#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1za2 s ASN 2 N 0.00 5.10 0.21 0.00 2.20 -1.07 -4.87 114.94 116.50 1za2 s ASN 2 Ca 0.00 2.31 0.09 0.00 -0.94 0.00 0.00 52.86 54.32 1za2 s ASN 2 Cb 0.00 -2.59 0.51 0.00 -2.00 0.00 0.00 41.25 37.17 1za2 s ASN 2 CO 0.00 -1.65 1.17 -0.81 -2.94 0.00 0.00 177.10 172.87 1za2 n PRO 3 N -1.82 0.06 0.00 3.55 -0.04 -1.26 -1.70 135.00 133.79 1za2 n PRO 3 Ca 0.13 0.49 0.04 0.00 -0.04 0.00 0.00 63.50 64.12 1za2 n PRO 3 Cb 0.50 -1.92 0.01 0.00 -0.04 0.00 0.00 33.50 32.05 1za2 n PRO 3 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1za2 n LEU 4 N -1.81 1.27 -4.67 1.53 4.77 -1.26 -4.92 117.00 111.90 1za2 n LEU 4 Ca -0.01 -0.83 -0.53 0.00 -0.03 0.00 0.00 56.01 54.61 1za2 n LEU 4 Cb 0.23 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.26 1za2 n LEU 4 CO 0.04 0.26 1.25 0.00 -1.33 0.00 0.00 177.39 177.61 1za2 n TYR 5 N -0.07 2.02 -1.23 -1.77 -0.00 -0.69 -0.95 117.16 114.48 1za2 n TYR 5 Ca 0.04 0.40 -0.08 0.00 -0.00 0.00 0.00 57.90 58.26 1za2 n TYR 5 Cb 0.18 -2.49 -0.03 0.00 -0.00 0.00 0.00 39.34 37.00 1za2 n TYR 5 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 176.86 177.90 1za2 n GLN 6 N 4.79 -1.59 -3.05 2.98 1.13 0.34 -4.98 117.38 116.99 1za2 n GLN 6 Ca 0.23 0.75 -0.31 0.00 -1.94 0.00 0.00 57.00 55.72 1za2 n GLN 6 Cb 0.20 -5.07 -0.04 0.00 0.11 0.00 0.00 30.24 25.44 1za2 n GLN 6 CO 0.00 0.00 0.00 0.15 -1.44 0.00 0.00 177.06 175.77 1za2 s LYS 7 N -2.54 3.85 0.37 -1.09 -0.14 -0.13 -4.77 119.74 115.29 1za2 s LYS 7 Ca 0.00 0.48 -0.15 0.00 -1.36 0.00 0.00 55.97 54.94 1za2 s LYS 7 Cb 0.00 -2.45 -0.09 0.00 -1.68 0.00 0.00 37.83 33.61 1za2 s LYS 7 CO 0.00 0.09 0.79 -1.01 -0.76 0.00 0.00 175.35 174.46 1za2 s HIS 8 N -2.16 3.39 -0.57 3.18 3.76 -1.26 -4.71 115.29 116.92 1za2 s HIS 8 Ca 0.51 1.26 0.04 0.00 -0.15 0.00 0.00 55.06 56.73 1za2 s HIS 8 Cb -0.10 -2.59 0.14 0.00 1.11 0.00 0.00 32.58 31.14 1za2 s HIS 8 CO 0.25 -0.01 0.32 0.42 -0.85 0.00 0.00 174.74 174.88 1za2 s ILE 9 N -2.13 2.63 -0.17 0.60 -1.09 -0.81 -4.93 121.20 115.30 1za2 s ILE 9 Ca 0.55 -3.56 -0.09 0.00 -2.23 0.00 0.00 60.65 55.31 1za2 s ILE 9 Cb -0.10 -2.80 -0.07 0.00 -1.58 0.00 0.00 42.46 37.91 1za2 s ILE 9 CO 0.20 -0.86 -0.23 -0.38 -1.23 0.00 0.00 174.94 172.44 1za2 n ILE 10 N 2.80 1.05 -4.65 2.92 2.08 -1.26 -0.80 119.36 121.50 1za2 n ILE 10 Ca 0.09 -0.18 -0.23 0.00 0.56 0.00 0.00 62.75 62.99 1za2 n ILE 10 Cb 0.33 -1.80 -0.15 0.00 -0.75 0.00 0.00 39.64 37.28 1za2 n ILE 10 CO 0.00 0.00 0.00 -0.55 0.56 0.00 0.00 176.55 176.56 1za2 s SER 11 N -6.53 1.82 0.53 4.38 0.15 -1.26 -4.58 113.70 108.21 1za2 s SER 11 Ca -0.24 -0.32 0.18 0.00 0.70 0.00 0.00 55.95 56.26 1za2 s SER 11 Cb 0.09 -0.19 1.34 0.00 -1.71 0.00 0.00 66.02 65.55 1za2 s SER 11 CO 0.31 0.16 2.16 -0.29 1.20 0.00 0.00 173.24 176.79 1za2 h ILE 12 N 4.69 0.94 -0.14 6.45 6.09 -1.95 -0.47 117.51 133.12 1za2 h ILE 12 Ca -0.36 0.00 0.04 0.00 -1.37 0.00 0.00 64.86 63.17 1za2 h ILE 12 Cb 1.16 1.00 -0.01 0.00 0.47 0.00 0.00 36.82 39.44 1za2 h ILE 12 CO 0.48 0.00 0.12 -1.13 -3.07 0.00 0.00 178.15 174.55 1za2 h ASN 13 N 0.00 0.00 -0.60 2.19 -1.24 -1.96 -1.86 115.58 112.11 1za2 h ASN 13 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.01 1za2 h ASN 13 Cb 0.02 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.07 1za2 h ASN 13 CO -0.00 0.00 0.00 0.47 -1.29 0.00 0.00 177.43 176.61 1za2 n ASP 14 N -4.14 3.97 -4.24 1.15 8.00 -0.18 -4.85 116.55 116.26 1za2 n ASP 14 Ca 0.00 -2.25 -0.35 0.00 0.71 0.00 0.00 54.79 52.90 1za2 n ASP 14 Cb 0.24 -0.50 -0.14 0.00 -0.02 0.00 0.00 41.12 40.70 1za2 n ASP 14 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1za2 s LEU 15 N -1.44 3.04 0.89 0.64 1.43 -0.70 -5.02 118.68 117.54 1za2 s LEU 15 Ca 0.44 -0.67 -0.12 0.00 -1.03 0.00 0.00 54.13 52.75 1za2 s LEU 15 Cb 0.27 -1.69 0.13 0.00 0.03 0.00 0.00 46.19 44.92 1za2 s LEU 15 CO 0.24 -0.08 1.10 -0.94 0.23 0.00 0.00 176.35 176.90 1za2 s SER 16 N 1.39 3.57 0.31 2.29 1.04 -1.26 -4.83 113.70 116.21 1za2 s SER 16 Ca 0.03 1.25 -0.01 0.00 0.48 0.00 0.00 55.95 57.70 1za2 s SER 16 Cb -0.15 -1.92 0.49 0.00 0.10 0.00 0.00 66.02 64.53 1za2 s SER 16 CO -0.04 -2.54 1.97 -0.09 0.98 0.00 0.00 173.24 173.51 1za2 h ARG 17 N -1.49 1.04 -0.46 4.02 2.43 -1.97 -1.14 114.38 116.81 1za2 h ARG 17 Ca -0.50 -0.06 -0.09 0.00 -0.81 0.00 0.00 59.98 58.51 1za2 h ARG 17 Cb 1.30 -0.23 -0.02 0.00 -0.42 0.00 0.00 29.97 30.60 1za2 h ARG 17 CO 0.58 0.69 -0.09 -0.44 -1.51 0.00 0.00 179.97 179.20 1za2 h ASP 18 N 1.07 0.81 -0.36 -3.80 3.32 -1.99 -1.57 116.42 113.90 1za2 h ASP 18 Ca 0.31 -0.24 -0.01 0.00 0.02 0.00 0.00 57.03 57.11 1za2 h ASP 18 Cb -0.08 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.24 1za2 h ASP 18 CO -0.07 0.93 0.19 0.44 -1.72 0.00 0.00 179.24 179.00 1za2 h ASP 19 N 0.75 0.47 -0.46 6.45 3.45 -1.59 0.14 116.42 125.62 1za2 h ASP 19 Ca 0.13 -0.11 -0.02 0.00 0.43 0.00 0.00 57.03 57.46 1za2 h ASP 19 Cb 0.58 -0.12 -0.02 0.00 -0.56 0.00 0.00 39.33 39.21 1za2 h ASP 19 CO 0.04 0.45 0.22 -0.07 -1.57 0.00 0.00 179.24 178.30 1za2 h LEU 20 N 0.46 0.61 -0.92 1.55 3.38 -1.11 -0.86 115.31 118.41 1za2 h LEU 20 Ca 0.13 -0.13 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 1za2 h LEU 20 Cb 0.09 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 40.65 1za2 h LEU 20 CO -0.02 0.57 0.49 0.78 0.09 0.00 0.00 178.44 180.35 1za2 h ASN 21 N 0.61 1.12 -0.45 -0.43 -0.26 -1.04 -1.08 115.58 114.05 1za2 h ASN 21 Ca 0.16 -0.10 -0.01 0.00 -0.56 0.00 0.00 56.30 55.79 1za2 h ASN 21 Cb 0.12 -0.29 -0.02 0.00 -1.06 0.00 0.00 38.32 37.08 1za2 h ASN 21 CO -0.02 0.90 0.24 0.25 -1.06 0.00 0.00 177.43 177.74 1za2 h LEU 22 N 1.25 0.57 -0.20 1.61 5.85 -0.23 0.13 115.31 124.29 1za2 h LEU 22 Ca 0.31 -0.10 -0.02 0.00 0.84 0.00 0.00 57.88 58.92 1za2 h LEU 22 Cb 0.03 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 40.91 1za2 h LEU 22 CO -0.05 0.51 0.06 0.58 -0.34 0.00 0.00 178.44 179.21 1za2 h VAL 23 N 0.59 1.19 -0.72 1.05 2.07 -0.69 -1.75 116.25 117.99 1za2 h VAL 23 Ca 0.16 -0.58 -0.02 0.00 0.82 0.00 0.00 66.70 67.08 1za2 h VAL 23 Cb 0.07 1.20 -0.03 0.00 -1.52 0.00 0.00 31.29 31.01 1za2 h VAL 23 CO -0.02 0.18 0.39 -0.07 0.02 0.00 0.00 177.57 178.07 1za2 h LEU 24 N 0.15 0.90 -1.08 2.57 3.38 -0.99 0.20 115.31 120.45 1za2 h LEU 24 Ca 0.06 -0.10 -0.02 0.00 0.09 0.00 0.00 57.88 57.91 1za2 h LEU 24 Cb 0.22 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.71 1za2 h LEU 24 CO -0.00 0.75 0.33 0.00 0.09 0.00 0.00 178.44 179.60 1za2 h ALA 25 N 1.20 1.28 -0.29 1.53 0.00 -0.63 -0.72 119.26 121.63 1za2 h ALA 25 Ca 0.25 -0.14 -0.18 0.00 0.00 0.00 0.00 54.91 54.85 1za2 h ALA 25 Cb 0.05 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.56 1za2 h ALA 25 CO -0.04 0.55 -0.51 1.15 0.00 0.00 0.00 179.25 180.40 1za2 h THR 26 N 0.98 1.28 -0.02 0.00 2.02 -0.63 -2.46 112.91 114.08 1za2 h THR 26 Ca 0.24 -1.70 -0.04 0.00 0.77 0.00 0.00 66.41 65.68 1za2 h THR 26 Cb 0.10 1.60 -0.01 0.00 -1.74 0.00 0.00 68.15 68.10 1za2 h THR 26 CO -0.03 0.55 -0.18 0.00 0.37 0.00 0.00 175.52 176.24 1za2 h ALA 27 N 0.76 1.67 -0.01 6.16 0.00 -0.09 -1.57 119.26 126.18 1za2 h ALA 27 Ca 0.02 -0.17 -0.25 0.00 0.00 0.00 0.00 54.91 54.51 1za2 h ALA 27 Cb 1.11 -0.04 0.02 0.00 0.00 0.00 0.00 17.79 18.88 1za2 h ALA 27 CO 0.11 0.25 -0.98 0.00 0.00 0.00 0.00 179.25 178.64 1za2 h ALA 28 N 1.79 0.13 0.03 0.00 0.00 -0.97 -2.33 119.26 117.90 1za2 h ALA 28 Ca 0.00 -0.68 -0.00 0.00 0.00 0.00 0.00 54.91 54.24 1za2 h ALA 28 Cb 0.33 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.18 1za2 h ALA 28 CO 0.02 0.64 -0.01 0.87 0.00 0.00 0.00 179.25 180.77 1za2 h LYS 29 N 0.34 -0.03 -0.87 0.00 1.57 -1.12 -1.24 116.57 115.21 1za2 h LYS 29 Ca -0.12 0.00 0.02 0.00 -1.87 0.00 0.00 60.65 58.68 1za2 h LYS 29 Cb 1.64 0.01 -0.05 0.00 0.08 0.00 0.00 32.23 33.91 1za2 h LYS 29 CO 0.19 0.28 0.58 -0.07 -0.57 0.00 0.00 179.45 179.86 1za2 h LEU 30 N -0.35 0.98 -0.65 2.94 3.38 -1.41 0.93 115.31 121.14 1za2 h LEU 30 Ca -0.00 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.93 1za2 h LEU 30 Cb 0.33 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.81 1za2 h LEU 30 CO 0.01 0.70 0.34 0.50 0.09 0.00 0.00 178.44 180.07 1za2 h LYS 31 N 1.15 0.91 0.09 1.13 3.64 -1.29 -2.76 116.57 119.43 1za2 h LYS 31 Ca 0.33 -0.12 -0.00 0.00 -1.27 0.00 0.00 60.65 59.58 1za2 h LYS 31 Cb -0.09 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 31.56 1za2 h LYS 31 CO -0.08 0.71 -0.04 0.00 -2.27 0.00 0.00 179.45 177.77 1za2 h ALA 32 N 1.16 -0.11 -3.37 5.00 0.00 -0.19 -3.42 119.26 118.32 1za2 h ALA 32 Ca 0.23 -0.27 -0.61 0.00 0.00 0.00 0.00 54.91 54.25 1za2 h ALA 32 Cb 0.07 0.04 -0.40 0.00 0.00 0.00 0.00 17.79 17.51 1za2 h ALA 32 CO -0.03 -0.23 -0.74 -0.80 0.00 0.00 0.00 179.25 177.44 1za2 s ASN 33 N -5.66 4.31 0.79 0.00 0.01 0.31 -5.09 114.94 109.61 1za2 s ASN 33 Ca -0.14 -1.83 -0.14 0.00 -0.71 0.00 0.00 52.86 50.03 1za2 s ASN 33 Cb 0.00 -1.17 0.05 0.00 0.41 0.00 0.00 41.25 40.54 1za2 s ASN 33 CO 0.56 -0.40 0.99 -2.65 -1.51 0.00 0.00 177.10 174.09 1za2 n PRO 34 N 4.61 0.23 -3.23 -0.60 -0.02 -1.05 -4.21 135.00 130.73 1za2 n PRO 34 Ca 0.00 0.14 -0.24 0.00 -2.02 0.00 0.00 63.50 61.38 1za2 n PRO 34 Cb 0.42 -2.26 -0.07 0.00 -0.02 0.00 0.00 33.50 31.57 1za2 n PRO 34 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 1za2 n GLN 35 N -2.49 1.10 -0.08 -0.52 1.13 -1.26 -5.00 117.38 110.26 1za2 n GLN 35 Ca 0.12 -3.52 0.25 0.00 -1.94 0.00 