.47 0.00 0.00 174.74 173.10 5at1 n PRO 107 N 1.83 0.10 -4.62 2.88 -0.04 -1.26 -1.18 135.00 132.70 5at1 n PRO 107 Ca -0.19 0.47 -0.28 0.00 -0.04 0.00 0.00 63.50 63.47 5at1 n PRO 107 Cb 0.57 -1.74 -0.14 0.00 -0.04 0.00 0.00 33.50 32.15 5at1 n PRO 107 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 5at1 s GLN 108 N -3.25 1.51 0.60 0.54 -0.21 -1.26 -4.18 119.66 113.41 5at1 s GLN 108 Ca 0.02 -1.16 -0.16 0.00 0.02 0.00 0.00 55.36 54.07 5at1 s GLN 108 Cb 0.06 -1.79 -0.03 0.00 1.00 0.00 0.00 33.01 32.25 5at1 s GLN 108 CO 0.22 0.45 1.09 -1.21 -2.12 0.00 0.00 175.29 173.71 5at1 s GLU 109 N -1.57 3.14 -1.49 2.91 8.01 -1.26 -3.19 118.70 125.25 5at1 s GLU 109 Ca 0.11 1.37 0.00 0.00 0.01 0.00 0.00 54.97 56.46 5at1 s GLU 109 Cb -0.10 -2.00 0.00 0.00 -4.31 0.00 0.00 34.13 27.73 5at1 s GLU 109 CO 0.04 -0.98 0.00 0.41 0.01 0.00 0.00 175.26 174.74 5at1 n GLY 110 N -0.52 1.43 0.22 -1.39 0.00 -1.26 -4.91 105.19 98.77 5at1 n GLY 110 Ca 0.10 -0.24 -0.16 0.00 0.00 0.00 0.00 46.02 45.71 5at1 n GLY 110 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 5at1 h ALA 111 N 0.00 0.34 0.00 4.61 0.00 -1.89 0.17 119.26 122.49 5at1 h ALA 111 Ca -0.29 -0.55 -0.04 0.00 0.00 0.00 0.00 54.91 54.03 5at1 h ALA 111 Cb 1.00 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 5at1 h ALA 111 CO 0.42 0.63 -0.18 0.00 0.00 0.00 0.00 179.25 180.12 5at1 h ALA 112 N 0.58 1.05 0.00 0.00 0.00 -1.91 -0.99 119.26 118.00 5at1 h ALA 112 Ca -0.03 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.71 5at1 h ALA 112 Cb 1.28 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.04 5at1 h ALA 112 CO 0.14 0.22 -0.03 -0.09 0.00 0.00 0.00 179.25 179.49 5at1 h ARG 113 N 0.00 0.01 -0.93 0.00 2.43 -1.90 -2.32 114.38 111.67 5at1 h ARG 113 Ca -0.00 -0.02 0.15 0.00 -0.81 0.00 0.00 59.98 59.30 5at1 h ARG 113 Cb 0.66 0.01 -0.08 0.00 -0.42 0.00 0.00 29.97 30.14 5at1 h ARG 113 CO 0.02 0.95 0.59 1.25 -1.51 0.00 0.00 179.97 181.28 5at1 h LEU 114 N -0.92 0.71 -0.61 3.80 6.46 -0.90 -2.55 115.31 121.30 5at1 h LEU 114 Ca -0.00 0.05 0.02 0.00 -0.12 0.00 0.00 57.88 57.83 5at1 h LEU 114 Cb 0.97 -0.09 -0.04 0.00 -0.73 0.00 0.00 40.66 40.77 5at1 h LEU 114 CO 0.01 0.34 0.38 0.00 -0.62 0.00 0.00 178.44 178.55 5at1 h ALA 115 N 1.59 0.79 -1.07 1.25 0.00 -1.12 -2.14 119.26 118.56 5at1 h ALA 115 Ca 0.48 -0.02 0.29 0.00 0.00 0.00 0.00 54.91 55.65 5at1 h ALA 115 Cb 0.74 -0.20 -0.08 0.00 0.00 0.00 0.00 17.79 18.24 5at1 h ALA 115 CO -0.24 0.14 0.71 1.15 0.00 0.00 0.00 179.25 181.00 5at1 h THR 116 N 0.76 0.49 0.00 0.00 2.02 -0.98 0.33 112.91 115.54 5at1 h THR 116 Ca 0.24 -0.10 -0.01 0.00 0.77 0.00 0.00 66.41 67.32 5at1 h THR 116 Cb -0.00 0.18 -0.00 0.00 -1.74 0.00 0.00 68.15 66.58 5at1 h THR 116 CO -0.09 0.05 -0.03 -0.33 0.37 0.00 0.00 175.52 175.49 5at1 h GLU 117 N 0.29 0.00 -0.01 6.66 5.08 -1.40 -3.25 114.58 121.95 5at1 h GLU 117 Ca 0.59 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.95 5at1 h GLU 117 Cb 1.70 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.95 5at1 h GLU 117 CO -0.23 0.03 -0.17 1.19 -1.00 0.00 0.00 179.01 178.83 5at1 n PHE 118 N -3.12 0.00 0.31 4.33 3.01 0.11 -4.67 117.46 117.42 5at1 n PHE 118 Ca 0.02 0.00 0.13 0.00 1.01 0.00 0.00 57.45 58.61 5at1 n PHE 118 Cb 0.40 0.00 0.61 0.00 -0.01 0.00 0.00 39.48 40.47 5at1 n PHE 118 CO 0.00 0.00 0.00 0.77 1.01 0.00 0.00 176.76 178.54 5at1 h SER 119 N 0.97 0.00 0.00 4.37 0.02 -1.29 -3.37 113.55 114.26 5at1 h SER 119 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 5at1 h SER 119 Cb 0.29 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.83 5at1 h SER 119 CO 0.00 0.00 0.00 0.61 -1.14 0.00 0.00 176.83 176.30 5at1 n GLY 120 N -0.43 1.67 0.93 -3.77 0.00 -1.26 -1.95 105.19 100.38 5at1 n GLY 120 Ca 0.01 -0.09 0.04 0.00 0.00 0.00 0.00 46.02 45.98 5at1 n GLY 120 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 5at1 n ASN 121 N 9.26 1.10 -4.59 1.61 6.94 -1.26 -5.00 115.26 123.32 5at1 n ASN 121 Ca 0.00 -2.56 -0.42 0.00 -0.02 0.00 0.00 54.58 51.58 5at1 n ASN 121 Cb 0.00 -0.35 -0.05 0.00 -2.36 0.00 0.00 39.78 37.02 5at1 n ASN 121 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 5at1 s VAL 122 N -1.06 4.79 0.28 3.53 1.01 -0.82 -5.03 120.40 123.10 5at1 s VAL 122 Ca 0.28 0.93 -0.30 0.00 0.00 0.00 0.00 61.98 62.89 5at1 s VAL 122 Cb 0.29 -4.15 -0.11 0.00 0.00 0.00 0.00 36.38 32.41 5at1 s VAL 122 CO -0.09 -0.34 1.55 -2.84 0.00 0.00 0.00 175.10 173.38 5at1 s PRO 123 N 2.96 4.17 -0.02 2.72 0.02 -1.26 -4.75 135.00 138.83 5at1 s PRO 123 Ca 0.30 2.49 -0.02 0.00 0.02 0.00 0.00 61.00 63.80 5at1 s PRO 123 Cb -0.14 -3.05 -0.04 0.00 0.02 0.00 0.00 34.50 31.29 5at1 s PRO 123 CO 0.15 -0.57 0.10 0.14 -0.33 0.00 0.00 177.00 176.48 5at1 s VAL 124 N 0.02 4.88 -0.07 3.83 -7.23 -1.26 -1.68 120.40 118.89 5at1 s VAL 124 Ca 0.62 -0.30 0.02 0.00 -1.81 0.00 0.00 61.98 60.51 5at1 s VAL 124 Cb -0.46 -3.22 0.02 0.00 0.56 0.00 0.00 36.38 33.28 5at1 s VAL 124 CO 0.46 0.39 -0.10 -0.76 -0.31 0.00 0.00 175.10 174.78 5at1 s LEU 125 N -1.63 1.53 -0.50 1.32 1.02 0.91 -3.19 118.68 118.13 5at1 s LEU 125 Ca 0.22 -0.27 -0.26 0.00 0.02 0.00 0.00 54.13 53.84 5at1 s LEU 125 Cb -0.12 -0.76 0.03 0.00 0.02 0.00 0.00 46.19 45.36 5at1 s LEU 125 CO 0.13 -0.00 0.99 0.21 0.02 0.00 0.00 176.35 177.69 5at1 s ASN 126 N 0.84 6.47 0.00 2.29 2.47 -1.04 -0.73 114.94 125.24 5at1 s ASN 126 Ca -0.12 0.06 0.24 0.00 0.42 0.00 0.00 52.86 53.46 5at1 s ASN 126 Cb -0.15 -2.47 0.58 0.00 -1.45 0.00 0.00 41.25 37.76 5at1 s ASN 126 CO 0.02 -1.17 1.47 0.00 -3.72 0.00 0.00 177.10 173.70 5at1 n ALA 127 N 7.48 2.49 0.00 1.71 0.00 -0.46 -4.20 120.51 127.52 5at1 n ALA 127 Ca 0.06 -0.69 0.00 0.00 0.00 0.00 0.00 53.44 52.82 5at1 n ALA 127 Cb 0.48 -0.98 0.00 0.00 0.00 0.00 0.00 19.45 18.96 5at1 n ALA 127 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 5at1 n GLY 128 N 1.30 3.27 2.84 0.00 0.00 -1.26 -4.83 105.19 106.51 5at1 n GLY 128 Ca 0.17 -0.27 -0.29 0.00 0.00 0.00 0.00 46.02 45.64 5at1 n GLY 128 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 5at1 s ASP 129 N 0.00 4.15 0.92 1.61 -4.77 -1.09 -1.33 116.67 116.17 5at1 s ASP 129 Ca 0.00 -3.28 0.00 0.00 -3.30 0.00 0.00 52.55 45.97 5at1 s ASP 129 Cb 0.00 -1.42 0.00 0.00 -1.09 0.00 0.00 42.92 40.41 5at1 s ASP 129 CO 0.00 -0.17 0.00 0.61 0.70 0.00 0.00 175.17 176.31 5at1 n GLY 130 N 2.72 2.22 1.62 2.12 0.00 -0.33 -1.21 105.19 112.33 5at1 n GLY 130 Ca 0.14 -0.49 0.04 0.00 0.00 0.00 0.00 46.02 45.70 5at1 n GLY 130 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 5at1 n SER 131 N 2.94 4.62 -0.01 1.61 3.41 -1.26 -4.66 113.62 120.28 5at1 n SER 131 Ca 0.00 -2.77 -0.00 0.00 -0.26 0.00 0.00 58.87 55.84 5at1 n SER 131 Cb 0.00 -0.66 -0.00 0.00 -0.26 0.00 0.00 64.21 63.29 5at1 n SER 131 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 5at1 n ASN 132 N 0.39 0.13 -4.21 4.04 5.15 -0.35 -4.89 115.26 115.52 5at1 n ASN 132 Ca 0.24 0.23 -0.12 0.00 -0.60 0.00 0.00 54.58 54.32 5at1 n ASN 132 Cb 1.03 -0.52 -0.10 0.00 -0.53 0.00 0.00 39.78 39.65 5at1 n ASN 132 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 5at1 s GLN 