0.00 57.00 51.92 1za2 n GLN 35 Cb 0.50 -1.46 0.63 0.00 0.11 0.00 0.00 30.24 30.02 1za2 n GLN 35 CO 0.00 0.00 0.00 -1.35 -1.44 0.00 0.00 177.06 174.27 1za2 h PRO 36 N 3.93 0.00 -0.11 -1.09 0.11 -1.86 -1.18 132.00 131.79 1za2 h PRO 36 Ca 0.10 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.21 1za2 h PRO 36 Cb 0.84 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.95 1za2 h PRO 36 CO 0.54 0.00 0.00 0.39 -0.21 0.00 0.00 178.00 178.72 1za2 n GLU 37 N -3.55 2.88 -0.18 1.05 -0.58 -1.25 -1.65 120.64 117.36 1za2 n GLU 37 Ca 0.16 -1.74 0.13 0.00 -0.42 0.00 0.00 57.16 55.29 1za2 n GLU 37 Cb 1.07 -1.12 0.46 0.00 -0.57 0.00 0.00 31.44 31.28 1za2 n GLU 37 CO 0.00 0.00 0.00 1.25 -0.48 0.00 0.00 177.13 177.90 1za2 h LEU 38 N 0.63 0.47 -3.30 -4.62 5.85 -1.02 -2.34 115.31 110.99 1za2 h LEU 38 Ca 0.00 0.02 -0.19 0.00 0.84 0.00 0.00 57.88 58.55 1za2 h LEU 38 Cb 0.61 -0.07 -0.13 0.00 0.37 0.00 0.00 40.66 41.44 1za2 h LEU 38 CO 0.00 0.26 -0.37 0.18 -0.34 0.00 0.00 178.44 178.17 1za2 n LEU 39 N -4.49 3.80 -4.75 2.25 4.77 0.17 -4.98 117.00 113.77 1za2 n LEU 39 Ca 0.14 -4.04 -0.38 0.00 -0.03 0.00 0.00 56.01 51.70 1za2 n LEU 39 Cb 0.46 -0.55 0.03 0.00 -2.33 0.00 0.00 43.42 41.04 1za2 n LEU 39 CO 0.32 1.50 0.93 -0.75 -1.33 0.00 0.00 177.39 178.06 1za2 s LYS 40 N -3.34 3.21 0.00 3.23 2.20 -0.88 -2.39 119.74 121.76 1za2 s LYS 40 Ca 0.44 2.07 0.00 0.00 -0.36 0.00 0.00 55.97 58.12 1za2 s LYS 40 Cb 0.40 -2.21 0.00 0.00 -1.51 0.00 0.00 37.83 34.50 1za2 s LYS 40 CO -0.03 -1.09 0.00 0.72 -0.36 0.00 0.00 175.35 174.60 1za2 n HIS 41 N -1.05 0.00 -4.35 4.03 8.25 -1.26 -4.94 115.22 115.89 1za2 n HIS 41 Ca 0.11 0.00 -0.34 0.00 -0.26 0.00 0.00 57.72 57.22 1za2 n HIS 41 Cb 0.46 -0.50 -0.09 0.00 1.12 0.00 0.00 29.99 30.98 1za2 n HIS 41 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 1za2 s LYS 42 N -0.49 2.92 -0.15 -0.41 3.01 -1.01 -5.03 119.74 118.58 1za2 s LYS 42 Ca 0.00 -0.47 0.01 0.00 -1.01 0.00 0.00 55.97 54.50 1za2 s LYS 42 Cb 0.00 -2.75 0.02 0.00 -1.01 0.00 0.00 37.83 34.08 1za2 s LYS 42 CO 0.00 0.68 -0.17 0.08 0.51 0.00 0.00 175.35 176.45 1za2 s VAL 43 N -0.95 1.77 -0.00 3.17 1.01 -1.26 -0.75 120.40 123.39 1za2 s VAL 43 Ca 0.15 -0.77 0.05 0.00 0.00 0.00 0.00 61.98 61.41 1za2 s VAL 43 Cb -0.11 -1.62 -0.03 0.00 0.00 0.00 0.00 36.38 34.62 1za2 s VAL 43 CO 0.05 0.49 -0.13 -0.63 0.00 0.00 0.00 175.10 174.88 1za2 s ILE 44 N 1.28 3.15 -0.07 2.22 1.01 -0.56 -0.52 121.20 127.70 1za2 s ILE 44 Ca 0.02 -0.90 -0.14 0.00 0.00 0.00 0.00 60.65 59.63 1za2 s ILE 44 Cb -0.13 -2.31 -0.05 0.00 0.01 0.00 0.00 42.46 39.98 1za2 s ILE 44 CO -0.09 0.44 0.36 0.00 0.00 0.00 0.00 174.94 175.65 1za2 s ALA 45 N -0.88 3.66 -0.35 9.38 0.00 -0.60 -2.25 121.76 130.71 1za2 s ALA 45 Ca 0.14 -0.32 0.01 0.00 0.00 0.00 0.00 51.96 51.80 1za2 s ALA 45 Cb -0.11 -2.38 0.10 0.00 0.00 0.00 0.00 23.12 20.73 1za2 s ALA 45 CO 0.04 0.33 0.08 0.45 0.00 0.00 0.00 175.76 176.66 1za2 s SER 46 N -0.44 4.90 -0.37 0.00 0.15 0.23 -1.05 113.70 117.13 1za2 s SER 46 Ca 0.21 -2.01 -0.02 0.00 0.70 0.00 0.00 55.95 54.83 1za2 s SER 46 Cb -0.15 -1.69 0.09 0.00 -1.71 0.00 0.00 66.02 62.56 1za2 s SER 46 CO 0.09 -0.41 0.13 0.00 1.20 0.00 0.00 173.24 174.25 1za2 s PHE 48 N 1.16 3.07 -1.98 0.00 0.08 -0.60 -2.11 117.98 117.60 1za2 s PHE 48 Ca 0.04 -0.86 0.23 0.00 0.12 0.00 0.00 56.93 56.45 1za2 s PHE 48 Cb -0.21 -2.19 0.65 0.00 -0.57 0.00 0.00 43.02 40.69 1za2 s PHE 48 CO -0.03 -0.52 1.54 1.19 -0.10 0.00 0.00 175.22 177.30 1za2 n PHE 49 N 4.85 0.99 -3.73 0.36 3.01 -0.30 -2.49 117.46 120.14 1za2 n PHE 49 Ca -0.16 -0.49 -0.14 0.00 1.01 0.00 0.00 57.45 57.67 1za2 n PHE 49 Cb 0.50 -0.00 -0.08 0.00 -0.01 0.00 0.00 39.48 39.88 1za2 n PHE 49 CO 0.00 0.00 0.00 -2.00 1.01 0.00 0.00 176.76 175.77 1za2 s GLU 50 N -1.03 0.72 0.66 -1.08 2.12 -1.26 -4.53 118.70 114.30 1za2 s GLU 50 Ca 0.49 -0.16 -0.17 0.00 0.36 0.00 0.00 54.97 55.49 1za2 s GLU 50 Cb 0.26 0.32 -0.03 0.00 0.26 0.00 0.00 34.13 34.94 1za2 s GLU 50 CO 0.33 -0.20 0.90 0.00 -0.54 0.00 0.00 175.26 175.75 1za2 n ALA 51 N 1.19 -0.21 -3.65 6.30 0.00 -1.26 -4.94 120.51 117.95 1za2 n ALA 51 Ca -0.21 -0.09 -0.04 0.00 0.00 0.00 0.00 53.44 53.09 1za2 n ALA 51 Cb 0.56 -2.07 -0.07 0.00 0.00 0.00 0.00 19.45 17.87 1za2 n ALA 51 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1za2 s SER 52 N -1.42 -0.19 -0.03 0.00 0.15 -1.26 -5.06 113.70 105.89 1za2 s SER 52 Ca 0.74 0.36 -0.01 0.00 0.70 0.00 0.00 55.95 57.73 1za2 s SER 52 Cb -0.38 0.44 -0.01 0.00 -1.71 0.00 0.00 66.02 64.35 1za2 s SER 52 CO 0.49 -0.06 -0.04 1.07 1.20 0.00 0.00 173.24 175.90 1za2 n THR 53 N 1.95 0.17 -0.04 6.45 5.66 -1.26 -4.67 114.28 122.55 1za2 n THR 53 Ca -0.12 -0.05 -0.16 0.00 -3.05 0.00 0.00 64.05 60.68 1za2 n THR 53 Cb 0.57 -1.45 -0.13 0.00 -1.55 0.00 0.00 70.33 67.77 1za2 n THR 53 CO 0.00 0.00 0.00 0.08 -3.05 0.00 0.00 175.07 172.10 1za2 h ARG 54 N -0.10 0.09 -0.67 1.09 0.11 -1.97 -2.36 114.38 110.56 1za2 h ARG 54 Ca -0.08 -0.14 -0.02 0.00 0.10 0.00 0.00 59.98 59.84 1za2 h ARG 54 Cb 1.07 0.05 -0.03 0.00 1.11 0.00 0.00 29.97 32.17 1za2 h ARG 54 CO -0.04 1.04 0.33 1.15 0.10 0.00 0.00 179.97 182.55 1za2 h THR 55 N -0.79 1.22 -0.02 0.08 2.02 -1.96 -0.21 112.91 113.25 1za2 h THR 55 Ca -0.04 -0.62 -0.16 0.00 0.77 0.00 0.00 66.41 66.36 1za2 h THR 55 Cb 1.15 0.39 0.01 0.00 -1.74 0.00 0.00 68.15 67.96 1za2 h THR 55 CO 0.04 0.26 -0.62 -0.09 0.37 0.00 0.00 175.52 175.48 1za2 h ARG 56 N 0.93 0.46 -0.56 6.66 2.43 -1.83 -2.94 114.38 119.53 1za2 h ARG 56 Ca 0.23 -0.46 -0.11 0.00 -0.81 0.00 0.00 59.98 58.83 1za2 h ARG 56 Cb 0.11 0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 29.76 1za2 h ARG 56 CO -0.03 1.11 -0.06 -0.07 -1.51 0.00 0.00 179.97 179.41 1za2 h LEU 57 N -0.02 1.02 -0.26 3.80 3.38 -1.34 -1.95 115.31 119.95 1za2 h LEU 57 Ca -0.07 -0.33 -0.05 0.00 0.09 0.00 0.00 57.88 57.51 1za2 h LEU 57 Cb 1.31 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.78 1za2 h LEU 57 CO 0.12 1.11 -0.05 0.77 0.09 0.00 0.00 178.44 180.48 1za2 h SER 58 N 0.91 0.50 -0.55 -0.43 4.64 -1.16 -0.60 113.55 116.84 1za2 h SER 58 Ca 0.15 -0.36 0.05 0.00 -0.47 0.00 0.00 61.79 61.17 1za2 h SER 58 Cb 0.63 -0.13 -0.05 0.00 -0.31 0.00 0.00 62.40 62.53 1za2 h SER 58 CO 0.04 0.74 0.28 0.15 -0.87 0.00 0.00 176.83 177.16 1za2 h PHE 59 N 0.25 0.50 -0.25 4.77 -0.00 -1.43 0.32 116.94 121.09 1za2 h PHE 59 Ca 0.07 0.02 -0.12 0.00 -0.00 0.00 0.00 57.97 57.94 1za2 h PHE 59 Cb 0.51 -0.14 -0.01 0.00 -0.00 0.00 0.00 35.95 36.31 1za2 h PHE 59 CO 0.05 0.23 -0.36 0.93 -0.00 0.00 0.00 178.31 179.16 1za2 h GLU 60 N 0.52 0.55 -0.41 1.11 5.08 -1.28 -1.43 114.58 118.72 1za2 h GLU 60 Ca 0.25 -0.26 -0.11 0.00 -1.00 0.00 0.00 59.36 58.24 1za2 h GLU 60 Cb 0.18 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.40 1za2 h GLU 60 CO -0.18 0.83 -0.18 1.15 -1.00 0.00 0.00 179.01 179.63 1za2 h THR 61 N 0.47 1.27 -0.35 1.13 2.02 -0.16 -2.49 112.91 114.79 1za2 h THR 61 Ca 0.05 -1.27 0.00 0.00 0.77 0.00 0.00 66.41 65.96 1za2 h THR 61 Cb 0.84 1.14 -0.02 0.00 -1.74 0.00 0.00 68.15 68.37 1za2 h THR 61 CO 0.07 0.43 0.23 0.28 0.37 0.00 0.00 175.52 176.90 1za2 h SER 62 N 0.70 0.40 -0.57 4.18 0.02 0.01 0.22 113.55 118.50 1za2 h SER 62 Ca 0.11 -0.02 0.07 0.00 -0.84 0.00 0.00 61.79 61.11 1za2 h SER 62 Cb 0.68 -0.10 -0.06 0.00 0.14 0.00 0.00 62.40 63.06 1za2 h SER 62 CO 0.05 0.30 0.24 0.24 -1.14 0.00 0.00 176.83 176.52 1za2 h MET 63 N 0.47 0.44 -0.38 3.45 2.07 -1.02 -1.94 114.93 118.02 1za2 h MET 63 Ca 0.13 -0.03 -0.15 0.00 -2.07 0.00 0.00 59.70 57.58 1za2 h MET 63 Cb -0.05 -0.10 -0.01 0.00 -1.87 0.00 0.00 31.60 29.58 1za2 h MET 63 CO -0.03 0.29 -0.35 0.45 1.07 0.00 0.00 176.91 178.35 1za2 h HIS 64 N 0.46 1.08 -0.01 -0.22 3.86 -1.00 -0.48 115.15 118.83 1za2 h HIS 64 Ca 0.27 -0.32 0.00 0.00 -1.16 0.00 0.00 60.37 59.17 1za2 h HIS 64 Cb 0.27 -0.23 -0.00 0.00 1.06 0.00 0.00 27.41 28.51 1za2 h HIS 64 CO -0.14 1.13 0.10 0.00 0.86 0.00 0.00 177.93 179.88 1za2 h ARG 65 N 0.71 0.00 -0.09 2.45 2.47 -0.01 0.25 114.38 120.17 1za2 h ARG 65 Ca 0.06 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.78 1za2 h ARG 65 Cb 0.94 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.26 1za2 h ARG 65 CO 0.09 0.00 0.00 1.28 0.56 0.00 0.00 179.97 181.90 1za2 n LEU 66 N -3.13 2.80 0.00 3.04 4.77 -0.78 -3.79 117.00 119.90 1za2 n LEU 66 Ca -0.02 -1.10 0.00 0.00 -0.03 0.00 0.00 56.01 54.85 1za2 n LEU 66 Cb 0.17 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.21 1za2 n LEU 66 CO 0.19 0.51 0.00 0.61 -1.33 0.00 0.00 177.39 177.37 1za2 n GLY 67 N 1.17 0.72 3.86 -0.72 0.00 0.08 0.46 105.19 110.76 1za2 n GLY 67 Ca 0.13 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.84 1za2 n GLY 67 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1za2 s ALA 68 N -2.58 3.23 0.56 4.61 0.00 -0.23 -4.02 121.76 123.33 1za2 s ALA 68 Ca 0.00 -0.06 0.03 0.00 0.00 0.00 0.00 51.96 51.93 1za2 s ALA 68 Cb 0.00 -2.87 0.05 0.00 0.00 0.00 0.00 23.12 20.30 1za2 s ALA 68 CO 0.00 -0.14 0.78 -1.12 0.00 0.00 0.00 175.76 175.28 1za2 s SER 69 N -3.21 5.15 -0.03 0.00 0.01 0.07 -3.93 113.70 111.76 1za2 s SER 69 Ca 0.54 -0.24 -0.04 0.00 1.31 0.00 0.00 55.95 57.52 1za2 s SER 69 Cb -0.10 -0.54 0.01 0.00 0.21 0.00 0.00 66.02 65.59 1za2 s SER 69 CO 0.33 -1.23 0.10 -0.69 0.41 0.00 0.00 173.24 172.15 1za2 s VAL 70 N -2.75 0.01 0.04 3.43 1.01 -1.26 -1.50 120.40 119.38 1za2 s VAL 70 Ca 0.59 -0.12 -0.00 0.00 0.00 0.00 0.00 61.98 62.45 1za2 s VAL 70 Cb -0.09 -0.18 -0.03 0.00 0.00 0.00 0.00 36.38 36.08 1za2 s VAL 70 CO 0.39 -0.07 -0.03 0.68 0.00 0.00 0.00 175.10 176.07 1za2 s VAL 71 N -0.18 0.19 -5.00 2.92 -7.23 -0.95 -4.97 120.40 105.18 1za2 s VAL 71 Ca -0.02 -1.32 0.00 0.00 -1.81 0.00 0.00 61.98 58.83 1za2 s VAL 71 Cb -0.02 -0.83 0.00 0.00 0.56 0.00 0.00 36.38 36.09 1za2 s VAL 71 CO 0.00 -0.71 0.00 0.61 -0.31 0.00 0.00 175.10 174.69 1za2 n GLY 72 N 0.94 -0.18 3.47 2.32 0.00 -1.26 -0.60 105.19 109.87 1za2 n GLY 72 Ca -0.19 -1.25 -0.11 0.00 0.00 0.00 0.00 46.02 44.47 1za2 n GLY 72 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1za2 s PHE 73 N -3.11 -0.43 -0.51 1.61 -0.12 -0.58 -4.97 117.98 109.87 1za2 s PHE 73 Ca 0.00 0.17 0.22 0.00 -0.05 0.00 0.00 56.93 57.27 1za2 s PHE 73 Cb 0.00 0.53 -0.27 0.00 -0.63 0.00 0.00 43.02 42.65 1za2 s PHE 73 CO 0.00 -0.89 0.70 0.43 -0.05 0.00 0.00 175.22 175.42 1za2 n SER 74 N -0.37 0.50 -3.66 1.98 7.64 -1.26 -1.56 113.62 116.89 1za2 n SER 74 Ca -0.15 -0.48 -0.10 0.00 1.01 0.00 0.00 58.87 59.15 1za2 n SER 74 Cb 0.64 1.47 -0.05 0.00 -1.01 0.00 0.00 64.21 65.26 1za2 n SER 74 CO 0.00 0.00 0.00 1.51 -3.01 0.00 0.00 175.04 173.54 1za2 s ASP 75 N -3.78 -0.20 0.00 6.43 1.47 -1.04 -4.44 116.67 115.11 1za2 s ASP 75 Ca 0.00 -0.33 0.29 0.00 1.18 0.00 0.00 52.55 53.69 1za2 s ASP 75 Cb 0.15 0.46 1.23 0.00 -0.34 0.00 0.00 42.92 44.42 1za2 s ASP 75 CO 0.89 -0.83 1.85 -1.54 0.68 0.00 0.00 175.17 176.22 1za2 n SER 76 N -0.16 1.18 -0.27 2.11 3.41 -1.26 -4.41 113.62 114.22 1za2 n SER 76 Ca -0.16 -1.39 0.07 0.00 -0.26 0.00 0.00 58.87 57.12 1za2 n SER 76 Cb 0.63 0.00 0.21 0.00 -0.26 0.00 0.00 64.21 64.79 1za2 n SER 76 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1za2 h ALA 77 N 4.28 1.13 -1.00 7.33 0.00 -1.92 -2.37 119.26 126.71 1za2 h ALA 77 Ca 0.00 0.12 -0.56 0.00 0.00 0.00 0.00 54.91 54.48 1za2 h ALA 77 Cb 0.39 0.10 -0.30 0.00 0.00 0.00 0.00 17.79 17.98 1za2 h ALA 77 CO 0.00 -0.23 0.71 0.09 0.00 0.00 0.00 179.25 179.82 1za2 n ASN 78 N -5.01 4.71 -4.48 0.00 5.03 -1.26 -4.32 115.26 109.93 1za2 n ASN 78 Ca 0.16 -3.65 -0.24 0.00 0.87 0.00 0.00 54.58 51.71 1za2 n ASN 78 Cb 0.46 -0.87 -0.10 0.00 -1.02 0.00 0.00 39.78 38.24 1za2 n ASN 78 CO 0.00 0.00 0.00 0.28 -1.83 0.00 0.00 177.26 175.71 1za2 s THR 79 N -3.67 2.51 0.28 3.41 -1.32 -0.89 -5.02 115.64 110.93 1za2 s THR 79 Ca 0.59 -2.38 0.01 0.00 -1.21 0.00 0.00 61.69 58.70 1za2 s THR 79 Cb 0.49 -2.34 0.27 0.00 -1.51 0.00 0.00 72.50 69.41 1za2 s THR 79 CO 0.08 -0.39 1.80 0.28 -2.21 0.00 0.00 174.62 174.18 1za2 h SER 80 N 2.24 0.76 -3.28 8.08 0.02 -1.92 -1.45 113.55 118.01 1za2 h SER 80 Ca -0.40 0.07 -0.57 0.00 -0.84 0.00 0.00 61.79 60.05 1za2 h SER 80 Cb 1.26 -0.07 -0.06 0.00 0.14 0.00 0.00 62.40 63.67 1za2 h SER 80 CO 0.60 0.36 0.87 -0.22 -1.14 0.00 0.00 176.83 177.31 1za2 s LEU 81 N -10.28 3.92 0.00 5.07 0.20 -1.26 -0.91 118.68 115.41 1za2 s LEU 81 Ca -0.12 1.08 0.00 0.00 0.69 0.00 0.00 54.13 55.79 1za2 s LEU 81 Cb 0.22 -3.54 0.00 0.00 -0.43 0.00 0.00 46.19 42.44 1za2 s LEU 81 CO 0.80 -0.93 0.00 0.61 -0.29 0.00 0.00 176.35 176.54 1za2 n GLY 82 N 3.98 3.60 0.20 7.98 0.00 -1.19 -4.73 105.19 115.03 1za2 n GLY 82 Ca 0.13 -0.80 -0.22 0.00 0.00 0.00 0.00 46.02 45.13 1za2 n GLY 82 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1za2 n LYS 83 N 0.00 0.53 -1.35 1.61 4.76 -0.55 -4.63 118.16 118.53 1za2 n LYS 83 Ca 0.00 0.23 -0.23 0.00 -2.87 0.00 0.00 58.31 55.44 1za2 n LYS 83 Cb 0.00 -1.40 0.11 0.00 -1.84 0.00 0.00 35.03 31.90 1za2 n LYS 83 CO 0.00 0.00 0.00 0.36 -1.37 0.00 0.00 177.40 176.39 1za2 n LYS 84 N -4.22 2.62 -4.20 1.97 0.00 -0.09 -4.97 118.16 109.27 1za2 n LYS 84 Ca -0.40 -3.43 -0.33 0.00 -0.00 0.00 0.00 58.31 54.15 1za2 n LYS 84 Cb 0.75 -2.15 -0.08 0.00 -0.00 0.00 0.00 35.03 33.55 1za2 n LYS 84 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1za2 n GLY 85 N -0.96 -0.21 3.77 2.58 0.00 -1.01 -4.85 105.19 104.51 1za2 n GLY 85 Ca 0.50 0.12 -0.36 0.00 0.00 0.00 0.00 46.02 46.29 1za2 n GLY 85 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1za2 s GLU 86 N -6.85 3.44 0.58 1.61 2.12 -1.04 -4.91 118.70 113.65 1za2 s GLU 86 Ca 0.31 1.66 -0.16 0.00 0.36 0.00 0.00 54.97 57.14 1za2 s GLU 86 Cb -0.18 -2.10 -0.04 0.00 0.26 0.00 0.00 34.13 32.07 1za2 s GLU 86 CO 0.92 -0.79 1.06 0.95 -0.54 0.00 0.00 175.26 176.86 1za2 s THR 87 N -1.71 3.78 0.27 -1.70 -4.23 -1.26 -4.41 115.64 106.37 1za2 s THR 87 Ca 0.71 0.88 -0.03 0.00 -1.18 0.00 0.00 61.69 62.07 1za2 s THR 87 Cb -0.25 -3.38 0.17 0.00 1.34 0.00 0.00 72.50 70.38 1za2 s THR 87 CO 0.29 -0.46 1.84 0.25 -0.54 0.00 0.00 174.62 176.00 1za2 h LEU 88 N 0.59 0.86 0.34 4.79 5.85 -1.99 -1.30 115.31 124.46 1za2 h LEU 88 Ca -0.47 -0.13 -0.00 0.00 0.84 0.00 0.00 57.88 58.11 1za2 h LEU 88 Cb 1.22 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 42.01 1za2 h LEU 88 CO 0.58 0.79 -0.31 0.00 -0.34 0.00 0.00 178.44 179.15 1za2 h ALA 89 N 1.33 -0.68 -0.84 1.25 0.00 -1.94 0.28 119.26 118.66 1za2 h ALA 89 Ca 0.21 -0.11 0.04 0.00 0.00 0.00 0.00 54.91 55.05 1za2 h ALA 89 Cb 0.22 0.43 -0.05 0.00 0.00 0.00 0.00 17.79 18.39 1za2 h ALA 89 CO -0.01 -0.91 0.55 -0.44 0.00 0.00 0.00 179.25 178.44 1za2 h ASP 90 N -0.67 0.89 -0.76 0.00 3.32 -1.90 0.81 116.42 118.11 1za2 h ASP 90 Ca -0.02 -0.01 0.01 0.00 0.02 0.00 0.00 57.03 57.03 1za2 h ASP 90 Cb 0.60 -0.20 -0.04 0.00 0.22 0.00 0.00 39.33 39.91 1za2 h ASP 90 CO -0.04 0.60 0.50 0.74 -1.72 0.00 0.00 179.24 179.32 1za2 h THR 91 N 1.03 1.18 -0.01 0.35 2.02 -0.55 -0.93 112.91 116.00 1za2 h THR 91 Ca 0.34 -0.35 -0.16 0.00 0.77 0.00 0.00 66.41 67.02 1za2 h THR 91 Cb 0.06 0.08 0.01 0.00 -1.74 0.00 0.00 68.15 66.57 1za2 h THR 91 CO -0.10 0.18 -0.61 0.40 0.37 0.00 0.00 175.52 175.76 1za2 h ILE 92 N 1.01 1.42 -0.95 3.11 1.08 0.18 -1.23 117.51 122.13 1za2 h ILE 92 Ca 0.28 -2.07 0.23 0.00 -0.39 0.00 0.00 64.86 62.91 1za2 h ILE 92 Cb -0.10 2.58 -0.12 0.00 -3.07 0.00 0.00 36.82 36.10 1za2 h ILE 92 CO -0.07 0.60 0.51 0.28 -0.69 0.00 0.00 178.15 178.78 1za2 h SER 93 N -0.08 0.53 0.00 1.72 0.02 0.91 0.20 113.55 116.85 1za2 h SER 93 Ca -0.07 0.14 -0.00 0.00 -0.84 0.00 0.00 61.79 61.02 1za2 h SER 93 Cb 1.32 0.07 0.00 0.00 0.14 0.00 0.00 62.40 63.93 1za2 h SER 93 CO 0.12 0.06 -0.00 0.58 -1.14 0.00 0.00 176.83 176.45 1za2 h VAL 94 N 0.50 1.71 -0.26 2.27 2.07 -1.16 -3.34 116.25 118.04 1za2 h VAL 94 Ca 0.61 -2.12 -0.02 0.00 0.82 0.00 0.00 66.70 65.99 1za2 h VAL 94 Cb 1.15 3.14 -0.01 0.00 -1.52 0.00 0.00 31.29 34.05 1za2 h VAL 94 CO -0.50 0.55 0.06 0.40 0.02 0.00 0.00 177.57 178.10 1za2 h ILE 95 N -0.91 1.13 0.00 4.57 2.04 -0.64 -1.18 117.51 122.52 1za2 h ILE 95 Ca -0.00 -0.45 0.00 0.00 1.00 0.00 0.00 64.86 65.41 1za2 h ILE 95 Cb 0.90 0.87 0.00 0.00 -0.74 0.00 0.00 36.82 37.85 1za2 h ILE 95 CO 0.00 0.16 0.00 -1.54 0.00 0.00 0.00 178.15 176.77 1za2 n SER 96 N -4.39 0.40 -0.21 1.72 3.41 0.66 -0.56 113.62 114.66 1za2 n SER 96 Ca 0.01 0.63 0.13 0.00 -0.26 0.00 0.00 58.87 59.38 1za2 n SER 96 Cb 0.16 -0.71 0.38 0.00 -0.26 0.00 0.00 64.21 63.78 1za2 n SER 96 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1za2 n THR 97 N -1.98 0.00 -0.12 6.66 -2.24 -0.45 -4.36 114.28 111.79 1za2 n THR 97 Ca 0.01 -0.11 -0.23 0.00 -2.27 0.00 0.00 64.05 61.45 1za2 n THR 97 Cb 0.12 0.34 -0.09 0.00 -2.10 0.00 0.00 70.33 68.60 1za2 n THR 97 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 1za2 n TYR 98 N -0.77 0.00 -3.52 4.78 4.01 0.28 -5.08 117.16 116.86 1za2 n TYR 98 Ca 0.11 0.00 -0.21 0.00 -0.16 0.00 0.00 57.90 57.64 1za2 n TYR 98 Cb 0.34 -0.88 -0.02 0.00 -0.31 0.00 0.00 39.34 38.47 1za2 n TYR 98 CO 0.00 0.00 0.00 0.14 -0.46 0.00 0.00 176.86 176.54 1za2 s VAL 99 N -2.45 2.50 -2.22 -0.72 -7.23 -1.04 -4.97 120.40 104.27 1za2 s VAL 99 Ca -0.33 -1.31 0.25 0.00 -1.81 0.00 0.00 61.98 58.78 1za2 s VAL 99 Cb 0.11 -2.81 0.18 0.00 0.56 0.00 0.00 36.38 34.43 1za2 s VAL 99 CO 0.47 0.00 1.34 0.47 -0.31 0.00 0.00 175.10 177.07 1za2 n ASP 100 N -1.66 1.88 -3.62 4.85 8.00 0.32 -4.89 116.55 121.43 1za2 n ASP 100 Ca 0.04 -1.44 -0.05 0.00 0.71 0.00 0.00 54.79 54.05 1za2 n ASP 100 Cb 0.62 0.22 -0.04 0.00 -0.02 0.00 0.00 41.12 41.90 1za2 n ASP 100 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1za2 s ALA 101 N -2.32 -2.06 -0.14 2.24 0.00 -1.26 -4.33 121.76 113.89 1za2 s ALA 101 Ca 0.25 1.80 0.00 0.00 0.00 0.00 0.00 51.96 54.00 1za2 s ALA 101 Cb 0.19 -1.24 0.02 0.00 0.00 0.00 0.00 23.12 22.10 1za2 s ALA 101 CO 0.47 -0.27 -0.13 0.42 0.00 0.00 0.00 175.76 176.25 1za2 s ILE 102 N -1.09 1.47 -0.24 0.00 1.01 0.87 -1.56 121.20 121.65 1za2 s ILE 102 Ca 0.06 -0.57 -0.09 0.00 0.00 0.00 0.00 60.65 60.05 1za2 s ILE 102 Cb -0.01 -1.39 -0.04 0.00 0.01 0.00 0.00 42.46 41.03 1za2 s ILE 102 CO -0.05 0.44 0.11 -0.69 0.00 0.00 0.00 174.94 174.75 1za2 s VAL 103 N 1.51 4.78 0.01 2.92 1.01 -0.22 -0.22 120.40 130.19 1za2 s VAL 103 Ca 0.05 -0.02 0.01 0.00 0.00 0.00 0.00 61.98 62.01 1za2 s VAL 103 Cb -0.13 -3.23 -0.01 0.00 0.00 0.00 0.00 36.38 33.02 1za2 s VAL 103 CO -0.10 0.34 -0.03 -0.32 0.00 0.00 0.00 175.10 175.00 1za2 s MET 104 N 1.33 0.21 -0.06 2.72 0.00 -0.77 -0.31 119.30 122.41 1za2 s MET 104 Ca 0.06 -0.24 0.05 0.00 0.00 0.00 0.00 55.69 55.55 1za2 s MET 104 Cb -0.15 -0.10 -0.00 0.00 0.00 0.00 0.00 34.83 34.58 1za2 s MET 104 CO 0.05 0.02 -0.21 0.50 0.00 0.00 0.00 175.02 175.38 1za2 s ARG 105 N -0.48 2.35 -0.01 4.11 3.52 -0.89 0.83 118.95 128.36 1za2 s ARG 105 Ca -0.04 -0.76 -0.03 0.00 -0.13 