133 N -1.09 0.97 -0.45 1.20 -1.52 -1.26 -4.96 119.66 112.54 5at1 s GLN 133 Ca -0.01 -1.41 0.07 0.00 -1.95 0.00 0.00 55.36 52.05 5at1 s GLN 133 Cb 0.00 -0.37 0.27 0.00 -0.22 0.00 0.00 33.01 32.69 5at1 s GLN 133 CO 0.02 -0.00 0.88 1.58 -0.25 0.00 0.00 175.29 177.52 5at1 n HIS 134 N -0.13 -2.42 0.22 0.91 -0.00 -1.26 -2.66 115.22 109.87 5at1 n HIS 134 Ca -0.10 -2.34 0.05 0.00 0.46 0.00 0.00 57.72 55.79 5at1 n HIS 134 Cb 0.61 1.10 0.49 0.00 -0.12 0.00 0.00 29.99 32.07 5at1 n HIS 134 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 5at1 h PRO 135 N 3.63 0.00 0.00 1.57 0.13 -1.83 -1.89 132.00 133.61 5at1 h PRO 135 Ca -0.08 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.03 5at1 h PRO 135 Cb 1.02 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.15 5at1 h PRO 135 CO 0.31 0.22 -0.13 1.79 -0.23 0.00 0.00 178.00 179.96 5at1 h THR 136 N 0.00 0.80 -0.28 1.56 1.35 -1.96 -0.72 112.91 113.66 5at1 h THR 136 Ca -0.00 -0.49 -0.17 0.00 -0.55 0.00 0.00 66.41 65.20 5at1 h THR 136 Cb 0.39 1.29 0.00 0.00 -1.73 0.00 0.00 68.15 68.10 5at1 h THR 136 CO 0.03 0.12 -0.49 -0.61 -0.25 0.00 0.00 175.52 174.32 5at1 h GLN 137 N 0.00 0.83 -0.00 4.72 5.75 -1.70 -2.71 115.11 122.00 5at1 h GLN 137 Ca -0.00 -0.52 -0.16 0.00 -0.15 0.00 0.00 58.65 57.82 5at1 h GLN 137 Cb 0.28 0.06 -0.02 0.00 1.07 0.00 0.00 27.48 28.86 5at1 h GLN 137 CO 0.02 1.15 -0.75 1.15 -2.65 0.00 0.00 178.83 177.75 5at1 h THR 138 N 0.60 1.53 -0.23 2.39 2.02 -1.16 -0.30 112.91 117.76 5at1 h THR 138 Ca 0.02 -2.54 -0.07 0.00 0.77 0.00 0.00 66.41 64.59 5at1 h THR 138 Cb 1.10 2.37 -0.01 0.00 -1.74 0.00 0.00 68.15 69.87 5at1 h THR 138 CO 0.11 0.73 -0.15 -0.07 0.37 0.00 0.00 175.52 176.51 5at1 h LEU 139 N 0.01 0.53 -1.25 2.58 3.38 -1.32 0.66 115.31 119.90 5at1 h LEU 139 Ca -0.01 -0.43 -0.06 0.00 0.09 0.00 0.00 57.88 57.47 5at1 h LEU 139 Cb 1.32 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.92 5at1 h LEU 139 CO 0.10 0.85 -0.28 0.17 0.09 0.00 0.00 178.44 179.36 5at1 h LEU 140 N 0.22 0.00 -0.13 1.67 8.10 -1.29 0.01 115.31 123.90 5at1 h LEU 140 Ca 0.05 0.00 -0.08 0.00 0.11 0.00 0.00 57.88 57.96 5at1 h LEU 140 Cb 0.66 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.88 5at1 h LEU 140 CO 0.04 0.28 -0.24 0.44 -4.11 0.00 0.00 178.44 174.85 5at1 h ASP 141 N 0.00 0.43 -0.75 0.17 3.32 -0.50 -2.44 116.42 116.65 5at1 h ASP 141 Ca -0.00 -0.55 0.02 0.00 0.02 0.00 0.00 57.03 56.51 5at1 h ASP 141 Cb 0.70 -0.12 -0.04 0.00 0.22 0.00 0.00 39.33 40.08 5at1 h ASP 141 CO 0.04 0.90 0.49 -0.07 -1.72 0.00 0.00 179.24 178.87 5at1 h LEU 142 N -0.03 0.83 -1.04 1.55 3.38 -0.64 -0.59 115.31 118.78 5at1 h LEU 142 Ca 0.01 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 5at1 h LEU 142 Cb 0.83 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 41.34 5at1 h LEU 142 CO 0.05 0.59 0.45 0.15 0.09 0.00 0.00 178.44 179.77 5at1 h PHE 143 N 0.97 1.10 -0.01 1.13 3.04 -0.90 0.00 116.94 122.28 5at1 h PHE 143 Ca 0.28 -0.02 -0.15 0.00 3.98 0.00 0.00 57.97 62.06 5at1 h PHE 143 Cb -0.06 -0.35 -0.02 0.00 2.56 0.00 0.00 35.95 38.08 5at1 h PHE 143 CO -0.03 0.76 -0.71 1.15 -2.02 0.00 0.00 178.31 177.46 5at1 h THR 144 N 1.13 1.49 0.12 4.41 2.02 -1.04 0.14 112.91 121.18 5at1 h THR 144 Ca 0.29 -2.38 -0.01 0.00 0.77 0.00 0.00 66.41 65.08 5at1 h THR 144 Cb 0.02 2.28 0.00 0.00 -1.74 0.00 0.00 68.15 68.71 5at1 h THR 144 CO -0.05 0.68 -0.06 0.40 0.37 0.00 0.00 175.52 176.87 5at1 h ILE 145 N 0.03 1.06 -0.17 3.11 2.04 -0.34 -2.01 117.51 121.23 5at1 h ILE 145 Ca -0.01 -1.09 0.05 0.00 1.00 0.00 0.00 64.86 64.81 5at1 h ILE 145 Cb 1.25 1.70 -0.06 0.00 -0.74 0.00 0.00 36.82 38.98 5at1 h ILE 145 CO 0.10 0.25 -0.20 -0.61 0.00 0.00 0.00 178.15 177.68 5at1 h GLN 146 N -0.71 -0.23 0.00 2.37 4.15 -1.07 -0.33 115.11 119.29 5at1 h GLN 146 Ca -0.02 0.02 -0.07 0.00 0.77 0.00 0.00 58.65 59.34 5at1 h GLN 146 Cb 0.53 0.05 -0.01 0.00 0.21 0.00 0.00 27.48 28.26 5at1 h GLN 146 CO 0.03 -0.16 -0.35 0.37 -1.93 0.00 0.00 178.83 176.79 5at1 h GLN 147 N -0.24 0.00 0.00 1.69 4.15 -0.70 0.32 115.11 120.33 5at1 h GLN 147 Ca 0.11 0.00 -0.20 0.00 0.77 0.00 0.00 58.65 59.33 5at1 h GLN 147 Cb 0.41 0.00 -0.03 0.00 0.21 0.00 0.00 27.48 28.07 5at1 h GLN 147 CO -0.31 0.35 -1.12 1.79 -1.93 0.00 0.00 178.83 177.62 5at1 h THR 148 N 0.00 1.16 0.00 2.39 1.35 -1.12 -3.39 112.91 113.30 5at1 h THR 148 Ca -0.00 -2.79 0.00 0.00 -0.55 0.00 0.00 66.41 63.06 5at1 h THR 148 Cb 0.64 2.54 0.00 0.00 -1.73 0.00 0.00 68.15 69.60 5at1 h THR 148 CO 0.05 0.66 -1.36 -0.62 -0.25 0.00 0.00 175.52 174.00 5at1 n GLU 149 N -3.19 0.82 0.00 4.72 -0.58 -0.15 -5.01 120.64 117.24 5at1 n GLU 149 Ca -0.05 -0.09 0.00 0.00 -0.42 0.00 0.00 57.16 56.61 5at1 n GLU 149 Cb 0.91 -1.39 0.00 0.00 -0.57 0.00 0.00 31.44 30.38 5at1 n GLU 149 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 5at1 n GLY 150 N 1.44 2.09 3.81 0.62 0.00 0.11 -4.94 105.19 108.32 5at1 n GLY 150 Ca -0.00 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.97 5at1 n GLY 150 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 5at1 s ARG 151 N -0.33 1.44 0.00 1.61 1.70 -1.22 -4.99 118.95 117.16 5at1 s ARG 151 Ca 0.00 -0.86 0.00 0.00 -0.47 0.00 0.00 55.73 54.40 5at1 s ARG 151 Cb 0.00 0.45 0.00 0.00 -0.57 0.00 0.00 34.95 34.83 5at1 s ARG 151 CO 0.00 -0.67 0.79 1.28 -1.08 0.00 0.00 175.30 175.62 5at1 n LEU 152 N -0.54 1.46 -4.49 -1.89 4.77 -1.26 -3.96 117.00 111.08 5at1 n LEU 152 Ca -0.05 -1.46 -0.30 0.00 -0.03 0.00 0.00 56.01 54.17 5at1 n LEU 152 Cb 0.60 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.58 5at1 n LEU 152 CO 0.18 0.36 -0.49 -1.81 -1.33 0.00 0.00 177.39 174.31 5at1 s ASP 153 N -0.62 3.92 -1.32 -1.43 1.01 -1.26 -4.66 116.67 112.31 5at1 s ASP 153 Ca 0.00 -0.52 -0.05 0.00 0.71 0.00 0.00 52.55 52.69 5at1 s ASP 153 Cb 0.00 -0.58 0.02 0.00 1.01 0.00 0.00 42.92 43.36 5at1 s ASP 153 CO 0.00 0.19 1.01 0.59 0.21 0.00 0.00 175.17 177.17 5at1 n ASN 154 N 0.91 -3.76 -4.63 0.27 3.02 0.15 -4.90 115.26 106.31 5at1 n ASN 154 Ca -0.15 -0.65 -0.27 0.00 -0.03 0.00 0.00 54.58 53.48 5at1 n ASN 154 Cb 0.53 -4.75 -0.08 0.00 -0.61 0.00 0.00 39.78 34.87 5at1 n ASN 154 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 5at1 s LEU 155 N -6.87 3.22 -0.33 3.41 1.43 -1.26 -4.87 118.68 113.40 5at1 s LEU 155 Ca 0.29 -0.43 -0.00 0.00 -1.03 0.00 0.00 54.13 52.96 5at1 s LEU 155 Cb -0.14 -1.89 0.08 0.00 0.03 0.00 0.00 46.19 44.27 5at1 s LEU 155 CO 0.76 0.10 0.05 -1.00 0.23 0.00 0.00 176.35 176.49 5at1 s HIS 156 N -1.66 3.45 -0.15 0.29 3.76 -1.26 -1.56 115.29 118.16 5at1 s HIS 156 Ca 0.26 -2.30 -0.03 0.00 -0.15 0.00 0.00 55.06 52.85 5at1 s HIS 156 Cb -0.09 -2.54 -0.02 0.00 1.11 0.00 0.00 32.58 31.03 5at1 s HIS 156 CO 0.17 -0.89 -0.07 0.08 -0.85 0.00 0.00 174.74 173.19 5at1 s VAL 157 N 1.13 3.61 -0.09 -0.90 1.01 -0.11 -0.50 120.40 124.56 5at1 s VAL 157 Ca 0.01 -0.46 -0.02 0.00 0.00 0.00 0.00 61.98 61.51 5at1 s VAL 157 Cb -0.20 -2.57 -0.03 0.00 0.00 0.00 0.00 36.38 33.57 5at1 s VAL 157 CO -0.04 0.50 -0.00 0.00 0.00 0.00 0.00 175.10 175.56 5at1 s ALA 158 N 0.42 3.25 -0.10 5.51 0.00 0.36 -1.16 121.76 130.04 5at1 