0.00 0.00 55.73 54.77 1za2 s ARG 105 Cb -0.03 -1.93 0.00 0.00 -1.56 0.00 0.00 34.95 31.43 1za2 s ARG 105 CO -0.00 0.25 0.07 -1.58 -0.81 0.00 0.00 175.30 173.23 1za2 s HIS 106 N 0.11 0.00 0.41 5.12 2.46 0.58 -1.15 115.29 122.82 1za2 s HIS 106 Ca -0.09 0.01 0.39 0.00 0.47 0.00 0.00 55.06 55.85 1za2 s HIS 106 Cb -0.14 -0.03 1.99 0.00 -0.13 0.00 0.00 32.58 34.27 1za2 s HIS 106 CO 0.05 -0.12 2.19 -1.00 -2.47 0.00 0.00 174.74 173.39 1za2 h PRO 107 N 5.43 0.00 -5.52 2.88 0.13 -1.84 -1.03 132.00 132.04 1za2 h PRO 107 Ca -0.27 0.00 -0.64 0.00 -0.87 0.00 0.00 66.00 64.22 1za2 h PRO 107 Cb 1.20 0.00 -0.12 0.00 0.13 0.00 0.00 31.00 32.21 1za2 h PRO 107 CO 0.44 0.00 -0.54 -0.65 -0.23 0.00 0.00 178.00 177.02 1za2 s GLN 108 N -3.94 3.65 0.32 0.86 -0.21 -1.26 -3.49 119.66 115.59 1za2 s GLN 108 Ca -0.03 -0.27 -0.29 0.00 0.02 0.00 0.00 55.36 54.80 1za2 s GLN 108 Cb 0.11 -3.16 -0.11 0.00 1.00 0.00 0.00 33.01 30.86 1za2 s GLN 108 CO 0.44 0.52 1.45 -1.21 -2.12 0.00 0.00 175.29 174.37 1za2 s GLU 109 N -0.32 4.21 0.00 2.91 8.01 -1.26 -2.58 118.70 129.67 1za2 s GLU 109 Ca 0.10 2.42 0.00 0.00 0.01 0.00 0.00 54.97 57.50 1za2 s GLU 109 Cb -0.12 -3.03 0.00 0.00 -4.31 0.00 0.00 34.13 26.67 1za2 s GLU 109 CO 0.01 -0.44 0.00 0.41 0.01 0.00 0.00 175.26 175.25 1za2 n GLY 110 N 1.23 2.65 0.38 -1.39 0.00 -1.26 -4.97 105.19 101.84 1za2 n GLY 110 Ca 0.03 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.99 1za2 n GLY 110 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1za2 h ALA 111 N 0.00 -0.17 -1.01 4.61 0.00 -1.86 0.24 119.26 121.07 1za2 h ALA 111 Ca 0.00 0.17 0.01 0.00 0.00 0.00 0.00 54.91 55.09 1za2 h ALA 111 Cb 0.00 0.99 -0.05 0.00 0.00 0.00 0.00 17.79 18.73 1za2 h ALA 111 CO 0.00 -0.76 0.67 0.00 0.00 0.00 0.00 179.25 179.16 1za2 h ALA 112 N 0.88 1.28 -0.67 0.00 0.00 -1.92 0.11 119.26 118.94 1za2 h ALA 112 Ca 0.23 -0.07 -0.07 0.00 0.00 0.00 0.00 54.91 55.01 1za2 h ALA 112 Cb 0.55 -0.41 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 1za2 h ALA 112 CO -0.80 0.67 0.15 -0.09 0.00 0.00 0.00 179.25 179.18 1za2 h ARG 113 N 1.37 1.07 -0.38 0.00 9.65 -1.40 -2.34 114.38 122.36 1za2 h ARG 113 Ca 0.37 -0.26 -0.01 0.00 -1.10 0.00 0.00 59.98 58.98 1za2 h ARG 113 Cb -0.16 -0.14 -0.02 0.00 -1.39 0.00 0.00 29.97 28.26 1za2 h ARG 113 CO -0.08 0.96 0.20 1.25 2.80 0.00 0.00 179.97 185.11 1za2 h LEU 114 N 1.00 0.48 -0.74 3.80 6.46 0.43 -2.44 115.31 124.30 1za2 h LEU 114 Ca 0.21 -0.10 0.14 0.00 -0.12 0.00 0.00 57.88 58.02 1za2 h LEU 114 Cb 0.38 -0.12 -0.10 0.00 -0.73 0.00 0.00 40.66 40.09 1za2 h LEU 114 CO 0.00 0.44 0.27 0.00 -0.62 0.00 0.00 178.44 178.53 1za2 h ALA 115 N 1.06 1.03 -1.03 1.25 0.00 -0.68 -0.71 119.26 120.18 1za2 h ALA 115 Ca 0.13 0.13 0.28 0.00 0.00 0.00 0.00 54.91 55.45 1za2 h ALA 115 Cb 0.07 0.12 -0.12 0.00 0.00 0.00 0.00 17.79 17.86 1za2 h ALA 115 CO -0.02 -0.24 0.62 1.15 0.00 0.00 0.00 179.25 180.76 1za2 h THR 116 N 0.40 0.45 0.00 0.00 2.02 -0.92 0.18 112.91 115.04 1za2 h THR 116 Ca 0.41 -0.15 0.00 0.00 0.77 0.00 0.00 66.41 67.44 1za2 h THR 116 Cb 0.64 -0.04 0.00 0.00 -1.74 0.00 0.00 68.15 67.01 1za2 h THR 116 CO -0.42 0.08 0.00 -0.62 0.37 0.00 0.00 175.52 174.93 1za2 n GLU 117 N -4.86 0.69 0.00 6.66 1.02 -0.27 -3.59 120.64 120.30 1za2 n GLU 117 Ca 0.28 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.43 1za2 n GLU 117 Cb 0.87 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.79 1za2 n GLU 117 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 1za2 n PHE 118 N -1.14 0.00 0.27 -0.32 3.01 0.49 -4.78 117.46 114.98 1za2 n PHE 118 Ca 0.19 -0.11 0.10 0.00 1.01 0.00 0.00 57.45 58.63 1za2 n PHE 118 Cb 0.17 -0.01 0.26 0.00 -0.01 0.00 0.00 39.48 39.89 1za2 n PHE 118 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64 1za2 n SER 119 N -0.11 3.04 0.00 4.37 3.41 -0.32 -3.64 113.62 120.38 1za2 n SER 119 Ca 0.00 -1.97 0.00 0.00 -0.26 0.00 0.00 58.87 56.64 1za2 n SER 119 Cb 0.23 -0.34 0.00 0.00 -0.26 0.00 0.00 64.21 63.84 1za2 n SER 119 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1za2 n GLY 120 N 1.42 3.54 2.02 5.00 0.00 -1.26 -0.93 105.19 114.98 1za2 n GLY 120 Ca 0.19 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.04 1za2 n GLY 120 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1za2 n ASN 121 N 5.07 3.86 -4.51 1.61 2.04 -1.26 -4.89 115.26 117.18 1za2 n ASN 121 Ca 0.00 -3.32 -0.37 0.00 -0.44 0.00 0.00 54.58 50.45 1za2 n ASN 121 Cb 0.00 -0.78 -0.12 0.00 -2.53 0.00 0.00 39.78 36.35 1za2 n ASN 121 CO 0.00 0.00 0.00 -0.69 -0.44 0.00 0.00 177.26 176.13 1za2 s VAL 122 N -2.83 4.77 0.24 3.53 1.01 -0.10 -5.04 120.40 121.98 1za2 s VAL 122 Ca 0.49 -0.04 -0.31 0.00 0.00 0.00 0.00 61.98 62.13 1za2 s VAL 122 Cb 0.41 -3.26 -0.11 0.00 0.00 0.00 0.00 36.38 33.42 1za2 s VAL 122 CO 0.10 0.28 1.55 -2.84 0.00 0.00 0.00 175.10 174.19 1za2 s PRO 123 N 1.68 4.19 -0.08 2.72 0.02 -1.26 -4.80 135.00 137.47 1za2 s PRO 123 Ca 0.07 2.44 0.03 0.00 0.02 0.00 0.00 61.00 63.56 1za2 s PRO 123 Cb -0.16 -3.08 -0.02 0.00 0.02 0.00 0.00 34.50 31.26 1za2 s PRO 123 CO 0.07 -0.57 -0.17 0.14 -0.33 0.00 0.00 177.00 176.14 1za2 s VAL 124 N 0.36 2.73 -0.22 3.83 -7.23 -1.26 -0.09 120.40 118.51 1za2 s VAL 124 Ca 0.65 -0.82 -0.02 0.00 -1.81 0.00 0.00 61.98 59.98 1za2 s VAL 124 Cb -0.45 -2.07 0.01 0.00 0.56 0.00 0.00 36.38 34.43 1za2 s VAL 124 CO 0.41 0.56 -0.09 -0.76 -0.31 0.00 0.00 175.10 174.92 1za2 s LEU 125 N -0.22 2.82 -0.30 1.32 1.02 0.70 -1.92 118.68 122.09 1za2 s LEU 125 Ca -0.00 -0.65 -0.29 0.00 0.02 0.00 0.00 54.13 53.21 1za2 s LEU 125 Cb -0.13 -1.64 -0.02 0.00 0.02 0.00 0.00 46.19 44.42 1za2 s LEU 125 CO 0.03 -0.06 1.70 0.21 0.02 0.00 0.00 176.35 178.25 1za2 s ASN 126 N 1.37 6.10 -0.06 2.29 2.47 0.02 -1.85 114.94 125.28 1za2 s ASN 126 Ca 0.03 1.36 0.17 0.00 0.42 0.00 0.00 52.86 54.84 1za2 s ASN 126 Cb -0.15 -2.53 0.59 0.00 -1.45 0.00 0.00 41.25 37.71 1za2 s ASN 126 CO -0.06 -1.53 1.48 0.00 -3.72 0.00 0.00 177.10 173.27 1za2 n ALA 127 N 9.50 2.78 0.00 1.71 0.00 0.24 -4.31 120.51 130.43 1za2 n ALA 127 Ca 0.21 -1.24 0.00 0.00 0.00 0.00 0.00 53.44 52.41 1za2 n ALA 127 Cb 0.46 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.92 1za2 n ALA 127 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1za2 n GLY 128 N 1.20 3.70 2.64 0.00 0.00 -1.25 -4.67 105.19 106.82 1za2 n GLY 128 Ca 0.21 -0.85 -0.29 0.00 0.00 0.00 0.00 46.02 45.09 1za2 n GLY 128 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1za2 s ASP 129 N 0.00 3.69 0.85 1.61 -4.77 -0.91 -0.31 116.67 116.83 1za2 s ASP 129 Ca 0.00 -1.77 0.00 0.00 -3.30 0.00 0.00 52.55 47.48 1za2 s ASP 129 Cb 0.00 -0.68 0.00 0.00 -1.09 0.00 0.00 42.92 41.15 1za2 s ASP 129 CO 0.00 -0.39 0.00 0.61 0.70 0.00 0.00 175.17 176.09 1za2 n GLY 130 N 4.65 2.68 1.79 2.12 0.00 -0.39 -1.70 105.19 114.34 1za2 n GLY 130 Ca 0.01 -0.32 0.03 0.00 0.00 0.00 0.00 46.02 45.74 1za2 n GLY 130 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1za2 n SER 131 N 0.70 5.11 0.00 1.61 3.41 -1.26 -4.72 113.62 118.47 1za2 n SER 131 Ca 0.00 -2.90 0.00 0.00 -0.26 0.00 0.00 58.87 55.71 1za2 n SER 131 Cb 0.00 -0.68 0.00 0.00 -0.26 0.00 0.00 64.21 63.27 1za2 n SER 131 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1za2 n ASN 132 N 0.41 0.00 -4.65 4.04 5.15 -0.69 -4.71 115.26 114.80 1za2 n ASN 132 Ca 0.28 0.00 -0.24 0.00 -0.60 0.00 0.00 54.58 54.02 1za2 n ASN 132 Cb 1.15 0.00 -0.08 0.00 -0.53 0.00 0.00 39.78 40.32 1za2 n ASN 132 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 1za2 s GLN 133 N 0.00 2.17 -0.41 1.20 -1.52 -1.25 -4.88 119.66 114.97 1za2 s GLN 133 Ca 0.00 -1.65 0.05 0.00 -1.95 0.00 0.00 55.36 51.81 1za2 s GLN 133 Cb 0.00 -2.02 0.32 0.00 -0.22 0.00 0.00 33.01 31.09 1za2 s GLN 133 CO 0.00 0.17 1.22 1.58 -0.25 0.00 0.00 175.29 178.01 1za2 n HIS 134 N -0.99 -1.99 -0.30 0.91 -0.00 -1.26 -2.15 115.22 109.44 1za2 n HIS 134 Ca -0.04 -1.63 0.04 0.00 -0.00 0.00 0.00 57.72 56.08 1za2 n HIS 134 Cb 0.61 1.47 0.18 0.00 -0.00 0.00 0.00 29.99 32.26 1za2 n HIS 134 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 1za2 h PRO 135 N 2.68 0.78 0.00 1.57 0.13 -1.81 -2.14 132.00 133.22 1za2 h PRO 135 Ca -0.18 -0.05 -0.03 0.00 -0.87 0.00 0.00 66.00 64.87 1za2 h PRO 135 Cb 1.14 -0.18 -0.00 0.00 0.13 0.00 0.00 31.00 32.09 1za2 h PRO 135 CO 0.08 0.52 -0.14 1.79 -0.23 0.00 0.00 178.00 180.01 1za2 h THR 136 N 0.80 0.67 -0.32 1.56 1.35 -1.93 -0.25 112.91 114.79 1za2 h THR 136 Ca 0.41 -0.59 -0.10 0.00 -0.55 0.00 0.00 66.41 65.58 1za2 h THR 136 Cb 0.39 1.37 -0.01 0.00 -1.73 0.00 0.00 68.15 68.17 1za2 h THR 136 CO -0.26 0.14 -0.18 -0.61 -0.25 0.00 0.00 175.52 174.36 1za2 h GLN 137 N 0.00 0.69 -0.47 4.72 5.75 -1.74 -2.49 115.11 121.57 1za2 h GLN 137 Ca -0.00 -0.32 -0.11 0.00 -0.15 0.00 0.00 58.65 58.07 1za2 h GLN 137 Cb 0.36 -0.01 -0.02 0.00 1.07 0.00 0.00 27.48 28.88 1za2 h GLN 137 CO 0.02 0.92 -0.14 1.15 -2.65 0.00 0.00 178.83 178.12 1za2 h THR 138 N 0.46 1.27 -0.64 2.39 2.02 -1.20 -1.57 112.91 115.63 1za2 h THR 138 Ca 0.07 -1.26 0.00 0.00 0.77 0.00 0.00 66.41 65.99 1za2 h THR 138 Cb 0.72 1.06 -0.03 0.00 -1.74 0.00 0.00 68.15 68.16 1za2 h THR 138 CO 0.05 0.44 0.41 -0.07 0.37 0.00 0.00 175.52 176.71 1za2 h LEU 139 N 0.79 0.76 -0.75 2.58 3.38 -0.96 0.12 115.31 121.23 1za2 h LEU 139 Ca 0.12 -0.04 -0.13 0.00 0.09 0.00 0.00 57.88 57.91 1za2 h LEU 139 Cb 0.67 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.22 1za2 h LEU 139 CO 0.05 0.58 -0.60 0.17 0.09 0.00 0.00 178.44 178.72 1za2 h LEU 140 N 0.87 0.09 -0.19 1.67 8.10 -1.30 -1.20 115.31 123.36 1za2 h LEU 140 Ca 0.23 -0.05 -0.02 0.00 0.11 0.00 0.00 57.88 58.15 1za2 h LEU 140 Cb -0.06 -0.03 -0.01 0.00 -0.44 0.00 0.00 40.66 40.13 1za2 h LEU 140 CO -0.05 0.67 0.04 0.44 -4.11 0.00 0.00 178.44 175.43 1za2 h ASP 141 N 0.06 0.30 -0.13 0.17 3.32 -0.64 -0.71 116.42 118.79 1za2 h ASP 141 Ca -0.01 -0.25 -0.00 0.00 0.02 0.00 0.00 57.03 56.79 1za2 h ASP 141 Cb 1.08 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 40.54 1za2 h ASP 141 CO 0.08 0.47 0.07 -0.07 -1.72 0.00 0.00 179.24 178.08 1za2 h LEU 142 N 0.11 0.16 -0.26 1.55 3.38 -0.67 0.77 115.31 120.36 1za2 h LEU 142 Ca 0.06 -0.06 0.06 0.00 0.09 0.00 0.00 57.88 58.02 1za2 h LEU 142 Cb 0.30 -0.04 -0.06 0.00 0.09 0.00 0.00 40.66 40.95 1za2 h LEU 142 CO 0.00 0.18 -0.12 0.15 0.09 0.00 0.00 178.44 178.74 1za2 h PHE 143 N 0.13 -0.29 -0.72 1.13 3.04 -1.16 -0.06 116.94 119.00 1za2 h PHE 143 Ca 0.05 0.03 0.05 0.00 3.98 0.00 0.00 57.97 62.08 1za2 h PHE 143 Cb 0.05 0.17 -0.05 0.00 2.56 0.00 0.00 35.95 38.68 1za2 h PHE 143 CO -0.05 -0.19 0.42 1.15 -2.02 0.00 0.00 178.31 177.63 1za2 h THR 144 N -0.09 1.01 -0.47 4.41 2.02 -0.65 0.40 112.91 119.54 1za2 h THR 144 Ca 0.14 -0.27 -0.10 0.00 0.77 0.00 0.00 66.41 66.95 1za2 h THR 144 Cb 0.29 0.15 -0.02 0.00 -1.74 0.00 0.00 68.15 66.84 1za2 h THR 144 CO -0.32 0.14 -0.08 0.40 0.37 0.00 0.00 175.52 176.04 1za2 h ILE 145 N 0.78 1.27 -0.25 3.11 2.04 -0.16 -2.52 117.51 121.78 1za2 h ILE 145 Ca 0.31 -1.19 -0.13 0.00 1.00 0.00 0.00 64.86 64.85 1za2 h ILE 145 Cb 0.15 1.08 -0.01 0.00 -0.74 0.00 0.00 36.82 37.30 1za2 h ILE 145 CO -0.17 0.41 -0.40 -0.61 0.00 0.00 0.00 178.15 177.38 1za2 h GLN 146 N 0.73 0.58 -0.67 2.37 4.15 -0.64 -0.35 115.11 121.28 1za2 h GLN 146 Ca 0.12 -0.30 -0.07 0.00 0.77 0.00 0.00 58.65 59.18 1za2 h GLN 146 Cb 0.62 0.00 -0.03 0.00 0.21 0.00 0.00 27.48 28.28 1za2 h GLN 146 CO 0.04 0.88 0.15 1.49 -1.93 0.00 0.00 178.83 179.47 1za2 h GLU 147 N 0.48 1.06 0.00 1.69 4.81 -0.84 0.46 114.58 122.24 1za2 h GLU 147 Ca 0.04 -0.25 -0.16 0.00 -0.13 0.00 0.00 59.36 58.86 1za2 h GLU 147 Cb 0.90 -0.14 -0.03 0.00 0.63 0.00 0.00 28.75 30.11 1za2 h GLU 147 CO 0.08 0.95 -1.34 1.79 -0.73 0.00 0.00 179.01 179.76 1za2 h THR 148 N 1.01 0.53 0.00 0.32 1.35 -1.37 -3.37 112.91 111.38 1za2 h THR 148 Ca 0.21 -2.02 0.00 0.00 -0.55 0.00 0.00 66.41 64.05 1za2 h THR 148 Cb 0.37 2.07 0.00 0.00 -1.73 0.00 0.00 68.15 68.85 1za2 h THR 148 CO 0.00 0.30 -0.80 0.00 -0.25 0.00 0.00 175.52 174.78 1za2 n GLN 149 N -2.92 2.11 -0.97 4.72 1.13 -0.15 -5.01 117.38 116.30 1za2 n GLN 149 Ca -0.09 -0.02 0.00 0.00 -1.94 0.00 0.00 57.00 54.96 1za2 n GLN 149 Cb 0.83 -1.19 0.00 0.00 0.11 0.00 0.00 30.24 30.00 1za2 n GLN 149 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1za2 n GLY 150 N 1.38 0.67 3.79 1.08 0.00 0.16 -4.96 105.19 107.32 1za2 n GLY 150 Ca 0.02 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.02 1za2 n GLY 150 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1za2 s ARG 151 N -0.19 1.04 -0.03 1.61 1.70 -1.22 -5.00 118.95 116.86 1za2 s ARG 151 Ca 0.00 -0.62 0.04 0.00 -0.47 0.00 0.00 55.73 54.68 1za2 s ARG 151 Cb 0.00 0.32 0.06 0.00 -0.57 0.00 0.00 34.95 34.76 1za2 s ARG 151 CO 0.00 -0.48 0.93 1.28 -1.08 0.00 0.00 175.30 175.95 1za2 n LEU 152 N -0.59 1.47 -4.35 -1.89 4.77 -1.26 -4.19 117.00 110.95 1za2 n LEU 152 Ca -0.05 -1.72 -0.21 0.00 -0.03 0.00 0.00 56.01 54.01 1za2 n LEU 152 Cb 0.60 -0.09 -0.11 0.00 -2.33 0.00 0.00 43.42 41.50 1za2 n LEU 152 CO 0.16 0.42 -0.47 1.51 -1.33 0.00 0.00 177.39 177.68 1za2 s ASP 153 N -1.19 2.70 -1.30 -1.43 3.84 -1.26 -4.61 116.67 113.41 1za2 s ASP 153 Ca 0.07 -0.93 -0.01 0.00 -0.00 0.00 0.00 52.55 51.68 1za2 s ASP 153 Cb 0.06 -0.16 -0.00 0.00 -1.38 0.00 0.00 42.92 41.44 1za2 s ASP 153 CO 0.01 -0.08 0.70 0.59 -0.00 0.00 0.00 175.17 176.39 1za2 n ASN 154 N -0.01 -1.31 -4.53 2.11 5.03 0.12 -4.89 115.26 111.77 1za2 n ASN 154 Ca -0.11 -0.83 -0.28 0.00 0.87 0.00 0.00 54.58 54.24 1za2 n ASN 154 Cb 0.58 -4.05 -0.10 0.00 -1.02 0.00 0.00 39.78 35.19 1za2 n ASN 154 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 1za2 s LEU 155 N -6.65 2.82 -0.36 3.41 1.43 -1.25 -4.91 118.68 113.17 1za2 s LEU 155 Ca 0.02 -0.60 -0.11 0.00 -1.03 0.00 0.00 54.13 52.41 1za2 s LEU 155 Cb -0.01 -1.56 0.02 0.00 0.03 0.00 0.00 46.19 44.67 1za2 s LEU 155 CO 0.81 0.13 0.20 -1.00 0.23 0.00 0.00 176.35 176.72 1za2 s HIS 156 N -1.50 3.22 -0.11 0.29 3.76 -1.26 -1.36 115.29 118.33 1za2 s HIS 156 Ca 0.22 -0.79 0.03 0.00 -0.15 0.00 0.00 55.06 54.36 1za2 s HIS 156 Cb -0.09 -2.43 0.01 0.00 1.11 0.00 0.00 32.58 31.18 1za2 s HIS 156 CO 0.13 -0.58 -0.20 0.08 -0.85 0.00 0.00 174.74 173.32 1za2 s VAL 157 N 1.59 1.82 -0.06 -0.90 1.01 -0.66 -0.49 120.40 122.71 1za2 s VAL 157 Ca 0.03 -0.85 0.01 0.00 0.00 0.00 0.00 61.98 61.17 1za2 s VAL 157 Cb -0.18 -1.61 -0.03 0.00 0.00 0.00 0.00 36.38 34.55 1za2 s VAL 157 CO 0.07 0.50 -0.06 0.00 0.00 0.00 0.00 175.10 175.62 1za2 s ALA 158 N 0.70 3.04 -0.07 5.51 0.00 -0.18 -0.84 121.76 129.91 1za2 s ALA 158 Ca -0.11 -0.90 0.02 0.00 0.00 0.00 0.00 51.96 50.97 1za2 s ALA 158 Cb -0.16 -1.25 0.01 0.00 0.00 0.00 0.00 23.12 21.72 1za2 s ALA 158 CO 0.02 0.58 -0.12 -1.64 0.00 0.00 0.00 175.76 174.60 1za2 s MET 159 N -0.92 1.71 0.11 0.00 -1.94 -0.70 0.19 119.30 117.76 1za2 s MET 159 Ca 0.13 -0.41 0.09 0.00 -1.71 0.00 0.00 55.69 53.80 1za2 s MET 159 Cb -0.11 -1.45 -0.04 0.00 2.01 0.00 0.00 34.83 35.25 1za2 s MET 159 CO 0.03 -0.00 -0.22 0.08 -0.01 0.00 0.00 175.02 174.89 1za2 s VAL 160 N 0.77 1.87 0.00 -6.03 1.01 -0.24 -1.52 120.40 116.26 1za2 s VAL 160 Ca -0.12 -1.62 0.00 0.00 0.00 0.00 0.00 61.98 60.23 1za2 s VAL 160 Cb -0.15 -1.69 0.00 0.00 0.00 0.00 0.00 36.38 34.53 1za2 s VAL 160 CO 0.02 -0.04 0.00 0.61 0.00 0.00 0.00 175.10 175.70 1za2 n GLY 161 N 0.99 0.46 3.48 4.51 0.00 -0.39 -2.28 105.19 111.96 1za2 n GLY 161 Ca -0.19 -1.78 -0.37 0.00 0.00 0.00 0.00 46.02 43.68 1za2 n GLY 161 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1za2 n ASP 162 N 0.00 3.97 0.16 1.61 4.64 -1.26 -4.34 116.55 121.34 1za2 n ASP 162 Ca 0.00 -2.81 0.05 0.00 -1.38 0.00 0.00 54.79 50.65 1za2 n ASP 162 Cb 0.00 -1.69 0.11 0.00 -1.04 0.00 0.00 41.12 38.50 1za2 n ASP 162 CO 0.00 0.00 0.00 -0.07 -0.82 0.00 0.00 177.20 176.31 1za2 h LEU 163 N 14.43 0.00 -0.42 -2.67 3.38 -1.75 -1.59 115.31 126.69 1za2 h LEU 163 Ca 0.37 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 58.25 1za2 h LEU 163 Cb 0.86 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.60 1za2 h LEU 163 CO 1.44 0.40 -0.09 0.50 0.09 0.00 0.00 178.44 180.78 1za2 h LYS 164 N 0.00 0.81 0.00 1.13 3.64 -1.24 -3.35 116.57 117.55 1za2 h LYS 164 Ca -0.00 -0.30 0.00 0.00 -1.27 0.00 0.00 60.65 59.07 1za2 h LYS 164 Cb 1.24 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 33.01 1za2 h LYS 164 CO 0.05 0.92 -1.16 0.66 -2.27 0.00 0.00 179.45 177.65 1za2 n TYR 165 N -4.32 0.00 -1.83 1.91 4.01 -1.25 -4.68 117.16 111.01 1za2 n TYR 165 Ca -0.01 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.31 1za2 n TYR 165 Cb 0.36 -0.17 -0.03 0.00 -0.31 0.00 0.00 39.34 39.19 1za2 n TYR 165 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 1za2 s GLY 166 N -2.95 1.20 0.15 2.72 0.00 -0.60 -4.87 107.32 102.96 1za2 s GLY 166 Ca -0.00 0.92 0.03 0.00 0.00 0.00 0.00 44.72 45.66 1za2 s GLY 166 CO 0.55 3.35 1.34 0.07 0.00 0.00 0.00 173.10 178.41 1za2 h ARG 167 N 11.44 0.16 -0.53 2.90 0.11 -1.89 -2.68 114.38 123.89 1za2 h ARG 167 Ca -0.42 -0.20 -0.12 0.00 0.10 0.00 0.00 59.98 59.34 1za2 h ARG 167 Cb 1.21 0.06 -0.02 0.00 1.11 0.00 0.00 29.97 32.33 1za2 h ARG 167 CO 0.96 0.98 -0.14 1.79 0.10 0.00 0.00 179.97 183.67 1za2 h THR 168 N 0.08 1.27 -0.18 0.08 1.35 -1.92 -0.50 112.91 113.09 1za2 h THR 168 Ca -0.05 -1.30 -0.14 0.00 -0.55 0.00 0.00 66.41 64.37 1za2 h THR 168 Cb 1.60 1.00 -0.01 0.00 -1.73 0.00 0.00 68.15 69.01 1za2 h THR 168 CO 0.14 0.46 -0.47 -0.37 -0.25 0.00 0.00 175.52 175.03 1za2 h VAL 169 N 0.91 1.32 -0.53 6.82 -1.51 -1.94 0.15 116.25 121.46 1za2 h VAL 169 Ca 0.13 -1.68 -0.03 0.00 -1.23 0.00 0.00 66.70 63.89 1za2 h VAL 169 Cb 0.71 1.70 -0.02 0.00 -2.13 0.00 0.00 31.29 31.55 1za2 h VAL 169 CO 0.05 0.52 0.22 0.45 -1.23 0.00 0.00 177.57 177.58 1za2 h HIS 170 N 0.37 0.79 -0.24 5.19 3.86 -1.22 -1.41 115.15 122.50 1za2 h HIS 170 Ca 0.02 -0.05 -0.07 0.00 -1.16 0.00 0.00 60.37 59.11 1za2 h HIS 170 Cb 0.97 -0.24 -0.01 0.00 1.06 0.00 0.00 27.41 29.20 1za2 h HIS 170 CO 0.03 0.64 -0.13 1.03 0.86 0.00 0.00 177.93 180.37 1za2 h SER 171 N 0.71 0.53 -0.71 2.45 0.87 -0.94 -2.59 113.55 113.87 1za2 h SER 171 Ca 0.18 -0.42 -0.03 0.00 -1.23 0.00 0.00 61.79 60.29 1za2 h SER 171 Cb 0.18 -0.15 -0.03 0.00 -0.44 0.00 0.00 62.40 61.96 1za2 h SER 171 CO -0.02 0.83 0.33 0.25 -0.53 0.00 0.00 176.83 177.69 1za2 h LEU 172 N 0.23 0.95 -0.30 2.23 5.85 -0.89 -0.37 115.31 123.02 1za2 h LEU 172 Ca 0.05 -0.12 -0.02 0.00 0.84 0.00 0.00 57.88 58.63 1za2 h LEU 172 Cb 0.63 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.41 1za2 h LEU 172 CO 0.04 0.82 0.10 0.74 -0.34 0.00 0.00 178.44 179.80 1za2 h THR 173 N 1.04 1.20 -0.17 1.05 2.02 -1.22 0.09 112.91 116.90 1za2 h THR 173 Ca 0.25 -0.62 0.01 0.00 0.77 0.00 0.00 66.41 66.81 1za2 h THR 173 Cb 0.14 1.05 -0.01 0.00 -1.74 0.00 0.00 68.15 67.58 1za2 h THR 173 CO -0.03 0.21 0.10 1.56 0.37 0.00 0.00 175.52 177.73 1za2 h GLN 174 