s ALA 158 Ca -0.06 -0.81 0.04 0.00 0.00 0.00 0.00 51.96 51.13 5at1 s ALA 158 Cb -0.15 -1.49 0.00 0.00 0.00 0.00 0.00 23.12 21.48 5at1 s ALA 158 CO 0.04 0.54 -0.23 -1.64 0.00 0.00 0.00 175.76 174.47 5at1 s MET 159 N -0.74 2.99 0.09 0.00 -1.94 -0.51 -0.45 119.30 118.74 5at1 s MET 159 Ca 0.11 -0.86 0.07 0.00 -1.71 0.00 0.00 55.69 53.31 5at1 s MET 159 Cb -0.12 -2.28 -0.03 0.00 2.01 0.00 0.00 34.83 34.41 5at1 s MET 159 CO 0.02 0.14 -0.18 0.08 -0.01 0.00 0.00 175.02 175.08 5at1 s VAL 160 N 0.43 1.44 0.00 -6.03 1.01 0.11 -1.68 120.40 115.68 5at1 s VAL 160 Ca -0.17 -1.47 0.00 0.00 0.00 0.00 0.00 61.98 60.34 5at1 s VAL 160 Cb -0.18 -1.36 0.00 0.00 0.00 0.00 0.00 36.38 34.84 5at1 s VAL 160 CO 0.07 -0.16 0.00 0.61 0.00 0.00 0.00 175.10 175.62 5at1 n GLY 161 N 1.10 0.46 3.14 4.51 0.00 -0.87 -1.30 105.19 112.23 5at1 n GLY 161 Ca -0.20 -1.39 -0.43 0.00 0.00 0.00 0.00 46.02 44.00 5at1 n GLY 161 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 5at1 n ASP 162 N 0.00 4.99 0.12 1.61 4.64 -1.26 -4.14 116.55 122.51 5at1 n ASP 162 Ca 0.00 -3.01 0.12 0.00 -1.38 0.00 0.00 54.79 50.52 5at1 n ASP 162 Cb 0.00 -1.56 0.47 0.00 -1.04 0.00 0.00 41.12 38.99 5at1 n ASP 162 CO 0.00 0.00 0.00 0.18 -0.82 0.00 0.00 177.20 176.56 5at1 n LEU 163 N 5.22 0.69 -0.02 -2.67 4.77 -0.90 -1.19 117.00 122.90 5at1 n LEU 163 Ca 0.41 0.65 -0.15 0.00 -0.03 0.00 0.00 56.01 56.88 5at1 n LEU 163 Cb 0.40 -0.53 -0.11 0.00 -2.33 0.00 0.00 43.42 40.85 5at1 n LEU 163 CO 0.75 -0.48 0.38 0.50 -1.33 0.00 0.00 177.39 177.21 5at1 h LYS 164 N 0.00 0.19 -0.00 3.23 3.64 -0.86 -3.40 116.57 119.37 5at1 h LYS 164 Ca 0.00 -0.20 0.00 0.00 -1.27 0.00 0.00 60.65 59.18 5at1 h LYS 164 Cb 0.44 0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.31 5at1 h LYS 164 CO 0.00 0.94 -0.53 0.66 -2.27 0.00 0.00 179.45 178.25 5at1 n TYR 165 N -4.48 0.00 -1.58 1.91 4.01 -1.21 -4.80 117.16 111.02 5at1 n TYR 165 Ca -0.10 0.00 -0.38 0.00 -0.16 0.00 0.00 57.90 57.26 5at1 n TYR 165 Cb 0.52 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.52 5at1 n TYR 165 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 5at1 s GLY 166 N -2.07 -0.12 0.28 2.72 0.00 -0.33 -4.85 107.32 102.95 5at1 s GLY 166 Ca 0.05 0.28 0.02 0.00 0.00 0.00 0.00 44.72 45.07 5at1 s GLY 166 CO 0.47 4.03 1.71 -0.09 0.00 0.00 0.00 173.10 179.22 5at1 h ARG 167 N 18.06 0.44 -0.17 2.90 2.43 -1.90 -2.88 114.38 133.27 5at1 h ARG 167 Ca -0.30 -0.03 -0.06 0.00 -0.81 0.00 0.00 59.98 58.79 5at1 h ARG 167 Cb 1.26 -0.10 -0.00 0.00 -0.42 0.00 0.00 29.97 30.70 5at1 h ARG 167 CO 1.09 0.29 -0.11 1.79 -1.51 0.00 0.00 179.97 181.52 5at1 h THR 168 N 0.46 1.33 -0.46 0.20 1.35 -1.96 -2.51 112.91 111.32 5at1 h THR 168 Ca 0.53 -1.22 -0.06 0.00 -0.55 0.00 0.00 66.41 65.11 5at1 h THR 168 Cb 0.94 1.76 -0.02 0.00 -1.73 0.00 0.00 68.15 69.11 5at1 h THR 168 CO -0.48 0.36 0.03 -0.37 -0.25 0.00 0.00 175.52 174.80 5at1 h VAL 169 N 0.03 1.23 -0.29 6.82 -1.51 -1.89 -1.40 116.25 119.24 5at1 h VAL 169 Ca 0.03 -0.92 -0.12 0.00 -1.23 0.00 0.00 66.70 64.47 5at1 h VAL 169 Cb 0.62 0.85 -0.00 0.00 -2.13 0.00 0.00 31.29 30.63 5at1 h VAL 169 CO 0.03 0.32 -0.28 0.45 -1.23 0.00 0.00 177.57 176.86 5at1 h HIS 170 N 0.69 0.85 -0.44 5.19 3.86 -1.54 -1.91 115.15 121.84 5at1 h HIS 170 Ca 0.14 -0.25 -0.01 0.00 -1.16 0.00 0.00 60.37 59.09 5at1 h HIS 170 Cb 0.39 -0.18 -0.02 0.00 1.06 0.00 0.00 27.41 28.66 5at1 h HIS 170 CO 0.02 1.00 0.25 0.77 0.86 0.00 0.00 177.93 180.83 5at1 h SER 171 N 0.46 0.55 -0.52 2.45 0.02 -1.03 -2.91 113.55 112.56 5at1 h SER 171 Ca 0.05 -0.08 -0.07 0.00 -0.84 0.00 0.00 61.79 60.85 5at1 h SER 171 Cb 0.85 -0.14 -0.02 0.00 0.14 0.00 0.00 62.40 63.23 5at1 h SER 171 CO 0.07 0.46 0.06 0.25 -1.14 0.00 0.00 176.83 176.53 5at1 h LEU 172 N 0.58 0.89 -0.17 5.07 5.85 -1.25 -1.45 115.31 124.84 5at1 h LEU 172 Ca 0.16 -0.21 -0.00 0.00 0.84 0.00 0.00 57.88 58.66 5at1 h LEU 172 Cb 0.03 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 40.82 5at1 h LEU 172 CO -0.03 0.92 0.10 0.74 -0.34 0.00 0.00 178.44 179.83 5at1 h THR 173 N 0.87 1.08 -0.08 1.05 2.02 -1.24 -0.71 112.91 115.91 5at1 h THR 173 Ca 0.17 -0.22 0.04 0.00 0.77 0.00 0.00 66.41 67.17 5at1 h THR 173 Cb 0.44 0.93 -0.05 0.00 -1.74 0.00 0.00 68.15 67.73 5at1 h THR 173 CO 0.02 0.08 -0.19 1.56 0.37 0.00 0.00 175.52 177.35 5at1 h GLN 174 N 0.19 -0.26 -0.05 6.66 4.20 -1.23 0.28 115.11 124.89 5at1 h GLN 174 Ca 0.06 0.02 0.03 0.00 0.06 0.00 0.00 58.65 58.82 5at1 h GLN 174 Cb 0.04 0.06 -0.04 0.00 0.30 0.00 0.00 27.48 27.84 5at1 h GLN 174 CO -0.01 -0.17 -0.16 0.00 -0.67 0.00 0.00 178.83 177.82 5at1 h ALA 175 N 0.70 -0.15 0.00 3.87 0.00 -1.17 -1.10 119.26 121.41 5at1 h ALA 175 Ca 0.08 0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.02 5at1 h ALA 175 Cb 0.39 0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.48 5at1 h ALA 175 CO -0.24 -0.64 0.00 1.28 0.00 0.00 0.00 179.25 179.66 5at1 n LEU 176 N -5.30 0.14 -0.94 0.00 4.77 -0.28 -1.52 117.00 113.88 5at1 n LEU 176 Ca -0.04 0.53 0.04 0.00 -0.03 0.00 0.00 56.01 56.51 5at1 n LEU 176 Cb 0.21 -0.51 0.17 0.00 -2.33 0.00 0.00 43.42 40.96 5at1 n LEU 176 CO 0.24 -0.26 0.56 0.00 -1.33 0.00 0.00 177.39 176.59 5at1 n ALA 177 N -1.56 2.89 0.64 -1.18 0.00 0.05 -2.91 120.51 118.44 5at1 n ALA 177 Ca 0.04 -0.75 0.08 0.00 0.00 0.00 0.00 53.44 52.81 5at1 n ALA 177 Cb 0.21 -1.03 0.06 0.00 0.00 0.00 0.00 19.45 18.70 5at1 n ALA 177 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 5at1 n LYS 178 N 0.34 1.13 -4.35 0.00 5.02 -0.57 -5.02 118.16 114.70 5at1 n LYS 178 Ca 0.12 -1.39 -0.24 0.00 -2.02 0.00 0.00 58.31 54.78 5at1 n LYS 178 Cb 0.53 -1.29 -0.08 0.00 -0.02 0.00 0.00 35.03 34.17 5at1 n LYS 178 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 5at1 s PHE 179 N -1.28 2.54 0.01 2.13 0.08 -1.14 -4.89 117.98 115.42 5at1 s PHE 179 Ca 0.18 -0.31 -0.17 0.00 0.12 0.00 0.00 56.93 56.75 5at1 s PHE 179 Cb 0.13 -1.21 -0.06 0.00 -0.57 0.00 0.00 43.02 41.31 5at1 s PHE 179 CO 0.19 0.61 0.48 -0.51 -0.10 0.00 0.00 175.22 175.90 5at1 s ASP 180 N -3.64 6.89 0.00 1.36 1.01 -1.26 -4.45 116.67 116.57 5at1 s ASP 180 Ca 0.32 1.05 0.00 0.00 0.71 0.00 0.00 52.55 54.63 5at1 s ASP 180 Cb -0.04 -2.30 0.00 0.00 1.01 0.00 0.00 42.92 41.59 5at1 s ASP 180 CO 0.18 0.25 0.00 0.61 0.21 0.00 0.00 175.17 176.42 5at1 n GLY 181 N 2.04 0.78 3.77 0.21 0.00 -1.26 0.32 105.19 111.05 5at1 n GLY 181 Ca -0.11 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.52 5at1 n GLY 181 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 5at1 s ASN 182 N -2.92 6.66 -0.11 1.61 0.01 -1.26 -4.17 114.94 114.75 5at1 s ASN 182 Ca 0.00 2.38 0.01 0.00 -0.71 0.00 0.00 52.86 54.55 5at1 s ASN 182 Cb 0.00 -2.62 0.02 0.00 0.41 0.00 0.00 41.25 39.06 5at1 s ASN 182 CO 0.00 -0.58 -0.14 -0.60 -1.51 0.00 0.00 177.10 174.27 5at1 s ARG 183 N -2.12 2.05 -0.07 -0.60 6.06 -0.60 -3.82 118.95 119.84 5at1 s ARG 183 Ca 0.54 -0.49 0.02 0.00 -2.50 0.00 0.00 55.73 53.30 5at1 s ARG 183 Cb -0.32 -1.79 -0.03 0.00 0.06 0.00 0.00 34.95 32.87 5at1 s ARG 183 CO 0.41 -0.09 -0.11 -0.06 -2.50 0.00 0.00 175.30 172.94 5at1 s PHE 184 N 1.08 2.81 -0.27 5.12 0.40 -0.19 -0.93 117.98 126.00 5at1 s PHE 184 Ca -0.05 -0.16 -0.01 0.00 -0.60 0.00 0.00 56.93 56.11 5at1 s PHE 184 Cb -0.15 -1.70 0.04 0.00 0.51 0.00 0.00 43.02 41.73 5at1 s PHE 184 CO -0.02 0.18 -0.06 0.71 0.70 0.00 0.00 175.22 176.73 5at1 s TYR 185 N -0.58 3.16 -0.29 0.36 1.51 -0.31 -0.57 117.35 120.62 5at1 s TYR 185 Ca 0.08 -1.83 -0.15 0.00 -1.01 0.00 0.00 57.07 54.16 5at1 s TYR 185 Cb -0.12 -2.04 -0.03 0.00 -0.11 0.00 0.00 41.96 39.67 5at1 s TYR 185 CO 0.02 -0.79 0.38 -0.06 -1.11 0.00 0.00 175.55 173.98 5at1 s PHE 186 N 1.25 3.23 -0.30 2.71 0.08 0.12 -1.43 117.98 123.64 5at1 s PHE 186 Ca -0.03 0.29 0.03 0.00 0.12 0.00 0.00 56.93 57.33 5at1 s PHE 186 Cb -0.18 -2.63 0.08 0.00 -0.57 0.00 0.00 43.02 39.72 5at1 s PHE 186 CO -0.04 -0.30 -0.03 0.42 -0.10 0.00 0.00 175.22 175.17 5at1 s ILE 187 N 2.09 2.31 0.14 0.64 1.09 -0.68 -1.20 121.20 125.59 5at1 s ILE 187 Ca 0.15 -1.93 -0.11 0.00 -1.10 0.00 0.00 60.65 57.66 5at1 s ILE 187 Cb -0.16 -2.51 0.00 0.00 -1.06 0.00 0.00 42.46 38.73 5at1 s ILE 187 CO 0.11 -0.29 0.30 0.00 -0.10 0.00 0.00 174.94 174.96 5at1 s ALA 188 N 1.03 -0.33 0.53 9.38 0.00 -1.26 -2.04 121.76 129.07 5at1 s ALA 188 Ca 0.00 -0.59 -0.21 0.00 0.00 0.00 0.00 51.96 51.16 5at1 s ALA 188 Cb -0.20 0.72 -0.05 0.00 0.00 0.00 0.00 23.12 23.59 5at1 s ALA 188 CO -0.06 -0.63 1.25 -2.14 0.00 0.00 0.00 175.76 174.19 5at1 s PRO 189 N -3.90 3.31 0.27 0.00 0.02 -1.26 -4.89 135.00 128.55 5at1 s PRO 189 Ca 0.10 1.97 -0.00 0.00 0.02 0.00 0.00 61.00 63.09 5at1 s PRO 189 Cb 0.03 -2.22 0.59 0.00 0.02 0.00 0.00 34.50 32.91 5at1 s PRO 189 CO -0.06 -0.97 1.71 0.22 -0.33 0.00 0.00 177.00 177.57 5at1 h ASP 190 N 1.52 0.27 0.28 2.53 1.82 -2.00 0.23 116.42 121.08 5at1 h ASP 190 Ca -0.50 0.14 0.00 0.00 -0.39 0.00 0.00 57.03 56.27 5at1 h ASP 190 Cb 1.28 0.12 0.00 0.00 0.68 0.00 0.00 39.33 41.41 5at1 h ASP 190 CO 0.58 0.04 0.00 0.00 -1.61 0.00 0.00 179.24 178.25 5at1 h ALA 191 N 1.64 1.00 -1.10 -0.78 0.00 -2.01 -3.27 119.26 114.75 5at1 h ALA 191 Ca 0.49 0.00 -0.41 0.00 0.00 0.00 0.00 54.91 54.99 5at1 h ALA 191 Cb 0.84 0.00 -0.40 0.00 0.00 0.00 0.00 17.79 18.23 5at1 h ALA 191 CO -0.48 0.00 -1.10 1.28 0.00 0.00 0.00 179.25 178.95 5at1 n LEU 192 N -2.35 2.12 -4.92 0.00 4.77 0.79 -4.95 117.00 112.47 5at1 n LEU 192 Ca -0.00 -4.01 -0.27 0.00 -0.03 0.00 0.00 56.01 51.69 5at1 n LEU 192 Cb 0.11 0.25 0.08 0.00 -2.33 0.00 0.00 43.42 41.53 5at1 n LEU 192 CO 0.14 1.69 0.70 0.00 -1.33 0.00 0.00 177.39 178.59 5at1 s ALA 193 N -3.22 2.92 -0.05 -1.18 0.00 -1.11 -2.10 121.76 117.02 5at1 s ALA 193 Ca 0.31 -0.82 -0.30 0.00 0.00 0.00 0.00 51.96 51.15 5at1 s ALA 193 Cb 0.45 -2.75 -0.05 0.00 0.00 0.00 0.00 23.12 20.77 5at1 s ALA 193 CO -0.01 -1.50 1.44 1.41 0.00 0.00 0.00 175.76 177.10 5at1 s MET 194 N -5.41 4.24 0.31 0.00 1.75 -1.26 -2.07 119.30 116.86 5at1 s MET 194 Ca 0.61 1.96 -0.28 0.00 -1.25 0.00 0.00 55.69 56.74 5at1 s MET 194 Cb -0.11 -3.73 -0.13 0.00 2.84 0.00 0.00 34.83 33.70 5at1 s MET 194 CO 0.47 -0.68 1.03 -2.30 -0.65 0.00 0.00 175.02 172.89 5at1 n PRO 195 N 6.15 1.43 -0.24 4.11 -0.02 -1.26 -4.84 135.00 140.32 5at1 n PRO 195 Ca 0.14 0.50 0.05 0.00 -2.02 0.00 0.00 63.50 62.18 5at1 n PRO 195 Cb 0.44 -1.91 0.17 0.00 -0.02 0.00 0.00 33.50 32.18 5at1 n PRO 195 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 5at1 h GLU 196 N 1.98 0.27 -0.31 -0.52 4.57 -2.00 -2.36 114.58 116.21 5at1 h GLU 196 Ca -0.41 -0.02 0.04 0.00 -1.18 0.00 0.00 59.36 57.80 5at1 h GLU 196 Cb 1.33 -0.06 -0.02 0.00 -0.16 0.00 0.00 28.75 29.85 5at1 h GLU 196 CO 0.60 0.18 0.21 0.10 -1.18 0.00 0.00 179.01 178.92 5at1 h TYR 197 N 0.28 0.23 -0.11 0.92 -0.00 -1.98 0.66 116.97 116.97 5at1 h TYR 197 Ca 0.40 0.01 -0.00 0.00 -0.00 0.00 0.00 58.73 59.14 5at1 h TYR 197 Cb 0.67 -0.08 -0.01 0.00 -0.00 0.00 0.00 36.73 37.32 5at1 h TYR 197 CO -0.25 0.13 0.07 0.82 -0.00 0.00 0.00 178.16 178.92 5at1 h ILE 198 N 0.23 1.05 -0.26 -0.90 1.08 -1.78 -0.69 117.51 116.26 5at1 h ILE 198 Ca 0.13 -0.14 -0.01 0.00 -0.39 0.00 0.00 64.86 64.46 5at1 h ILE 198 Cb 0.23 0.95 -0.01 0.00 -3.07 0.00 0.00 36.82 34.92 5at1 h ILE 198 CO -0.02 0.05 0.14 -0.07 -0.69 0.00 0.00 178.15 177.56 5at1 h LEU 199 N 0.12 0.32 -1.15 1.44 3.38 -1.12 -0.06 115.31 118.24 5at1 h LEU 199 Ca 0.04 -0.09 -0.02 0.00 0.09 0.00 0.00 57.88 57.90 5at1 h LEU 199 Cb 0.02 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 40.66 5at1 h LEU 199 CO -0.01 0.32 0.30 0.44 0.09 0.00 0.00 178.44 179.58 5at1 h ASP 200 N 0.30 0.81 -0.43 -0.43 3.32 -0.76 0.37 116.42 119.60 5at1 h ASP 200 Ca 0.09 -0.08 -0.03 0.00 0.02 0.00 0.00 57.03 57.03 5at1 h ASP 200 Cb 0.07 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.39 5at1 h ASP 200 CO -0.01 0.69 0.14 -0.03 -1.72 0.00 0.00 179.24 178.31 5at1 h MET 201 N 0.90 0.66 -0.87 3.56 1.85 -0.62 -1.84 114.93 118.56 5at1 h MET 201 Ca 0.22 -0.14 0.07 0.00 -0.61 0.00 0.00 59.70 59.24 5at1 h MET 201 Cb 0.09 -0.10 -0.06 0.00 0.43 0.00 0.00 31.60 31.97 5at1 h MET 201 CO -0.03 0.64 0.57 -0.07 -0.40 0.00 0.00 176.91 177.61 5at1 h LEU 202 N 0.55 0.84 -0.24 3.39 3.38 0.09 -2.10 115.31 121.22 5at1 h LEU 202 Ca 0.14 0.01 -0.21 0.00 0.09 0.00 0.00 57.88 57.91 5at1 h LEU 202 Cb 0.24 -0.17 0.01 0.00 0.09 0.00 0.00 40.66 40.83 5at1 h LEU 202 CO -0.01 0.53 -0.71 0.44 0.09 0.00 0.00 178.44 178.78 5at1 h ASP 203 N 0.95 0.88 -0.14 -0.43 3.32 -0.65 -0.99 116.42 119.35 5at1 h ASP 203 Ca 0.38 -0.55 0.04 0.00 0.02 0.00 0.00 57.03 56.92 5at1 h ASP 203 Cb 0.25 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.54 5at1 h ASP 203 CO -0.14 1.33 0.15 -0.33 -1.72 0.00 0.00 179.24 178.53 5at1 h GLU 204 N 0.53 0.00 -0.02 3.56 5.08 -0.64 -0.29 114.58 122.79 5at1 h GLU 204 Ca -0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 5at1 h GLU 204 Cb 1.33 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.58 5at1 h GLU 204 CO 0.15 0.00 -0.02 1.63 -1.00 0.00 0.00 179.01 179.77 5at1 n LYS 205 N -3.85 2.08 -1.80 2.33 5.02 -1.11 -4.97 118.16 115.86 5at1 n LYS 205 Ca 0.00 -1.59 -0.08 0.00 -2.02 0.00 0.00 58.31 54.63 5at1 n LYS 205 Cb 0.26 -1.47 -0.01 0.00 -0.02 0.00 0.00 35.03 33.79 5at1 n LYS 205 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 5at1 n GLY 206 N 1.30 0.39 3.70 0.72 0.00 -0.12 -5.02 105.19 106.17 5at1 n GLY 206 Ca 0.15 -0.62 -0.40 0.00 0.00 0.00 0.00 46.02 45.16 5at1 n GLY 206 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 5at1 s ILE 207 N -2.34 5.04 -0.07 -0.61 1.01 -0.38 -5.02 121.20 118.83 5at1 s ILE 207 Ca 0.00 1.38 -0.29 0.00 0.00 0.00 0.00 60.65 61.74 5at1 s ILE 207 Cb 0.00 -4.02 -0.02 0.00 0.01 0.00 0.00 42.46 38.44 5at1 s ILE 207 CO 0.00 0.22 0.98 0.00 0.00 0.00 0.00 174.94 176.14 5at1 s ALA 208 N 1.07 3.31 0.05 9.38 0.00 -1.25 -4.62 121.76 129.70 5at1 s ALA 208 Ca 0.35 0.42 0.00 0.00 0.00 0.00 0.00 51.96 52.74 5at1 s ALA 208 Cb -0.17 -3.38 -0.03 0.00 0.00 0.00 0.00 23.12 19.54 5at1 s ALA 208 CO 0.16 -0.45 -0.04 1.67 0.00 0.00 0.00 175.76 177.09 5at1 s TRP 209 N 1.61 0.52 -0.07 0.00 1.48 -1.26 -1.02 118.94 120.20 5at1 s TRP 209 Ca 0.49 -0.78 -0.16 0.00 -1.06 0.00 0.00 56.10 