N 0.32 0.20 0.24 6.66 1.08 -1.11 -0.41 115.11 122.10 1za2 h GLN 174 Ca 0.10 -0.01 -0.00 0.00 -1.45 0.00 0.00 58.65 57.28 1za2 h GLN 174 Cb 0.23 -0.04 -0.01 0.00 -0.05 0.00 0.00 27.48 27.60 1za2 h GLN 174 CO -0.00 0.13 -0.20 0.00 -0.95 0.00 0.00 178.83 177.81 1za2 h ALA 175 N 1.08 -0.43 0.00 3.87 0.00 -0.87 -1.80 119.26 121.11 1za2 h ALA 175 Ca 0.07 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1za2 h ALA 175 Cb -0.00 0.26 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 1za2 h ALA 175 CO -0.04 -0.76 -0.05 -0.07 0.00 0.00 0.00 179.25 178.33 1za2 h LEU 176 N -0.45 0.00 0.00 0.00 3.38 -0.92 -0.73 115.31 116.59 1za2 h LEU 176 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1za2 h LEU 176 Cb 0.40 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.15 1za2 h LEU 176 CO -0.02 0.05 0.00 0.00 0.09 0.00 0.00 178.44 178.57 1za2 n ALA 177 N -2.50 2.18 0.26 1.53 0.00 -0.17 -1.81 120.51 120.00 1za2 n ALA 177 Ca -0.03 -0.01 0.10 0.00 0.00 0.00 0.00 53.44 53.51 1za2 n ALA 177 Cb 0.14 -1.02 -0.15 0.00 0.00 0.00 0.00 19.45 18.42 1za2 n ALA 177 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1za2 n LYS 178 N -0.53 0.56 -2.83 0.00 5.02 -0.28 -4.95 118.16 115.16 1za2 n LYS 178 Ca 0.01 -0.14 -0.20 0.00 -2.02 0.00 0.00 58.31 55.96 1za2 n LYS 178 Cb 0.00 -1.48 0.06 0.00 -0.02 0.00 0.00 35.03 33.60 1za2 n LYS 178 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 1za2 s PHE 179 N -3.28 2.06 0.19 2.13 0.08 -0.75 -4.91 117.98 113.51 1za2 s PHE 179 Ca -0.03 -0.39 0.06 0.00 0.12 0.00 0.00 56.93 56.68 1za2 s PHE 179 Cb 0.14 -2.56 -0.04 0.00 -0.57 0.00 0.00 43.02 39.99 1za2 s PHE 179 CO 0.85 -1.08 0.16 -0.51 -0.10 0.00 0.00 175.22 174.54 1za2 s ASP 180 N -4.57 5.55 0.00 1.36 -0.00 -1.26 -4.65 116.67 113.10 1za2 s ASP 180 Ca 0.61 -0.16 0.00 0.00 -0.00 0.00 0.00 52.55 53.00 1za2 s ASP 180 Cb -0.08 -1.45 0.00 0.00 -0.00 0.00 0.00 42.92 41.40 1za2 s ASP 180 CO 0.39 0.03 0.00 0.61 -0.00 0.00 0.00 175.17 176.20 1za2 n GLY 181 N -0.64 0.17 3.75 0.21 0.00 -1.26 0.11 105.19 107.53 1za2 n GLY 181 Ca -0.08 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.53 1za2 n GLY 181 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1za2 s ASN 182 N -2.06 7.32 -0.07 1.61 0.01 -1.26 -3.67 114.94 116.82 1za2 s ASN 182 Ca 0.00 2.17 0.03 0.00 -0.71 0.00 0.00 52.86 54.35 1za2 s ASN 182 Cb 0.00 -2.62 0.01 0.00 0.41 0.00 0.00 41.25 39.05 1za2 s ASN 182 CO 0.00 -0.13 -0.17 -0.60 -1.51 0.00 0.00 177.10 174.69 1za2 s ARG 183 N -1.05 2.19 0.08 -0.60 3.52 -0.47 -4.21 118.95 118.41 1za2 s ARG 183 Ca 0.46 -0.61 0.03 0.00 -0.13 0.00 0.00 55.73 55.47 1za2 s ARG 183 Cb -0.30 -1.75 -0.04 0.00 -1.56 0.00 0.00 34.95 31.30 1za2 s ARG 183 CO 0.38 0.12 0.08 -0.06 -0.81 0.00 0.00 175.30 175.01 1za2 s PHE 184 N 0.43 3.21 -0.19 5.12 0.40 -0.27 -1.66 117.98 125.03 1za2 s PHE 184 Ca -0.14 0.09 0.00 0.00 -0.60 0.00 0.00 56.93 56.28 1za2 s PHE 184 Cb -0.16 -1.63 0.04 0.00 0.51 0.00 0.00 43.02 41.79 1za2 s PHE 184 CO 0.05 0.53 -0.07 0.71 0.70 0.00 0.00 175.22 177.13 1za2 s TYR 185 N -1.39 2.09 -0.32 0.36 1.51 -0.02 -1.70 117.35 117.88 1za2 s TYR 185 Ca 0.29 -1.38 -0.12 0.00 -1.01 0.00 0.00 57.07 54.85 1za2 s TYR 185 Cb -0.12 -1.49 -0.02 0.00 -0.11 0.00 0.00 41.96 40.22 1za2 s TYR 185 CO 0.22 -0.69 0.21 -0.06 -1.11 0.00 0.00 175.55 174.12 1za2 s PHE 186 N 1.50 3.21 -0.35 2.71 0.08 -0.26 -1.73 117.98 123.15 1za2 s PHE 186 Ca -0.01 -0.26 -0.03 0.00 0.12 0.00 0.00 56.93 56.75 1za2 s PHE 186 Cb -0.16 -2.43 0.07 0.00 -0.57 0.00 0.00 43.02 39.93 1za2 s PHE 186 CO -0.08 -0.36 0.10 0.42 -0.10 0.00 0.00 175.22 175.20 1za2 s ILE 187 N 1.70 3.19 0.06 0.64 1.09 -0.58 -1.92 121.20 125.39 1za2 s ILE 187 Ca 0.06 -1.64 -0.17 0.00 -1.10 0.00 0.00 60.65 57.80 1za2 s ILE 187 Cb -0.17 -2.99 0.03 0.00 -1.06 0.00 0.00 42.46 38.27 1za2 s ILE 187 CO 0.09 -0.36 0.38 0.00 -0.10 0.00 0.00 174.94 174.96 1za2 s ALA 188 N 1.22 -0.91 0.64 9.38 0.00 -1.26 -1.26 121.76 129.57 1za2 s ALA 188 Ca 0.01 0.16 -0.18 0.00 0.00 0.00 0.00 51.96 51.95 1za2 s ALA 188 Cb -0.21 0.42 -0.01 0.00 0.00 0.00 0.00 23.12 23.31 1za2 s ALA 188 CO -0.02 -0.49 1.25 -2.14 0.00 0.00 0.00 175.76 174.37 1za2 s PRO 189 N -2.80 2.65 0.29 0.00 0.02 -1.26 -4.78 135.00 129.11 1za2 s PRO 189 Ca -0.03 1.95 0.03 0.00 0.02 0.00 0.00 61.00 62.97 1za2 s PRO 189 Cb -0.00 -1.87 0.69 0.00 0.02 0.00 0.00 34.50 33.34 1za2 s PRO 189 CO -0.05 -1.49 1.72 -0.44 -0.33 0.00 0.00 177.00 176.42 1za2 h ASP 190 N 0.57 0.46 0.69 2.53 3.32 -2.00 0.18 116.42 122.17 1za2 h ASP 190 Ca -0.50 0.13 -0.02 0.00 0.02 0.00 0.00 57.03 56.66 1za2 h ASP 190 Cb 1.32 0.08 -0.00 0.00 0.22 0.00 0.00 39.33 40.94 1za2 h ASP 190 CO 0.53 0.09 -0.08 0.00 -1.72 0.00 0.00 179.24 178.06 1za2 h ALA 191 N 1.67 1.08 -1.11 3.45 0.00 -2.01 -3.22 119.26 119.11 1za2 h ALA 191 Ca 0.54 -0.07 -0.58 0.00 0.00 0.00 0.00 54.91 54.80 1za2 h ALA 191 Cb 0.96 -0.01 -0.42 0.00 0.00 0.00 0.00 17.79 18.32 1za2 h ALA 191 CO -0.47 0.10 -0.71 1.28 0.00 0.00 0.00 179.25 179.46 1za2 n LEU 192 N -3.30 4.94 -4.82 0.00 4.77 0.62 -4.93 117.00 114.29 1za2 n LEU 192 Ca -0.01 -4.95 -0.32 0.00 -0.03 0.00 0.00 56.01 50.70 1za2 n LEU 192 Cb 0.28 -0.42 0.01 0.00 -2.33 0.00 0.00 43.42 40.96 1za2 n LEU 192 CO 0.28 2.15 0.71 0.00 -1.33 0.00 0.00 177.39 179.20 1za2 s ALA 193 N -3.59 2.82 0.24 -1.18 0.00 -1.09 -2.36 121.76 116.61 1za2 s ALA 193 Ca 0.50 0.27 -0.31 0.00 0.00 0.00 0.00 51.96 52.42 1za2 s ALA 193 Cb 0.41 -3.19 -0.12 0.00 0.00 0.00 0.00 23.12 20.22 1za2 s ALA 193 CO -0.07 -0.74 1.61 -0.12 0.00 0.00 0.00 175.76 176.43 1za2 n MET 194 N -2.14 2.56 -1.74 0.00 1.56 -1.26 -2.64 117.12 113.46 1za2 n MET 194 Ca 0.08 0.92 -0.39 0.00 -0.27 0.00 0.00 57.70 58.04 1za2 n MET 194 Cb 0.53 -2.70 0.04 0.00 2.15 0.00 0.00 33.22 33.24 1za2 n MET 194 CO 0.00 0.00 0.00 -0.35 -0.73 0.00 0.00 175.97 174.89 1za2 n PRO 195 N 2.86 1.68 -0.20 2.12 -0.04 -1.26 -4.86 135.00 135.29 1za2 n PRO 195 Ca 0.12 0.62 -0.02 0.00 -0.04 0.00 0.00 63.50 64.19 1za2 n PRO 195 Cb 0.34 -2.56 0.09 0.00 -0.04 0.00 0.00 33.50 31.34 1za2 n PRO 195 CO 0.00 0.00 0.00 0.37 -0.04 0.00 0.00 175.50 175.83 1za2 h GLN 196 N 1.43 0.51 -0.29 0.54 5.75 -1.99 -1.46 115.11 119.59 1za2 h GLN 196 Ca -0.51 -0.03 0.09 0.00 -0.15 0.00 0.00 58.65 58.05 1za2 h GLN 196 Cb 1.31 -0.11 -0.01 0.00 1.07 0.00 0.00 27.48 29.73 1za2 h GLN 196 CO 0.57 0.34 0.35 0.10 -2.65 0.00 0.00 178.83 177.53 1za2 h TYR 197 N 0.52 0.00 0.12 3.99 -0.00 -2.00 0.29 116.97 119.90 1za2 h TYR 197 Ca 0.28 0.00 -0.18 0.00 -0.00 0.00 0.00 58.73 58.83 1za2 h TYR 197 Cb 0.25 0.00 0.02 0.00 -0.00 0.00 0.00 36.73 37.00 1za2 h TYR 197 CO -0.12 0.00 -0.80 0.82 -0.00 0.00 0.00 178.16 178.06 1za2 h ILE 198 N 0.00 1.49 -0.68 -0.90 1.08 -1.64 -2.87 117.51 113.99 1za2 h ILE 198 Ca 0.14 -2.47 0.01 0.00 -0.39 0.00 0.00 64.86 62.15 1za2 h ILE 198 Cb 0.83 3.10 -0.03 0.00 -3.07 0.00 0.00 36.82 37.64 1za2 h ILE 198 CO -0.00 0.70 0.45 -0.07 -0.69 0.00 0.00 178.15 178.54 1za2 h LEU 199 N -0.31 0.77 -0.11 1.44 3.38 -0.23 -1.59 115.31 118.65 1za2 h LEU 199 Ca -0.13 -0.02 -0.04 0.00 0.09 0.00 0.00 57.88 57.78 1za2 h LEU 199 Cb 1.60 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 42.16 1za2 h LEU 199 CO 0.15 0.55 -0.09 0.44 0.09 0.00 0.00 178.44 179.59 1za2 h ASP 200 N 0.91 0.27 -0.85 -0.43 3.32 -1.04 -2.15 116.42 116.45 1za2 h ASP 200 Ca 0.25 -0.46 0.17 0.00 0.02 0.00 0.00 57.03 57.02 1za2 h ASP 200 Cb -0.08 -0.08 -0.11 0.00 0.22 0.00 0.00 39.33 39.29 1za2 h ASP 200 CO -0.06 0.67 0.39 -0.03 -1.72 0.00 0.00 179.24 178.50 1za2 h MET 201 N -0.13 0.49 -0.07 3.56 4.05 -1.20 0.29 114.93 121.92 1za2 h MET 201 Ca 0.02 -0.03 -0.10 0.00 -0.28 0.00 0.00 59.70 59.31 1za2 h MET 201 Cb 0.59 -0.11 -0.01 0.00 -0.80 0.00 0.00 31.60 31.26 1za2 h MET 201 CO 0.02 0.32 -0.40 -0.07 0.23 0.00 0.00 176.91 177.02 1za2 h LEU 202 N 0.50 0.15 0.02 3.39 3.38 -1.15 -3.11 115.31 118.49 1za2 h LEU 202 Ca 0.49 -0.06 -0.00 0.00 0.09 0.00 0.00 57.88 58.40 1za2 h LEU 202 Cb 0.81 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.52 1za2 h LEU 202 CO -0.44 0.54 -0.01 0.44 0.09 0.00 0.00 178.44 179.07 1za2 h ASP 203 N 0.12 -0.02 -1.05 -0.43 3.32 0.16 0.24 116.42 118.76 1za2 h ASP 203 Ca 0.01 -0.60 0.29 0.00 0.02 0.00 0.00 57.03 56.75 1za2 h ASP 203 Cb 0.76 0.01 -0.06 0.00 0.22 0.00 0.00 39.33 40.26 1za2 h ASP 203 CO 0.06 0.60 0.73 -0.33 -1.72 0.00 0.00 179.24 178.58 1za2 h GLU 204 N -0.65 0.14 -0.35 3.56 5.08 -0.99 1.47 114.58 122.83 1za2 h GLU 204 Ca -0.00 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1za2 h GLU 204 Cb 0.62 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.84 1za2 h GLU 204 CO 0.00 0.09 0.00 1.63 -1.00 0.00 0.00 179.01 179.74 1za2 n LYS 205 N -4.36 2.06 -3.75 2.33 5.02 -1.18 -4.94 118.16 113.33 1za2 n LYS 205 Ca 0.23 -1.62 -0.24 0.00 -2.02 0.00 0.00 58.31 54.67 1za2 n LYS 205 Cb 1.03 -1.41 0.03 0.00 -0.02 0.00 0.00 35.03 34.67 1za2 n LYS 205 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1za2 n GLY 206 N 1.26 -0.36 3.65 0.72 0.00 0.50 -4.97 105.19 105.99 1za2 n GLY 206 Ca 0.17 0.15 -0.35 0.00 0.00 0.00 0.00 46.02 45.99 1za2 n GLY 206 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1za2 s ILE 207 N -3.54 4.84 -0.01 -0.61 1.01 0.82 -5.02 121.20 118.69 1za2 s ILE 207 Ca 0.23 -0.02 -0.30 0.00 0.00 0.00 0.00 60.65 60.56 1za2 s ILE 207 Cb -0.11 -3.18 -0.04 0.00 0.01 0.00 0.00 42.46 39.14 1za2 s ILE 207 CO 0.81 0.47 1.11 0.00 