54.60 5at1 s TRP 209 Cb -0.19 -0.35 0.03 0.00 -1.16 0.00 0.00 33.47 31.80 5at1 s TRP 209 CO 0.22 -0.23 0.37 -1.54 -4.06 0.00 0.00 176.95 171.70 5at1 s SER 210 N -2.26 -0.32 -0.01 -2.66 1.04 0.26 -4.93 113.70 104.82 5at1 s SER 210 Ca -0.02 0.42 -0.20 0.00 0.48 0.00 0.00 55.95 56.63 5at1 s SER 210 Cb -0.01 0.53 -0.05 0.00 0.10 0.00 0.00 66.02 66.59 5at1 s SER 210 CO -0.05 -0.33 0.57 -0.76 0.98 0.00 0.00 173.24 173.65 5at1 s LEU 211 N -0.69 4.41 0.10 2.42 1.43 -1.26 0.16 118.68 125.25 5at1 s LEU 211 Ca -0.08 1.11 0.04 0.00 -1.03 0.00 0.00 54.13 54.18 5at1 s LEU 211 Cb -0.04 -2.88 -0.04 0.00 0.03 0.00 0.00 46.19 43.27 5at1 s LEU 211 CO 0.03 0.11 -0.11 -1.00 0.23 0.00 0.00 176.35 175.61 5at1 s HIS 212 N -0.17 1.11 -0.04 0.29 3.76 -0.34 -4.91 115.29 115.00 5at1 s HIS 212 Ca 0.30 -0.62 -0.19 0.00 -0.15 0.00 0.00 55.06 54.40 5at1 s HIS 212 Cb -0.18 -0.61 -0.32 0.00 1.11 0.00 0.00 32.58 32.59 5at1 s HIS 212 CO 0.16 0.03 0.85 0.77 -0.85 0.00 0.00 174.74 175.70 5at1 h SER 213 N 3.64 0.55 -5.52 1.40 0.02 -1.92 -3.36 113.55 108.36 5at1 h SER 213 Ca -0.38 -0.93 -0.21 0.00 -0.84 0.00 0.00 61.79 59.43 5at1 h SER 213 Cb 1.19 -0.18 -0.15 0.00 0.14 0.00 0.00 62.40 63.40 5at1 h SER 213 CO 0.51 1.53 -0.63 -0.94 -1.14 0.00 0.00 176.83 176.16 5at1 s SER 214 N -7.14 0.22 0.07 3.07 1.04 -1.26 -4.68 113.70 105.01 5at1 s SER 214 Ca -0.14 -1.31 -0.23 0.00 0.48 0.00 0.00 55.95 54.75 5at1 s SER 214 Cb 0.02 0.34 -0.15 0.00 0.10 0.00 0.00 66.02 66.34 5at1 s SER 214 CO 0.85 -0.79 1.64 0.40 0.98 0.00 0.00 173.24 176.32 5at1 h ILE 215 N 2.73 1.09 0.00 -1.02 2.04 -1.91 -3.10 117.51 117.35 5at1 h ILE 215 Ca -0.36 -0.27 0.00 0.00 1.00 0.00 0.00 64.86 65.23 5at1 h ILE 215 Cb 1.23 1.23 0.00 0.00 -0.74 0.00 0.00 36.82 38.54 5at1 h ILE 215 CO 0.56 0.07 0.00 -1.84 0.00 0.00 0.00 178.15 176.94 5at1 n GLU 216 N -5.01 0.02 0.20 2.37 0.00 -1.26 -1.34 120.64 115.62 5at1 n GLU 216 Ca -0.07 0.31 0.08 0.00 0.00 0.00 0.00 57.16 57.48 5at1 n GLU 216 Cb 0.08 -1.50 0.30 0.00 0.00 0.00 0.00 31.44 30.32 5at1 n GLU 216 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.13 178.06 5at1 h GLU 217 N 0.00 0.00 0.00 3.44 5.08 -1.97 -3.34 114.58 117.79 5at1 h GLU 217 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 5at1 h GLU 217 Cb 0.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.27 5at1 h GLU 217 CO 0.00 0.27 -0.22 1.33 -1.00 0.00 0.00 179.01 179.39 5at1 n VAL 218 N -3.28 0.00 -0.18 3.13 0.24 -0.45 -4.87 118.33 112.92 5at1 n VAL 218 Ca 0.01 -0.37 0.03 0.00 -2.04 0.00 0.00 64.34 61.98 5at1 n VAL 218 Cb 0.53 0.88 0.08 0.00 -1.47 0.00 0.00 33.84 33.86 5at1 n VAL 218 CO 0.00 0.00 0.00 0.80 -2.14 0.00 0.00 176.83 175.49 5at1 n MET 219 N -1.06 -0.05 0.19 7.34 0.00 -0.76 -0.26 117.12 122.53 5at1 n MET 219 Ca 0.00 0.80 0.13 0.00 0.00 0.00 0.00 57.70 58.63 5at1 n MET 219 Cb 0.00 -1.20 0.33 0.00 0.00 0.00 0.00 33.22 32.35 5at1 n MET 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 5at1 h ALA 220 N 1.03 1.00 0.00 -5.12 0.00 -1.86 -3.30 119.26 111.01 5at1 h ALA 220 Ca 0.25 0.00 -0.13 0.00 0.00 0.00 0.00 54.91 55.03 5at1 h ALA 220 Cb 0.39 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 5at1 h ALA 220 CO -0.53 0.00 -1.44 0.39 0.00 0.00 0.00 179.25 177.67 5at1 n GLU 221 N -2.83 0.63 -2.65 0.00 1.02 0.64 -4.50 120.64 112.94 5at1 n GLU 221 Ca 0.04 0.15 -0.42 0.00 -0.02 0.00 0.00 57.16 56.90 5at1 n GLU 221 Cb 0.45 -1.77 -0.03 0.00 -0.02 0.00 0.00 31.44 30.07 5at1 n GLU 221 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 5at1 s VAL 222 N -3.05 4.70 -0.16 2.62 1.01 -1.14 -4.76 120.40 119.61 5at1 s VAL 222 Ca -0.03 1.94 -0.20 0.00 0.00 0.00 0.00 61.98 63.69 5at1 s VAL 222 Cb 0.09 -4.24 -0.23 0.00 0.00 0.00 0.00 36.38 32.00 5at1 s VAL 222 CO 0.82 0.14 0.40 0.44 0.00 0.00 0.00 175.10 176.90 5at1 h ASP 223 N 6.84 0.15 -4.04 3.32 3.32 -1.15 -3.42 116.42 121.44 5at1 h ASP 223 Ca -0.40 -0.72 -0.67 0.00 0.02 0.00 0.00 57.03 55.26 5at1 h ASP 223 Cb 1.21 -0.05 -0.31 0.00 0.22 0.00 0.00 39.33 40.40 5at1 h ASP 223 CO 0.77 1.50 -0.88 -0.63 -1.72 0.00 0.00 179.24 178.28 5at1 s ILE 224 N -2.39 1.96 -0.42 0.35 -1.09 -1.15 -2.40 121.20 116.04 5at1 s ILE 224 Ca -0.24 -1.02 0.02 0.00 -2.23 0.00 0.00 60.65 57.18 5at1 s ILE 224 Cb 0.04 -1.65 0.12 0.00 -1.58 0.00 0.00 42.46 39.38 5at1 s ILE 224 CO 0.67 0.55 0.17 -0.22 -1.23 0.00 0.00 174.94 174.87 5at1 s LEU 225 N -0.17 4.78 -0.55 2.97 1.98 -0.12 -0.49 118.68 127.09 5at1 s LEU 225 Ca -0.03 -2.42 -0.21 0.00 -2.89 0.00 0.00 54.13 48.58 5at1 s LEU 225 Cb -0.13 -1.69 0.06 0.00 0.66 0.00 0.00 46.19 45.09 5at1 s LEU 225 CO 0.03 -0.37 0.78 -0.47 -1.89 0.00 0.00 176.35 174.44 5at1 s TYR 226 N 0.54 2.91 0.14 5.38 6.14 0.40 -1.63 117.35 131.24 5at1 s TYR 226 Ca 0.13 -0.40 -0.13 0.00 0.64 0.00 0.00 57.07 57.30 5at1 s TYR 226 Cb -0.22 -3.86 -0.07 0.00 0.42 0.00 0.00 41.96 38.24 5at1 s TYR 226 CO -0.05 -1.25 0.52 -1.64 0.64 0.00 0.00 175.55 173.78 5at1 s MET 227 N 3.27 3.93 0.22 4.97 -1.94 -0.46 0.10 119.30 129.39 5at1 s MET 227 Ca 0.21 0.42 0.07 0.00 -1.71 0.00 0.00 55.69 54.68 5at1 s MET 227 Cb -0.17 -2.93 -0.05 0.00 2.01 0.00 0.00 34.83 33.69 5at1 s MET 227 CO 0.14 0.48 -0.11 -0.08 -0.01 0.00 0.00 175.02 175.44 5at1 s THR 228 N -1.47 1.60 -0.24 2.05 -1.32 -0.42 -4.23 115.64 111.60 5at1 s THR 228 Ca 0.37 -2.16 -0.25 0.00 -1.21 0.00 0.00 61.69 58.44 5at1 s THR 228 Cb -0.15 -2.15 -0.00 0.00 -1.51 0.00 0.00 72.50 68.69 5at1 s THR 228 CO 0.19 -0.51 0.86 0.00 -2.21 0.00 0.00 174.62 172.95 5at1 s ARG 229 N -3.69 4.19 -0.14 7.08 1.04 -1.26 -4.56 118.95 121.61 5at1 s ARG 229 Ca 0.24 1.00 -0.29 0.00 -1.04 0.00 0.00 55.73 55.64 5at1 s ARG 229 Cb 0.01 -3.64 -0.01 0.00 -2.04 0.00 0.00 34.95 29.27 5at1 s ARG 229 CO 0.08 -0.53 1.07 0.08 -0.04 0.00 0.00 175.30 175.95 5at1 s VAL 230 N 2.89 4.63 -0.36 4.99 1.01 -1.26 -4.61 120.40 127.69 5at1 s VAL 230 Ca 0.36 1.93 -0.21 0.00 0.00 0.00 0.00 61.98 64.06 5at1 s VAL 230 Cb -0.15 -4.24 0.00 0.00 0.00 0.00 0.00 36.38 31.99 5at1 s VAL 230 CO 0.07 -0.06 0.65 -1.10 0.00 0.00 0.00 175.10 174.66 5at1 s GLN 231 N 2.51 3.69 0.17 2.72 -0.21 -1.26 -4.96 119.66 122.32 5at1 s GLN 231 Ca 0.49 0.08 -0.18 0.00 0.02 0.00 0.00 55.36 55.76 5at1 s GLN 231 Cb -0.19 -3.81 0.11 0.00 1.00 0.00 0.00 33.01 30.13 5at1 s GLN 231 CO 0.15 -0.74 1.64 0.87 -2.12 0.00 0.00 175.29 175.08 5at1 h LYS 232 N 8.46 -0.09 0.00 2.91 6.56 -1.94 -2.64 116.57 129.84 5at1 h LYS 232 Ca -0.26 0.01 0.00 0.00 -1.06 0.00 0.00 60.65 59.33 5at1 h LYS 232 Cb 1.11 0.02 0.00 0.00 -0.57 0.00 0.00 32.23 32.79 5at1 h LYS 232 CO 0.84 -0.06 0.00 -0.85 -2.06 0.00 0.00 179.45 177.32 5at1 n GLU 233 N -5.37 0.08 -0.18 3.15 0.00 -1.26 -1.43 120.64 115.63 5at1 n GLU 233 Ca 0.03 0.26 0.11 0.00 0.00 0.00 0.00 57.16 57.56 5at1 n GLU 233 Cb 0.28 -1.50 0.25 0.00 0.00 0.00 0.00 31.44 30.47 5at1 n GLU 233 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.13 177.67 5at1 n ARG 234 N -1.36 2.33 -4.07 3.44 1.74 -0.99 -4.92 116.66 112.83 5at1 n ARG 234 Ca 0.03 -2.02 -0.11 0.00 -0.77 0.00 0.00 57.85 54.98 5at1 n ARG 234 Cb 0.08 -1.48 -0.11 0.00 -1.02 0.00 0.00 