0.00 0.00 0.00 174.94 177.33 1za2 s ALA 208 N 0.31 3.36 0.01 9.38 0.00 -1.26 -4.52 121.76 129.04 1za2 s ALA 208 Ca 0.04 0.63 -0.07 0.00 0.00 0.00 0.00 51.96 52.56 1za2 s ALA 208 Cb -0.12 -3.43 -0.00 0.00 0.00 0.00 0.00 23.12 19.56 1za2 s ALA 208 CO -0.00 -0.49 0.13 1.67 0.00 0.00 0.00 175.76 177.06 1za2 s TRP 209 N 1.50 0.08 0.06 0.00 1.48 -1.26 -1.11 118.94 119.68 1za2 s TRP 209 Ca 0.55 -0.23 -0.12 0.00 -1.06 0.00 0.00 56.10 55.23 1za2 s TRP 209 Cb -0.24 -0.07 0.01 0.00 -1.16 0.00 0.00 33.47 32.01 1za2 s TRP 209 CO 0.25 -0.31 0.26 -1.54 -4.06 0.00 0.00 176.95 171.56 1za2 s SER 210 N -1.58 -0.05 0.07 -2.66 1.04 -0.69 -4.97 113.70 104.86 1za2 s SER 210 Ca -0.12 -0.33 -0.03 0.00 0.48 0.00 0.00 55.95 55.94 1za2 s SER 210 Cb -0.06 0.35 -0.05 0.00 0.10 0.00 0.00 66.02 66.36 1za2 s SER 210 CO 0.00 -0.64 0.27 -0.76 0.98 0.00 0.00 173.24 173.09 1za2 s LEU 211 N -2.27 4.33 -0.11 2.42 1.43 -1.26 -1.10 118.68 122.12 1za2 s LEU 211 Ca -0.03 0.45 -0.09 0.00 -1.03 0.00 0.00 54.13 53.44 1za2 s LEU 211 Cb 0.00 -2.96 0.03 0.00 0.03 0.00 0.00 46.19 43.29 1za2 s LEU 211 CO -0.06 0.16 0.28 -1.00 0.23 0.00 0.00 176.35 175.97 1za2 s HIS 212 N -1.48 -0.32 -1.30 0.29 3.76 -0.81 -4.91 115.29 110.52 1za2 s HIS 212 Ca 0.34 0.77 0.28 0.00 -0.15 0.00 0.00 55.06 56.30 1za2 s HIS 212 Cb -0.13 0.10 1.09 0.00 1.11 0.00 0.00 32.58 34.76 1za2 s HIS 212 CO 0.23 -0.16 1.80 -1.13 -0.85 0.00 0.00 174.74 174.62 1za2 n SER 213 N 3.15 0.31 -3.86 1.40 3.41 -1.26 -4.04 113.62 112.72 1za2 n SER 213 Ca -0.15 -0.16 -0.11 0.00 -0.26 0.00 0.00 58.87 58.19 1za2 n SER 213 Cb 0.57 -0.14 -0.10 0.00 -0.26 0.00 0.00 64.21 64.28 1za2 n SER 213 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1za2 s SER 214 N -2.75 0.00 0.10 4.04 1.04 -1.26 -4.80 113.70 110.07 1za2 s SER 214 Ca 0.21 -0.19 -0.18 0.00 0.48 0.00 0.00 55.95 56.27 1za2 s SER 214 Cb 0.19 0.22 -0.06 0.00 0.10 0.00 0.00 66.02 66.47 1za2 s SER 214 CO 0.54 -0.40 1.56 0.40 0.98 0.00 0.00 173.24 176.32 1za2 h ILE 215 N 4.14 1.24 -0.15 -1.02 2.04 -1.88 -2.79 117.51 119.09 1za2 h ILE 215 Ca -0.31 -0.84 0.04 0.00 1.00 0.00 0.00 64.86 64.75 1za2 h ILE 215 Cb 1.19 1.23 -0.01 0.00 -0.74 0.00 0.00 36.82 38.50 1za2 h ILE 215 CO 0.41 0.27 0.23 -0.08 0.00 0.00 0.00 178.15 178.98 1za2 h GLU 216 N 0.30 0.00 0.00 2.37 4.81 -1.92 -1.19 114.58 118.95 1za2 h GLU 216 Ca 0.09 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.32 1za2 h GLU 216 Cb 0.37 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.75 1za2 h GLU 216 CO 0.01 0.00 0.00 1.49 -0.73 0.00 0.00 179.01 179.78 1za2 h GLU 217 N 0.00 0.00 0.00 1.92 4.81 -1.92 -3.31 114.58 116.08 1za2 h GLU 217 Ca 0.07 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.30 1za2 h GLU 217 Cb 0.53 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.91 1za2 h GLU 217 CO -0.00 0.00 -0.09 1.55 -0.73 0.00 0.00 179.01 179.74 1za2 n VAL 218 N -2.68 0.00 -0.27 0.32 3.14 -0.51 -4.87 118.33 113.46 1za2 n VAL 218 Ca 0.02 -0.34 -0.02 0.00 -2.96 0.00 0.00 64.34 61.04 1za2 n VAL 218 Cb 0.33 0.93 0.01 0.00 -1.06 0.00 0.00 33.84 34.05 1za2 n VAL 218 CO 0.00 0.00 0.00 0.80 -6.46 0.00 0.00 176.83 171.17 1za2 n MET 219 N -0.81 -0.19 -0.02 1.45 0.00 -0.81 -1.81 117.12 114.94 1za2 n MET 219 Ca 0.00 1.04 0.24 0.00 0.00 0.00 0.00 57.70 58.98 1za2 n MET 219 Cb 0.00 -1.54 0.70 0.00 0.00 0.00 0.00 33.22 32.38 1za2 n MET 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1za2 h ALA 220 N 0.81 2.41 -0.00 -5.12 0.00 -1.85 -3.09 119.26 112.42 1za2 h ALA 220 Ca 0.21 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1za2 h ALA 220 Cb 0.38 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.22 1za2 h ALA 220 CO -0.67 -0.93 -0.03 -0.85 0.00 0.00 0.00 179.25 176.78 1za2 n GLU 221 N -3.76 2.12 -2.47 0.00 0.28 -0.75 -4.48 120.64 111.59 1za2 n GLU 221 Ca 0.12 -0.36 -0.37 0.00 -0.16 0.00 0.00 57.16 56.39 1za2 n GLU 221 Cb 0.84 -0.85 -0.03 0.00 1.43 0.00 0.00 31.44 32.83 1za2 n GLU 221 CO 0.00 0.00 0.00 0.14 -0.16 0.00 0.00 177.13 177.11 1za2 s VAL 222 N -0.53 3.56 -0.15 3.84 -7.23 -1.17 -4.72 120.40 113.99 1za2 s VAL 222 Ca 0.01 1.22 0.16 0.00 -1.81 0.00 0.00 61.98 61.56 1za2 s VAL 222 Cb 0.01 -3.64 -0.23 0.00 0.56 0.00 0.00 36.38 33.08 1za2 s VAL 222 CO 0.04 0.03 0.13 0.47 -0.31 0.00 0.00 175.10 175.45 1za2 n ASP 223 N -0.06 0.68 -3.82 4.85 8.00 0.36 -4.56 116.55 122.00 1za2 n ASP 223 Ca 0.05 0.00 -0.26 0.00 0.71 0.00 0.00 54.79 55.29 1za2 n ASP 223 Cb 0.49 1.11 -0.17 0.00 -0.02 0.00 0.00 41.12 42.52 1za2 n ASP 223 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1za2 s ILE 224 N -2.59 0.68 -0.54 0.53 -1.09 -1.05 -2.03 121.20 115.12 1za2 s ILE 224 Ca -0.08 -0.22 -0.13 0.00 -2.23 0.00 0.00 60.65 57.99 1za2 s ILE 224 Cb 0.06 -0.87 0.14 0.00 -1.58 0.00 0.00 42.46 40.21 1za2 s ILE 224 CO 0.73 0.19 0.46 -0.22 -1.23 0.00 0.00 174.94 174.87 1za2 s LEU 225 N 1.83 6.01 -0.52 2.97 2.96 -0.36 -1.01 118.68 130.56 1za2 s LEU 225 Ca 0.03 -1.96 -0.21 0.00 -0.22 0.00 0.00 54.13 51.77 1za2 s LEU 225 Cb -0.14 -2.12 0.05 0.00 0.50 0.00 0.00 46.19 44.49 1za2 s LEU 225 CO -0.07 -0.75 0.73 -0.47 -1.32 0.00 0.00 176.35 174.48 1za2 s TYR 226 N 1.31 2.96 0.02 5.38 6.14 0.13 -0.83 117.35 132.46 1za2 s TYR 226 Ca 0.06 -0.34 -0.11 0.00 0.64 0.00 0.00 57.07 57.32 1za2 s TYR 226 Cb -0.26 -3.71 -0.05 0.00 0.42 0.00 0.00 41.96 38.35 1za2 s TYR 226 CO 0.00 -1.13 0.36 -1.64 0.64 0.00 0.00 175.55 173.78 1za2 s MET 227 N 3.09 3.77 0.14 4.97 -1.94 0.90 -1.08 119.30 129.15 1za2 s MET 227 Ca 0.21 0.22 0.01 0.00 -1.71 0.00 0.00 55.69 54.41 1za2 s MET 227 Cb -0.17 -3.12 -0.04 0.00 2.01 0.00 0.00 34.83 33.51 1za2 s MET 227 CO 0.15 0.65 -0.01 0.95 -0.01 0.00 0.00 175.02 176.74 1za2 s THR 228 N -1.22 0.57 -0.09 2.05 -4.23 -0.97 -4.02 115.64 107.74 1za2 s THR 228 Ca 0.27 -1.95 -0.26 0.00 -1.18 0.00 0.00 61.69 58.56 1za2 s THR 228 Cb -0.15 -1.96 -0.02 0.00 1.34 0.00 0.00 72.50 71.71 1za2 s THR 228 CO 0.14 -0.61 0.85 0.00 -0.54 0.00 0.00 174.62 174.47 1za2 s ARG 229 N -3.91 4.42 -0.48 3.99 1.70 -1.26 -4.52 118.95 118.90 1za2 s ARG 229 Ca 0.20 1.13 -0.27 0.00 -0.47 0.00 0.00 55.73 56.32 1za2 s ARG 229 Cb 0.06 -3.50 -0.03 0.00 -0.57 0.00 0.00 34.95 30.91 1za2 s ARG 229 CO 0.01 -0.13 1.99 0.08 -1.08 0.00 0.00 175.30 176.16 1za2 s VAL 230 N 1.42 3.29 -0.83 4.99 1.01 -1.26 -4.07 120.40 124.95 1za2 s VAL 230 Ca 0.43 0.23 -0.26 0.00 0.00 0.00 0.00 61.98 62.38 1za2 s VAL 230 Cb -0.18 -3.59 -0.15 0.00 0.00 0.00 0.00 36.38 32.46 1za2 s VAL 230 CO 0.19 -0.51 2.37 -1.10 0.00 0.00 0.00 175.10 176.05 1za2 s GLN 231 N 6.86 1.53 0.21 2.72 -1.52 -1.26 -4.72 119.66 123.48 1za2 s GLN 231 Ca 0.80 0.36 -0.10 0.00 -1.95 0.00 0.00 55.36 54.47 1za2 s GLN 231 Cb -0.18 -4.81 0.28 0.00 -0.22 0.00 0.00 33.01 28.08 1za2 s GLN 231 CO 0.27 -4.61 1.72 0.87 -0.25 0.00 0.00 175.29 173.29 1za2 h LYS 232 N 12.53 0.30 0.00 2.91 1.57 -1.94 0.17 116.57 132.11 1za2 h LYS 232 Ca 0.00 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1za2 h LYS 232 Cb 1.00 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 33.24 1za2 h LYS 232 CO 1.01 0.20 0.20 0.93 -0.57 0.00 0.00 179.45 181.21 1za2 h GLU 233 N 0.30 0.00 -0.05 3.15 3.07 -2.00 0.54 114.58 119.60 1za2 h GLU 233 Ca 0.30 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.16 1za2 h GLU 233 Cb 0.42 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.33 1za2 h GLU 233 CO -0.36 0.00 0.00 0.54 -1.40 0.00 0.00 179.01 177.79 1za2 n ARG 234 N -2.23 1.44 -4.30 2.33 1.74 0.05 -4.87 116.66 110.81 1za2 n ARG 234 Ca -0.01 -0.65 -0.16 0.00 -0.77 0.00 0.00 57.85 56.26 1za2 n ARG 234 Cb 0.23 -1.44 -0.10 0.00 -1.02 0.00 0.00 32.46 30.13 1za2 n ARG 234 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1za2 s LEU 235 N -1.84 2.29 0.06 0.55 1.43 0.19 -5.07 118.68 116.29 1za2 s LEU 235 Ca 0.38 -1.15 -0.31 0.00 -1.03 0.00 0.00 54.13 52.02 1za2 s LEU 235 Cb 0.19 -0.28 -0.06 0.00 0.03 0.00 0.00 46.19 46.07 1za2 s LEU 235 CO 0.31 -0.46 1.29 -0.62 0.23 0.00 0.00 176.35 177.10 1za2 s ASP 236 N -3.26 6.96 0.27 2.29 2.15 -1.26 -4.87 116.67 118.96 1za2 s ASP 236 Ca 0.25 2.12 0.04 0.00 0.43 0.00 0.00 52.55 55.39 1za2 s ASP 236 Cb 0.05 -2.58 0.73 0.00 -0.30 0.00 0.00 42.92 40.82 1za2 s ASP 236 CO 0.06 -0.57 1.34 -2.65 -0.17 0.00 0.00 175.17 173.18 1za2 n PRO 237 N 4.23 -0.07 0.08 4.34 -0.02 -1.26 0.55 135.00 142.85 1za2 n PRO 237 Ca 0.10 1.27 -0.10 0.00 -2.02 0.00 0.00 63.50 62.75 1za2 n PRO 237 Cb 0.45 -2.05 -0.06 0.00 -0.02 0.00 0.00 33.50 31.81 1za2 n PRO 237 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 1za2 h SER 238 N 0.00 0.23 0.07 2.55 0.02 -2.00 -2.95 113.55 111.47 1za2 h SER 238 Ca 0.55 -0.21 0.01 0.00 -0.84 0.00 0.00 61.79 61.29 1za2 h SER 238 Cb 1.20 -0.07 -0.01 0.00 0.14 0.00 0.00 62.40 63.66 1za2 h SER 238 CO -0.78 1.09 -0.10 -0.08 -1.14 0.00 0.00 176.83 175.82 1za2 h GLU 239 N 0.07 -0.19 0.08 3.45 4.81 -0.26 -2.86 114.58 119.68 1za2 h GLU 239 Ca -0.06 0.01 0.02 0.00 -0.13 0.00 0.00 59.36 59.21 1za2 h GLU 239 Cb 1.68 0.04 -0.05 0.00 0.63 0.00 0.00 28.75 31.05 1za2 h GLU 239 CO 0.15 -0.13 -0.37 -0.92 -0.73 0.00 0.00 179.01 177.01 1za2 h TYR 240 N -0.20 -1.02 -1.10 0.92 5.03 -1.23 -2.68 116.97 116.70 1za2 h TYR 240 Ca 0.01 0.03 0.31 0.00 2.58 0.00 0.00 58.73 61.66 1za2 h TYR 240 Cb 0.21 0.44 -0.11 0.00 1.55 0.00 0.00 36.73 38.82 1za2 h TYR 240 CO -0.13 -0.47 0.70 0.00 -1.32 0.00 0.00 178.16 176.94 1za2 h ALA 241 N 0.02 2.30 -0.05 1.82 0.00 -1.35 0.40 