32.46 29.92 5at1 n ARG 234 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 5at1 s LEU 235 N -1.46 2.34 0.29 0.55 1.02 -0.52 -5.12 118.68 115.78 5at1 s LEU 235 Ca 0.37 -0.69 -0.29 0.00 0.02 0.00 0.00 54.13 53.54 5at1 s LEU 235 Cb 0.21 -0.05 -0.10 0.00 0.02 0.00 0.00 46.19 46.27 5at1 s LEU 235 CO 0.30 -0.32 1.37 -0.62 0.02 0.00 0.00 176.35 177.09 5at1 s ASP 236 N -2.04 6.72 0.40 2.29 2.15 -1.26 -4.86 116.67 120.08 5at1 s ASP 236 Ca -0.04 2.66 0.23 0.00 0.43 0.00 0.00 52.55 55.83 5at1 s ASP 236 Cb -0.05 -2.64 1.25 0.00 -0.30 0.00 0.00 42.92 41.19 5at1 s ASP 236 CO -0.02 -0.61 1.67 -0.65 -0.17 0.00 0.00 175.17 175.38 5at1 h PRO 237 N 4.25 0.21 0.00 4.34 0.11 -1.99 0.12 132.00 139.04 5at1 h PRO 237 Ca -0.47 -0.01 -0.14 0.00 0.11 0.00 0.00 66.00 65.48 5at1 h PRO 237 Cb 1.22 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 32.26 5at1 h PRO 237 CO 0.72 0.14 -0.68 0.77 -0.21 0.00 0.00 178.00 178.74 5at1 h SER 238 N 0.22 0.00 0.05 -2.05 0.02 -1.98 -3.02 113.55 106.79 5at1 h SER 238 Ca 0.74 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 61.69 5at1 h SER 238 Cb 2.06 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.60 5at1 h SER 238 CO -0.45 0.68 -0.02 -0.08 -1.14 0.00 0.00 176.83 175.81 5at1 h GLU 239 N 0.00 -0.07 0.38 3.45 4.81 -1.18 -2.95 114.58 119.02 5at1 h GLU 239 Ca -0.01 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.22 5at1 h GLU 239 Cb 1.44 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 30.80 5at1 h GLU 239 CO 0.09 0.53 -0.41 -0.92 -0.73 0.00 0.00 179.01 177.56 5at1 h TYR 240 N -0.74 -1.14 0.00 0.92 5.03 -1.39 -2.79 116.97 116.85 5at1 h TYR 240 Ca -0.01 0.01 0.00 0.00 2.58 0.00 0.00 58.73 61.31 5at1 h TYR 240 Cb 0.62 0.45 0.00 0.00 1.55 0.00 0.00 36.73 39.35 5at1 h TYR 240 CO 0.14 -0.56 0.00 0.00 -1.32 0.00 0.00 178.16 176.42 5at1 n ALA 241 N -2.73 1.37 -1.00 1.82 0.00 -1.14 -4.19 120.51 114.63 5at1 n ALA 241 Ca -0.10 0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.43 5at1 n ALA 241 Cb 0.40 -1.29 0.00 0.00 0.00 0.00 0.00 19.45 18.56 5at1 n ALA 241 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 5at1 n ASN 242 N -2.04 0.00 -3.06 0.00 2.85 -1.06 -4.90 115.26 107.06 5at1 n ASN 242 Ca 0.01 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.48 5at1 n ASN 242 Cb 0.13 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.15 5at1 n ASN 242 CO 0.00 0.00 0.00 0.52 -2.11 0.00 0.00 177.26 175.67 5at1 n VAL 243 N 0.00 0.00 0.00 3.44 0.31 -1.23 -4.38 118.33 116.47 5at1 n VAL 243 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 5at1 n VAL 243 Cb 0.00 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 32.93 5at1 n VAL 243 CO 0.00 0.00 0.00 2.29 -1.32 0.00 0.00 176.83 177.80 5at1 n LYS 244 N -0.72 0.00 -0.42 5.55 0.00 -1.26 0.07 118.16 121.38 5at1 n LYS 244 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.31 5at1 n LYS 244 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 35.03 5at1 n LYS 244 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 5at1 n ALA 245 N 0.00 1.83 -1.12 0.58 0.00 -1.26 -5.15 120.51 115.38 5at1 n ALA 245 Ca 0.00 -0.39 0.15 0.00 0.00 0.00 0.00 53.44 53.20 5at1 n ALA 245 Cb 0.00 -0.18 -0.04 0.00 0.00 0.00 0.00 19.45 19.23 5at1 n ALA 245 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 5at1 n GLN 246 N 0.00 -2.24 -2.60 0.00 1.13 0.11 -4.70 117.38 109.08 5at1 n GLN 246 Ca 0.00 1.52 -0.27 0.00 -1.94 0.00 0.00 57.00 56.31 5at1 n GLN 246 Cb 0.57 -2.75 -0.01 0.00 0.11 0.00 0.00 30.24 28.16 5at1 n GLN 246 CO 0.00 0.00 0.00 1.19 -1.44 0.00 0.00 177.06 176.81 5at1 n PHE 247 N -3.42 3.57 -4.22 1.08 3.01 -1.26 -4.89 117.46 111.33 5at1 n PHE 247 Ca -0.00 -3.34 -0.27 0.00 1.01 0.00 0.00 57.45 54.84 5at1 n PHE 247 Cb 0.63 -0.18 -0.08 0.00 -0.01 0.00 0.00 39.48 39.83 5at1 n PHE 247 CO 0.00 0.00 0.00 0.14 1.01 0.00 0.00 176.76 177.91 5at1 s VAL 248 N -5.26 3.58 -0.06 -4.37 -7.23 -1.26 -4.87 120.40 100.93 5at1 s VAL 248 Ca 0.48 -1.40 -0.02 0.00 -1.81 0.00 0.00 61.98 59.22 5at1 s VAL 248 Cb 0.37 -2.77 -0.04 0.00 0.56 0.00 0.00 36.38 34.51 5at1 s VAL 248 CO -0.18 -0.05 0.07 -0.22 -0.31 0.00 0.00 175.10 174.41 5at1 s LEU 249 N -2.73 3.90 0.05 1.32 2.96 0.32 -4.99 118.68 119.50 5at1 s LEU 249 Ca 0.26 0.22 -0.01 0.00 -0.22 0.00 0.00 54.13 54.38 5at1 s LEU 249 Cb -0.10 -2.07 -0.04 0.00 0.50 0.00 0.00 46.19 44.48 5at1 s LEU 249 CO 0.17 0.34 -0.03 -0.60 -1.32 0.00 0.00 176.35 174.91 5at1 s ARG 250 N -1.28 0.61 0.29 1.98 3.52 -1.26 -0.69 118.95 122.12 5at1 s ARG 250 Ca 0.18 -1.20 -0.03 0.00 -0.13 0.00 0.00 55.73 54.55 5at1 s ARG 250 Cb -0.12 0.18 0.42 0.00 -1.56 0.00 0.00 34.95 33.87 5at1 s ARG 250 CO 0.08 -0.10 1.96 0.00 -0.81 0.00 0.00 175.30 176.42 5at1 h ALA 251 N 3.21 1.39 0.00 6.12 0.00 -1.88 -3.09 119.26 125.02 5at1 h ALA 251 Ca -0.34 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.45 5at1 h ALA 251 Cb 1.14 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 5at1 h ALA 251 CO 0.65 0.56 -0.29 0.66 0.00 0.00 0.00 179.25 180.83 5at1 h SER 252 N 1.16 0.00 1.08 0.00 4.64 -1.98 -0.54 113.55 117.91 5at1 h SER 252 Ca 0.32 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.64 5at1 h SER 252 Cb -0.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 61.97 5at1 h SER 252 CO -0.07 0.29 0.00 0.44 -0.87 0.00 0.00 176.83 176.62 5at1 h ASP 253 N 0.00 0.00 -0.06 4.97 3.32 -1.98 -1.68 116.42 120.99 5at1 h ASP 253 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 5at1 h ASP 253 Cb 0.55 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.10 5at1 h ASP 253 CO 0.04 0.00 0.00 0.18 -1.72 0.00 0.00 179.24 177.74 5at1 n LEU 254 N -3.07 0.75 0.22 1.55 4.77 -0.21 -4.15 117.00 116.86 5at1 n LEU 254 Ca 0.01 -0.30 0.08 0.00 -0.03 0.00 0.00 56.01 55.77 5at1 n LEU 254 Cb 0.32 -0.04 0.51 0.00 -2.33 0.00 0.00 43.42 41.88 5at1 n LEU 254 CO 0.27 0.15 0.83 1.12 -1.33 0.00 0.00 177.39 178.44 5at1 h HIS 255 N 1.02 0.00 -0.38 -1.77 2.07 -1.39 -2.95 115.15 111.75 5at1 h HIS 255 Ca 0.00 0.00 -0.14 0.00 -2.85 0.00 0.00 60.37 57.38 5at1 h HIS 255 Cb 0.22 0.00 -0.08 0.00 2.57 0.00 0.00 27.41 30.12 5at1 h HIS 255 CO 0.04 0.25 0.02 0.27 -3.07 0.00 0.00 177.93 175.44 5at1 n ASN 256 N -3.76 3.19 -4.84 3.10 6.94 -1.26 -4.98 115.26 113.65 5at1 n ASN 256 Ca -0.01 -3.46 -0.35 0.00 -0.02 0.00 0.00 54.58 50.74 5at1 n ASN 256 Cb 0.35 -0.62 -0.06 0.00 -2.36 0.00 0.00 39.78 37.09 5at1 n ASN 256 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 5at1 s ALA 257 N -3.09 3.59 0.80 -2.53 0.00 -1.12 -3.59 121.76 115.83 5at1 s ALA 257 Ca 0.45 -0.15 -0.14 0.00 0.00 0.00 0.00 51.96 52.13 5at1 s ALA 257 Cb 0.39 -2.50 0.07 0.00 0.00 0.00 0.00 23.12 21.08 5at1 s ALA 257 CO 0.05 0.46 1.15 1.63 0.00 0.00 0.00 175.76 179.05 5at1 n LYS 258 N 0.88 0.22 -0.15 0.00 5.02 -1.26 -4.93 118.16 117.94 5at1 n LYS 258 Ca -0.06 0.15 -0.02 0.00 -2.02 0.00 0.00 58.31 56.35 5at1 n LYS 258 Cb 0.52 -2.40 0.06 0.00 -0.02 0.00 0.00 35.03 33.19 5at1 n LYS 258 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 5at1 h ALA 259 N -0.82 0.48 0.00 7.82 0.00 -1.96 -2.72 119.26 122.05 5at1 h ALA 259 Ca -0.46 0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.58 5at1 h ALA 259 Cb 1.30 0.23 0.00 0.00 0.00 0.00 0.00 17.79 19.32 5at1 h ALA 259 CO 0.46 -0.37 0.00 0.27 0.00 0.00 0.00 179.25 179.60 5at1 n ASN 260 N -5.21 0.00 -4.74 0.00 6.94 -1.26 -4.92 115.26 106.08 5at1 n ASN 260 Ca 0.05 -0.54 -0.41 0.00 -0.02 0.00 0.00 54.58 53.66 5at1 n ASN 260 Cb 0.26 -0.10 -0.04 0.00 -2.36 0.00 0.00 39.78 37.53 5at1 n ASN 260 CO 0.00 0.00 0.00 -0.32 -1.03 0.00 0.00 177.26 175.91 5at1 s MET 261 N -2.21 4.62 -0.01 -3.83 1.75 -1.03 -4.87 119.30 113.72 5at1 s MET 261 Ca 0.33 1.66 0.05 0.00 -1.25 0.00 0.00 55.69 56.48 5at1 s MET 261 Cb 0.17 -3.30 -0.01 0.00 2.84 0.00 0.00 34.83 34.53 5at1 s MET 261 CO 0.33 0.11 -0.15 0.15 -0.65 0.00 0.00 175.02 174.81 5at1 s LYS 262 N -0.28 1.18 -0.38 4.11 -0.14 -1.01 -4.48 119.74 118.74 5at1 s LYS 262 Ca 0.49 -0.56 -0.15 0.00 -1.36 0.00 0.00 55.97 54.39 5at1 s LYS 262 Cb -0.28 -1.15 0.00 0.00 -1.68 0.00 0.00 37.83 34.72 5at1 s LYS 262 CO 0.34 0.31 0.32 0.08 -0.76 0.00 0.00 175.35 175.63 5at1 s VAL 263 N -0.40 5.22 0.12 3.17 1.01 0.62 -0.94 120.40 129.20 5at1 s VAL 263 Ca 0.05 -0.36 0.02 0.00 0.00 0.00 0.00 61.98 61.69 5at1 s VAL 263 Cb -0.06 -3.87 -0.04 0.00 0.00 0.00 0.00 36.38 32.42 5at1 s VAL 263 CO -0.00 -0.21 0.24 -0.76 0.00 0.00 0.00 175.10 174.37 5at1 s LEU 264 N 1.82 4.26 -0.29 3.92 1.02 -0.64 -2.46 118.68 126.32 5at1 s LEU 264 Ca 0.08 0.16 -0.14 0.00 0.02 0.00 0.00 54.13 54.24 5at1 s LEU 264 Cb -0.18 -2.85 0.13 0.00 0.02 0.00 0.00 46.19 43.31 5at1 s LEU 264 CO 0.11 0.09 0.82 -2.28 0.02 0.00 0.00 176.35 175.11 5at1 s HIS 265 N -1.66 -0.93 0.58 0.29 2.46 -1.26 -1.36 115.29 113.41 5at1 s HIS 265 Ca 0.34 1.72 0.27 0.00 0.47 0.00 0.00 55.06 57.87 5at1 s HIS 265 Cb -0.12 0.56 1.58 0.00 -0.13 0.00 0.00 32.58 34.47 5at1 s HIS 265 CO 0.28 -0.46 2.07 -1.00 -2.47 0.00 0.00 174.74 173.16 5at1 h PRO 266 N 7.14 0.00 -0.62 2.88 0.13 -1.94 -3.45 132.00 136.13 5at1 h PRO 266 Ca -0.23 0.00 0.06 0.00 -0.87 0.00 0.00 66.00 64.96 5at1 h PRO 266 Cb 1.16 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.26 5at1 h PRO 266 CO 0.14 0.00 -0.22 1.28 -0.23 0.00 0.00 178.00 178.97 5at1 n LEU 267 N -3.92 -0.18 -4.43 1.56 4.77 -1.26 -5.01 117.00 108.53 5at1 n LEU 267 Ca 0.03 0.42 -0.37 0.00 -0.03 0.00 0.00 56.01 56.06 5at1 n LEU 267 Cb 0.38 -0.61 0.06 0.00 -2.33 0.00 0.00 43.42 40.92 5at1 n LEU 267 CO 0.29 -0.41 -0.06 -0.81 -1.33 0.00 0.00 177.39 175.07 5at1 n PRO 268 N -2.51 0.29 -4.28 3.23 -0.04 -1.26 -5.03 135.00 125.41 5at1 n PRO 268 Ca -0.02 0.13 -0.19 0.00 -0.04 0.00 0.00 63.50 63.38 5at1 n PRO 268 Cb 0.12 -1.70 -0.13 0.00 -0.04 0.00 0.00 33.50 31.76 5at1 n PRO 268 CO 0.00 0.00 0.00 0.50 -0.04 0.00 0.00 175.50 175.96 5at1 s ARG 269 N -2.47 0.89 0.00 0.54 3.00 -1.26 -4.74 118.95 114.92 5at1 s ARG 269 Ca 0.64 -0.85 0.00 0.00 -1.00 0.00 0.00 55.73 54.52 5at1 s ARG 269 Cb -0.37 -0.91 0.00 0.00 0.00 0.00 0.00 34.95 33.67 5at1 s ARG 269 CO 0.59 0.22 0.00 1.55 0.00 0.00 0.00 175.30 177.66 5at1 n VAL 270 N 1.62 0.00 0.02 7.11 3.14 -1.26 -5.04 118.33 123.93 5at1 n VAL 270 Ca -0.19 0.00 -0.02 0.00 -2.96 0.00 0.00 64.34 61.17 5at1 n VAL 270 Cb 0.54 0.00 -0.01 0.00 -1.06 0.00 0.00 33.84 33.31 5at1 n VAL 270 CO 0.00 0.00 0.00 -2.24 -6.46 0.00 0.00 176.83 168.13 5at1 h ASP 271 N 0.00 -0.11 0.00 6.55 2.03 -1.96 -3.40 116.42 119.53 5at1 h ASP 271 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 5at1 h ASP 271 Cb 0.00 0.03 0.00 0.00 -0.83 0.00 0.00 39.33 38.53 5at1 h ASP 271 CO 0.00 0.24 0.34 1.05 -1.03 0.00 0.00 179.24 179.84 5at1 h GLU 272 N -0.78 0.00 -3.84 4.15 9.09 -1.92 -3.38 114.58 117.90 5at1 h GLU 272 Ca -0.01 0.00 -0.43 0.00 0.05 0.00 0.00 59.36 58.96 5at1 h GLU 272 Cb 0.10 0.00 -0.37 0.00 -1.65 0.00 0.00 28.75 26.83 5at1 h GLU 272 CO 0.02 0.00 -0.77 0.42 0.05 0.00 0.00 179.01 178.73 5at1 s ILE 273 N -3.36 0.47 0.31 -1.06 1.01 -1.26 -0.53 121.20 116.78 5at1 s ILE 273 Ca -0.01 0.02 -0.17 0.00 0.00 0.00 0.00 60.65 60.48 5at1 s ILE 273 Cb 0.04 -0.58 -0.09 0.00 0.01 0.00 0.00 42.46 41.84 5at1 s ILE 273 CO 0.12 0.26 0.75 0.00 0.00 0.00 0.00 174.94 176.07 5at1 s ALA 274 N 1.63 3.32 0.55 9.38 0.00 0.14 -4.79 121.76 131.98 5at1 s ALA 274 Ca 0.00 0.11 0.48 0.00 0.00 0.00 0.00 51.96 52.55 5at1 s ALA 274 Cb -0.13 -2.82 1.71 0.00 0.00 0.00 0.00 23.12 21.88 5at1 s ALA 274 CO -0.04 0.31 1.59 1.15 0.00 0.00 0.00 175.76 178.78 5at1 h THR 275 N 2.15 0.04 0.00 0.00 2.02 -1.93 -0.23 112.91 114.95 5at1 h THR 275 Ca -0.48 -0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.70 5at1 h THR 275 Cb 1.18 0.04 0.00 0.00 -1.74 0.00 0.00 68.15 67.63 5at1 h THR 275 CO 0.65 0.00 0.00 -2.24 0.37 0.00 0.00 175.52 174.30 5at1 h ASP 276 N 0.00 0.00 0.71 4.18 -0.00 -1.95 -1.63 116.42 117.73 5at1 h ASP 276 Ca 0.91 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.94 5at1 h ASP 276 Cb 3.59 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 42.92 5at1 h ASP 276 CO -0.05 0.00 0.00 0.58 -0.00 0.00 0.00 179.24 179.77 5at1 h VAL 277 N 0.00 0.00 -0.04 4.15 2.07 -1.37 -3.12 116.25 117.94 5at1 h VAL 277 Ca 0.00 -0.25 -0.22 0.00 0.82 0.00 0.00 66.70 67.05 5at1 h VAL 277 Cb 0.65 1.00 0.02 0.00 -1.52 0.00 0.00 31.29 31.43 5at1 h VAL 277 CO 0.00 0.00 -0.85 0.44 0.02 0.00 0.00 177.57 177.18 5at1 h ASP 278 N 0.00 0.81 -0.15 0.57 3.45 -1.45 -2.92 116.42 116.73 5at1 h ASP 278 Ca 0.00 -0.72 0.00 0.00 0.43 0.00 0.00 57.03 56.74 5at1 h ASP 278 Cb 0.36 -0.25 0.00 0.00 -0.56 0.00 0.00 39.33 38.88 5at1 h ASP 278 CO 0.00 1.41 0.00 2.29 -1.57 0.00 0.00 179.24 181.37 5at1 n LYS 279 N -3.99 1.36 -3.49 3.56 2.85 -1.18 -4.70 118.16 112.58 5at1 n LYS 279 Ca -0.10 -0.56 -0.32 0.00 -1.05 0.00 0.00 58.31 56.28 5at1 n LYS 279 Cb 0.79 -1.14 -0.05 0.00 -0.65 0.00 0.00 35.03 33.98 5at1 n LYS 279 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 177.40 178.30 5at1 s THR 280 N -1.80 5.00 0.64 0.58 -4.23 -1.10 -4.95 115.64 109.78 5at1 s THR 280 Ca 0.12 0.35 0.27 0.00 -1.18 0.00 0.00 61.69 61.25 5at1 s THR 280 Cb 0.06 -3.62 0.30 0.00 1.34 0.00 0.00 72.50 70.58 5at1 s THR 280 CO 0.08 -0.03 1.83 -0.65 -0.54 0.00 0.00 174.62 175.31 5at1 h PRO 281 N 2.64 0.00 -0.01 3.99 0.11 -1.87 -2.53 132.00 134.34 5at1 h PRO 281 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 5at1 h PRO 281 Cb 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 5at1 h PRO 281 CO 0.70 0.00 -0.10 0.72 -0.21 0.00 0.00 178.00 179.11 5at1 n HIS 282 N -3.11 0.00 -2.41 0.65 8.25 -1.26 -4.77 115.22 112.57 5at1 n HIS 282 Ca 0.02 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 57.05 5at1 n HIS 282 Cb 0.53 -0.13 -0.02 0.00 1.12 0.00 0.00 29.99 31.49 5at1 n HIS 282 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 5at1 s ALA 283 N -2.35 3.30 0.00 -1.41 0.00 -0.95 -0.28 121.76 120.07 5at1 s ALA 283 Ca 0.32 0.04 0.00 0.00 0.00 0.00 0.00 51.96 52.32 5at1 s ALA 283 Cb 0.20 -3.81 0.00 0.00 0.00 0.00 0.00 23.12 19.52 5at1 s ALA 283 CO 0.45 -1.89 0.60 1.87 0.00 0.00 0.00 175.76 176.78 5at1 n TRP 284 N 7.84 0.00 0.09 0.00 -0.00 -1.03 -4.89 117.44 119.45 5at1 n TRP 284 Ca 0.15 -0.16 -0.07 0.00 -0.00 0.00 0.00 57.50 57.43 5at1 n TRP 284 Cb 0.47 -0.02 0.06 0.00 -0.00 0.00 0.00 31.31 31.83 5at1 n TRP 284 CO 0.00 0.00 0.00 0.10 -0.00 0.00 0.00 177.69 177.79 5at1 h TYR 285 N 0.00 0.29 -0.24 5.87 -0.00 -1.86 0.18 116.97 121.21 5at1 h TYR 285 Ca 0.00 -0.13 -0.20 0.00 0.00 0.00 0.00 58.73 58.40 5at1 h TYR 285 Cb 0.70 -0.04 0.00 0.00 0.00 0.00 0.00 36.73 37.39 5at1 h TYR 285 CO 0.00 0.86 -0.62 0.74 -0.00 0.00 0.00 178.16 179.14 5at1 h PHE 286 N 0.14 1.07 -0.04 0.10 0.04 -1.90 -2.47 116.94 113.89 5at1 h PHE 286 Ca -0.02 -0.41 -0.07 0.00 2.80 0.00 0.00 57.97 60.27 5at1 h PHE 286 Cb 1.28 -0.19 -0.01 0.00 2.20 0.00 0.00 35.95 39.23 5at1 h PHE 286 CO 0.02 1.24 -0.29 1.96 -0.60 0.00 0.00 178.31 180.65 5at1 h GLN 287 N 0.62 0.06 -0.90 1.51 7.50 -1.90 -1.31 115.11 120.70 5at1 h GLN 287 Ca -0.01 -0.02 0.02 0.00 0.50 0.00 0.00 58.65 59.15 5at1 h GLN 287 Cb 1.23 -0.01 -0.05 0.00 0.05 0.00 0.00 27.48 28.71 5at1 h GLN 287 CO 0.13 0.35 0.60 0.37 -1.50 0.00 0.00 178.83 178.78 5at1 h GLN 288 N 0.06 1.13 -0.19 1.46 4.15 -0.89 -1.29 115.11 119.54 5at1 h GLN 288 Ca 0.01 -0.07 -0.06 0.00 0.77 0.00 0.00 58.65 59.30 5at1 h GLN 288 Cb 0.54 -0.26 -0.00 0.00 0.21 0.00 0.00 27.48 27.97 5at1 h GLN 288 CO 0.04 0.75 -0.13 0.00 -1.93 0.00 0.00 178.83 177.56 5at1 h ALA 289 N 1.46 0.27 -0.82 3.38 0.00 -0.78 -3.05 119.26 119.72 5at1 h ALA 289 Ca 0.35 -0.31 0.17 0.00 0.00 0.00 0.00 54.91 55.12 5at1 h ALA 289 Cb -0.05 -0.06 -0.11 0.00 0.00 0.00 0.00 17.79 17.58 5at1 h ALA 289 CO -0.09 0.14 0.34 0.78 0.00 0.00 0.00 179.25 180.41 5at1 h GLY 290 N 0.10 1.30 1.80 0.00 0.00 -1.28 -0.46 103.07 104.53 5at1 h GLY 290 Ca 0.04 -0.16 0.00 0.00 0.00 0.00 0.00 47.33 47.21 5at1 h GLY 290 CO 0.04 -0.15 0.00 0.70 0.00 0.00 0.00 176.54 177.12 5at1 n ASN 291 N -5.01 0.00 -0.33 0.19 5.03 -0.50 -2.23 115.26 112.41 5at1 n ASN 291 Ca 0.17 0.29 -0.02 0.00 0.87 0.00 0.00 54.58 55.90 5at1 n ASN 291 Cb 0.50 -0.40 0.14 0.00 -1.02 0.00 0.00 39.78 39.00 5at1 n ASN 291 CO 0.00 0.00 0.00 1.23 -1.83 0.00 0.00 177.26 176.66 5at1 h GLY 292 N 2.71 1.31 0.95 7.41 0.00 -1.08 -1.99 103.07 112.38 5at1 h GLY 292 Ca 0.00 -0.51 -0.00 0.00 0.00 0.00 0.00 47.33 46.82 5at1 h GLY 292 CO 0.00 0.50 -0.08 -2.22 0.00 0.00 0.00 176.54 174.73 5at1 h ILE 293 N 1.26 0.82 -0.56 2.60 1.08 -1.59 0.20 117.51 121.32 5at1 h ILE 293 Ca 0.34 0.00 -0.10 0.00 -0.39 0.00 0.00 64.86 64.71 5at1 h ILE 293 Cb -0.12 0.82 -0.02 0.00 -3.07 0.00 0.00 36.82 34.44 5at1 h ILE 293 CO -0.07 0.00 -0.04 -0.26 -0.69 0.00 0.00 178.15 177.09 5at1 h PHE 294 N -0.21 1.11 0.68 1.37 0.04 -1.70 0.21 116.94 118.43 5at1 h PHE 294 Ca -0.01 -0.21 -0.03 0.00 2.80 0.00 0.00 57.97 60.52 5at1 h PHE 294 Cb 0.18 -0.28 0.01 0.00 2.20 0.00 0.00 35.95 38.05 5at1 h PHE 294 CO -0.09 1.01 -0.33 0.00 -0.60 0.00 0.00 178.31 178.31 5at1 h ALA 295 N 0.95 -0.91 -0.73 2.45 0.00 -1.16 -1.12 119.26 118.74 5at1 h ALA 295 Ca 0.15 -0.21 0.07 0.00 0.00 0.00 0.00 54.91 54.92 5at1 h ALA 295 Cb 0.59 0.35 -0.05 0.00 0.00 0.00 0.00 17.79 18.69 5at1 h ALA 295 CO 0.04 -0.96 0.48 0.00 0.00 0.00 0.00 179.25 178.81 5at1 h ARG 296 N -1.02 0.70 -0.31 0.00 -0.00 -0.49 -2.11 114.38 111.15 5at1 h ARG 296 Ca -0.09 -0.04 -0.04 0.00 -0.50 0.00 0.00 59.98 59.30 5at1 h ARG 296 Cb 0.72 -0.16 -0.01 0.00 0.00 0.00 0.00 29.97 30.53 5at1 h ARG 296 CO 0.15 0.46 0.02 1.96 0.00 0.00 0.00 179.97 182.56 5at1 h GLN 297 N 0.72 0.53 -0.00 0.04 4.20 -0.49 -1.60 115.11 118.51 5at1 h GLN 297 Ca 0.32 -0.16 0.02 0.00 0.06 0.00 0.00 58.65 58.89 5at1 h GLN 297 Cb 0.32 -0.05 -0.02 0.00 0.30 0.00 0.00 27.48 28.03 5at1 h GLN 297 CO -0.11 0.66 -0.10 0.00 -0.67 0.00 0.00 178.83 178.61 5at1 h ALA 298 N 0.85 -0.10 -0.33 3.87 0.00 -0.75 0.08 119.26 122.87 5at1 h ALA 298 Ca 0.09 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 5at1 h ALA 298 Cb 0.41 0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 5at1 h ALA 298 CO 0.01 -0.59 0.19 1.25 0.00 0.00 0.00 179.25 180.11 5at1 h LEU 299 N -0.17 0.41 -1.30 0.00 5.85 -1.27 0.12 115.31 118.95 5at1 h LEU 299 Ca 0.04 -0.07 -0.04 0.00 0.84 0.00 0.00 57.88 58.65 5at1 h LEU 299 Cb 0.21 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.12 5at1 h LEU 299 CO -0.10 0.36 0.06 -0.07 -0.34 0.00 0.00 178.44 178.35 5at1 h LEU 300 N 0.42 0.49 -0.14 2.25 3.38 -1.27 -2.62 115.31 117.83 5at1 h LEU 300 Ca 0.12 -0.07 -0.06 0.00 0.09 0.00 0.00 57.88 57.96 5at1 h LEU 300 Cb 0.04 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 40.66 5at1 h LEU 300 CO -0.02 0.52 -0.14 0.00 0.09 0.00 0.00 178.44 178.89 5at1 h ALA 301 N 1.55 0.20 -0.34 1.53 0.00 0.12 -2.24 119.26 120.09 5at1 h ALA 301 Ca 0.12 -0.32 -0.06 0.00 0.00 0.00 0.00 54.91 54.64 5at1 h ALA 301 Cb 0.25 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 5at1 h ALA 301 CO 0.00 0.08 -0.04 -0.07 0.00 0.00 0.00 179.25 179.22 5at1 h LEU 302 N -0.04 0.62 -0.77 0.00 3.38 -1.10 0.38 115.31 117.77 5at1 h LEU 302 Ca 0.02 -0.33 -0.10 0.00 0.09 0.00 0.00 57.88 57.56 5at1 h LEU 302 Cb 0.67 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.24 5at1 h LEU 302 CO 0.03 0.80 -0.15 0.58 0.09 0.00 0.00 178.44 179.80 5at1 h VAL 303 N 0.42 1.26 -0.00 1.22 2.07 -1.53 -3.17 116.25 116.51 5at1 h VAL 303 Ca 0.09 -1.23 0.00 0.00 0.82 0.00 0.00 66.70 66.39 5at1 h VAL 303 Cb 0.51 1.10 0.00 0.00 -1.52 0.00 0.00 31.29 31.38 5at1 h VAL 303 CO 0.02 0.41 -0.75 0.18 0.02 0.00 0.00 177.57 177.46 5at1 n LEU 304 N -4.15 0.87 -4.12 2.57 4.77 -0.84 -0.33 117.00 115.76 5at1 n LEU 304 Ca 0.01 -0.31 -0.29 0.00 -0.03 0.00 0.00 56.01 55.39 5at1 n LEU 304 Cb 0.39 -0.10 -0.17 0.00 -2.33 0.00 0.00 43.42 41.21 5at1 n LEU 304 CO 0.43 0.21 -0.52 0.20 -1.33 0.00 0.00 177.39 176.39 5at1 s ASN 305 N -2.95 2.48 0.00 -1.43 0.01 0.13 -4.99 114.94 108.20 5at1 s ASN 305 Ca 0.10 -0.44 0.00 0.00 -0.71 0.00 0.00 52.86 51.82 5at1 s ASN 305 Cb 0.17 -1.14 0.00 0.00 0.41 0.00 0.00 41.25 40.69 5at1 s ASN 305 CO 0.77 0.09 0.84 -1.14 -1.51 0.00 0.00 177.10 176.16 5at1 n ARG 306 N 3.71 0.00 -4.41 -0.60 3.00 -1.26 -4.42 116.66 112.67 5at1 n ARG 306 Ca -0.21 0.66 -0.34 0.00 -0.00 0.00 0.00 57.85 57.96 5at1 n ARG 306 Cb 0.52 -1.34 -0.15 0.00 0.00 0.00 0.00 32.46 31.50 5at1 n ARG 306 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 5at1 s ASP 307 N -2.63 3.88 -0.31 6.15 1.01 -1.26 -0.60 116.67 122.91 5at1 s ASP 307 Ca 0.00 -0.42 -0.09 0.00 0.71 0.00 0.00 52.55 52.75 5at1 s ASP 307 Cb 0.00 -1.61 0.00 0.00 1.01 0.00 0.00 42.92 42.32 5at1 s ASP 307 CO 0.00 0.08 0.13 -0.22 0.21 0.00 0.00 175.17 175.37 5at1 s LEU 308 N 0.88 4.08 -0.33 1.23 2.96 -1.26 -5.02 118.68 121.22 5at1 s LEU 308 Ca -0.03 -0.64 -0.13 0.00 -0.22 0.00 0.00 54.13 53.11 5at1 s LEU 308 Cb -0.15 -1.96 -0.02 0.00 0.50 0.00 0.00 46.19 44.56 5at1 s LEU 308 CO -0.00 -0.21 0.24 -0.69 -1.32 0.00 0.00 176.35 174.37 5at1 s VAL 309 N 1.57 5.28 0.00 1.68 1.01 -1.26 -5.12 120.40 123.55 5at1 s VAL 309 Ca 0.04 -0.13 0.00 0.00 0.00 0.00 0.00 61.98 61.89 5at1 s VAL 309 Cb -0.17 -3.70 0.00 0.00 0.00 0.00 0.00 36.38 32.51 5at1 s VAL 309 CO 0.05 0.02 0.00 0.18 0.00 0.00 0.00 175.10 175.35