119.26 122.41 1za2 h ALA 241 Ca 0.04 0.09 -0.13 0.00 0.00 0.00 0.00 54.91 54.90 1za2 h ALA 241 Cb 0.62 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 1za2 h ALA 241 CO -0.24 -0.78 -0.58 -0.91 0.00 0.00 0.00 179.25 176.74 1za2 h ASN 242 N 0.33 0.16 -0.00 0.00 2.35 -1.26 -3.29 115.58 113.87 1za2 h ASN 242 Ca 0.66 -0.09 0.00 0.00 -0.55 0.00 0.00 56.30 56.32 1za2 h ASN 242 Cb 1.74 -0.05 0.00 0.00 0.05 0.00 0.00 38.32 40.07 1za2 h ASN 242 CO -0.35 0.71 -0.43 1.33 -1.65 0.00 0.00 177.43 177.03 1za2 n VAL 243 N -3.88 0.00 -0.09 2.81 0.24 -0.44 -4.78 118.33 112.20 1za2 n VAL 243 Ca -0.02 -0.28 -0.03 0.00 -2.04 0.00 0.00 64.34 61.97 1za2 n VAL 243 Cb 0.59 1.06 -0.02 0.00 -1.47 0.00 0.00 33.84 34.00 1za2 n VAL 243 CO 0.00 0.00 0.00 0.50 -2.14 0.00 0.00 176.83 175.19 1za2 h LYS 244 N 0.58 -0.01 0.00 7.34 3.64 -0.34 -2.06 116.57 125.72 1za2 h LYS 244 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1za2 h LYS 244 Cb 0.34 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.16 1za2 h LYS 244 CO 0.00 -0.01 0.74 0.00 -2.27 0.00 0.00 179.45 177.91 1za2 h ALA 245 N -0.71 1.69 0.00 5.00 0.00 -1.86 0.52 119.26 123.90 1za2 h ALA 245 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1za2 h ALA 245 Cb 0.10 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1za2 h ALA 245 CO -0.21 -0.69 -0.53 1.96 0.00 0.00 0.00 179.25 179.79 1za2 h GLN 246 N 0.00 0.00 -0.14 0.00 4.20 -1.68 -3.35 115.11 114.14 1za2 h GLN 246 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1za2 h GLN 246 Cb 1.48 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.26 1za2 h GLN 246 CO 0.00 0.00 0.00 1.19 -0.67 0.00 0.00 178.83 179.35 1za2 n PHE 247 N -2.33 0.23 -4.23 2.96 3.72 0.18 -3.01 117.46 114.98 1za2 n PHE 247 Ca 0.03 -0.59 -0.30 0.00 -0.05 0.00 0.00 57.45 56.54 1za2 n PHE 247 Cb 0.47 -0.08 -0.09 0.00 -0.94 0.00 0.00 39.48 38.84 1za2 n PHE 247 CO 0.00 0.00 0.00 0.14 -0.05 0.00 0.00 176.76 176.85 1za2 s VAL 248 N -1.38 3.70 0.01 -4.37 -7.23 -1.20 -4.79 120.40 105.15 1za2 s VAL 248 Ca 0.15 -1.05 0.06 0.00 -1.81 0.00 0.00 61.98 59.34 1za2 s VAL 248 Cb 0.10 -2.72 -0.03 0.00 0.56 0.00 0.00 36.38 34.29 1za2 s VAL 248 CO 0.06 0.17 -0.19 -0.22 -0.31 0.00 0.00 175.10 174.62 1za2 s LEU 249 N -2.08 2.52 0.19 1.32 2.96 0.45 -4.97 118.68 119.06 1za2 s LEU 249 Ca 0.22 -0.38 -0.02 0.00 -0.22 0.00 0.00 54.13 53.72 1za2 s LEU 249 Cb -0.11 -1.48 -0.04 0.00 0.50 0.00 0.00 46.19 45.06 1za2 s LEU 249 CO 0.14 0.29 0.15 0.00 -1.32 0.00 0.00 176.35 175.62 1za2 s ARG 250 N -1.10 1.18 0.26 1.98 1.70 -1.26 -1.03 118.95 120.67 1za2 s ARG 250 Ca 0.13 -1.54 -0.03 0.00 -0.47 0.00 0.00 55.73 53.81 1za2 s ARG 250 Cb -0.10 0.29 0.38 0.00 -0.57 0.00 0.00 34.95 34.95 1za2 s ARG 250 CO 0.03 -0.39 1.87 0.00 -1.08 0.00 0.00 175.30 175.73 1za2 h ALA 251 N 2.63 1.33 -0.01 7.88 0.00 -1.90 -2.54 119.26 126.65 1za2 h ALA 251 Ca -0.35 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.54 1za2 h ALA 251 Cb 1.24 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 18.74 1za2 h ALA 251 CO 0.52 0.40 -0.02 0.66 0.00 0.00 0.00 179.25 180.81 1za2 h SER 252 N 1.12 0.01 0.65 0.00 4.64 -1.97 -1.61 113.55 116.38 1za2 h SER 252 Ca 0.41 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.73 1za2 h SER 252 Cb 0.16 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.25 1za2 h SER 252 CO -0.17 0.03 0.00 0.44 -0.87 0.00 0.00 176.83 176.26 1za2 h ASP 253 N 0.01 0.00 -0.31 4.97 3.32 -1.87 -2.97 116.42 119.56 1za2 h ASP 253 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1za2 h ASP 253 Cb 0.05 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.60 1za2 h ASP 253 CO 0.00 0.00 0.00 0.18 -1.72 0.00 0.00 179.24 177.70 1za2 n LEU 254 N -2.52 2.66 -0.20 1.55 4.77 -0.61 -4.45 117.00 118.22 1za2 n LEU 254 Ca 0.01 -1.34 -0.02 0.00 -0.03 0.00 0.00 56.01 54.63 1za2 n LEU 254 Cb 0.21 -0.43 0.20 0.00 -2.33 0.00 0.00 43.42 41.06 1za2 n LEU 254 CO 0.20 0.45 1.11 1.12 -1.33 0.00 0.00 177.39 178.95 1za2 h HIS 255 N 2.00 0.96 -0.29 -1.77 2.07 -1.69 -3.08 115.15 113.34 1za2 h HIS 255 Ca 0.00 -0.03 0.00 0.00 -2.85 0.00 0.00 60.37 57.49 1za2 h HIS 255 Cb 0.88 -0.30 0.00 0.00 2.57 0.00 0.00 27.41 30.56 1za2 h HIS 255 CO 0.40 0.70 0.00 0.27 -3.07 0.00 0.00 177.93 176.22 1za2 n ASN 256 N -4.34 3.89 -4.77 3.10 6.94 -1.26 -5.02 115.26 113.79 1za2 n ASN 256 Ca 0.06 -2.88 -0.32 0.00 -0.02 0.00 0.00 54.58 51.42 1za2 n ASN 256 Cb 0.13 -0.52 0.06 0.00 -2.36 0.00 0.00 39.78 37.09 1za2 n ASN 256 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1za2 s ALA 257 N -2.59 2.45 0.39 -2.53 0.00 -1.17 -4.15 121.76 114.16 1za2 s ALA 257 Ca 0.41 0.44 -0.25 0.00 0.00 0.00 0.00 51.96 52.56 1za2 s ALA 257 Cb 0.32 -3.29 -0.09 0.00 0.00 0.00 0.00 23.12 20.06 1za2 s ALA 257 CO 0.10 -1.36 1.10 0.15 0.00 0.00 0.00 175.76 175.75 1za2 s LYS 258 N -4.33 4.16 0.35 0.00 1.02 -1.26 -4.94 119.74 114.73 1za2 s LYS 258 Ca 0.65 1.66 0.08 0.00 0.02 0.00 0.00 55.97 58.38 1za2 s LYS 258 Cb -0.19 -2.65 0.80 0.00 -0.52 0.00 0.00 37.83 35.27 1za2 s LYS 258 CO 0.45 -0.18 1.86 0.00 -0.92 0.00 0.00 175.35 176.56 1za2 h ALA 259 N 2.66 1.81 -0.00 5.17 0.00 -1.95 -1.75 119.26 125.20 1za2 h ALA 259 Ca -0.48 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1za2 h ALA 259 Cb 1.22 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.89 1za2 h ALA 259 CO 0.63 -0.06 -0.28 0.27 0.00 0.00 0.00 179.25 179.80 1za2 n ASN 260 N -4.58 0.32 -4.75 0.00 6.94 -1.26 -4.92 115.26 107.01 1za2 n ASN 260 Ca 0.18 -0.00 -0.41 0.00 -0.02 0.00 0.00 54.58 54.33 1za2 n ASN 260 Cb 0.48 -0.05 -0.02 0.00 -2.36 0.00 0.00 39.78 37.83 1za2 n ASN 260 CO 0.00 0.00 0.00 -0.32 -1.03 0.00 0.00 177.26 175.91 1za2 s MET 261 N -2.96 4.23 0.05 -3.83 1.75 -0.66 -4.86 119.30 113.02 1za2 s MET 261 Ca 0.13 2.37 0.08 0.00 -1.25 0.00 0.00 55.69 57.03 1za2 s MET 261 Cb 0.18 -3.08 -0.03 0.00 2.84 0.00 0.00 34.83 34.75 1za2 s MET 261 CO 0.62 -0.46 -0.23 0.15 -0.65 0.00 0.00 175.02 174.45 1za2 s LYS 262 N -0.60 1.57 -0.26 4.11 -0.14 -0.86 -4.62 119.74 118.95 1za2 s LYS 262 Ca 0.59 -1.03 -0.10 0.00 -1.36 0.00 0.00 55.97 54.07 1za2 s LYS 262 Cb -0.43 -1.73 -0.05 0.00 -1.68 0.00 0.00 37.83 33.94 1za2 s LYS 262 CO 0.46 0.44 0.17 0.08 -0.76 0.00 0.00 175.35 175.74 1za2 s VAL 263 N -0.81 5.26 0.29 3.17 1.01 -0.09 -1.23 120.40 128.00 1za2 s VAL 263 Ca 0.10 0.15 0.10 0.00 0.00 0.00 0.00 61.98 62.33 1za2 s VAL 263 Cb -0.09 -3.48 -0.05 0.00 0.00 0.00 0.00 36.38 32.76 1za2 s VAL 263 CO 0.02 0.31 -0.05 -0.76 0.00 0.00 0.00 175.10 174.62 1za2 s LEU 264 N 1.38 2.99 -0.30 3.92 1.43 -0.01 -1.79 118.68 126.30 1za2 s LEU 264 Ca 0.07 -0.82 -0.12 0.00 -1.03 0.00 0.00 54.13 52.23 1za2 s LEU 264 Cb -0.15 -1.48 0.14 0.00 0.03 0.00 0.00 46.19 44.73 1za2 s LEU 264 CO 0.07 -0.04 0.79 -2.28 0.23 0.00 0.00 176.35 175.12 1za2 s HIS 265 N -2.41 -1.06 0.55 0.29 2.46 -1.26 -0.07 115.29 113.79 1za2 s HIS 265 Ca 0.32 1.86 0.39 0.00 0.47 0.00 0.00 55.06 58.10 1za2 s HIS 265 Cb -0.05 0.63 2.10 0.00 -0.13 0.00 0.00 32.58 35.14 1za2 s HIS 265 CO 0.19 -0.53 2.27 -1.00 -2.47 0.00 0.00 174.74 173.20 1za2 h PRO 266 N 7.68 0.00 -2.61 2.88 0.13 -1.94 -3.46 132.00 134.69 1za2 h PRO 266 Ca -0.18 0.00 0.26 0.00 -0.87 0.00 0.00 66.00 65.21 1za2 h PRO 266 Cb 1.12 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.10 1za2 h PRO 266 CO 0.10 0.01 -0.95 1.28 -0.23 0.00 0.00 178.00 178.21 1za2 n LEU 267 N -3.24 -0.77 -4.79 1.56 4.77 -1.26 -5.00 117.00 108.26 1za2 n LEU 267 Ca -0.02 1.80 -0.32 0.00 -0.03 0.00 0.00 56.01 57.44 1za2 n LEU 267 Cb 0.12 -2.29 0.05 0.00 -2.33 0.00 0.00 43.42 38.97 1za2 n LEU 267 CO 0.23 -1.60 0.71 -2.16 -1.33 0.00 0.00 177.39 173.24 1za2 s PRO 268 N -3.96 2.79 0.47 3.23 0.04 -1.26 -5.08 135.00 131.25 1za2 s PRO 268 Ca 0.00 1.14 0.08 0.00 0.04 0.00 0.00 61.00 62.26 1za2 s PRO 268 Cb 0.00 -1.96 0.02 0.00 0.04 0.00 0.00 34.50 32.60 1za2 s PRO 268 CO 0.00 -1.23 0.55 -0.98 0.04 0.00 0.00 177.00 175.39 1za2 s ARG 269 N -4.64 2.54 0.00 4.56 1.70 -1.26 -4.74 118.95 117.11 1za2 s ARG 269 Ca 0.62 -1.53 0.00 0.00 -0.47 0.00 0.00 55.73 54.35 1za2 s ARG 269 Cb -0.16 -2.54 0.00 0.00 -0.57 0.00 0.00 34.95 31.68 1za2 s ARG 269 CO 0.49 -0.44 0.00 1.55 -1.08 0.00 0.00 175.30 175.82 1za2 n VAL 270 N -1.85 0.00 -0.04 4.99 3.14 -1.26 -5.03 118.33 118.27 1za2 n VAL 270 Ca 0.08 0.00 -0.07 0.00 -2.96 0.00 0.00 64.34 61.38 1za2 n VAL 270 Cb 0.61 -0.12 -0.03 0.00 -1.06 0.00 0.00 33.84 33.23 1za2 n VAL 270 CO 0.00 0.00 0.00 -0.67 -6.46 0.00 0.00 176.83 169.70 1za2 n ASP 271 N -1.83 2.10 -0.64 6.55 4.64 -1.26 -4.79 116.55 121.32 1za2 n ASP 271 Ca 0.00 0.03 0.49 0.00 -1.38 0.00 0.00 54.79 53.93 1za2 n ASP 271 Cb 0.00 -0.19 0.78 0.00 -1.04 0.00 0.00 41.12 40.67 1za2 n ASP 271 CO 0.00 0.00 0.00 1.05 -0.82 0.00 0.00 177.20 177.43 1za2 h GLU 272 N -0.14 0.00 -4.68 -0.67 9.09 -1.92 -3.32 114.58 112.94 1za2 h GLU 272 Ca -0.20 -0.00 -0.65 0.00 0.05 0.00 0.00 59.36 58.56 1za2 h GLU 272 Cb 1.24 -0.00 -0.37 0.00 -1.65 0.00 0.00 28.75 27.97 1za2 h GLU 272 CO -0.08 0.00 -0.79 0.42 0.05 0.00 0.00 179.01 178.61 1za2 s ILE 273 N -5.00 1.93 0.62 -1.06 1.01 -1.26 0.17 121.20 117.62 1za2 s ILE 273 Ca -0.06 -1.49 -0.18 0.00 0.00 0.00 0.00 60.65 58.92 1za2 s ILE 273 Cb 0.28 -2.10 -0.02 0.00 0.01 0.00 0.00 42.46 40.63 1za2 s ILE 273 CO 0.88 -0.06 1.19 0.00 0.00 0.00 0.00 174.94 176.94 1za2 s ALA 274 N 1.21 2.47 0.04 9.38 0.00 -0.20 -4.91 121.76 129.75 1za2 s ALA 274 Ca -0.08 0.91 0.32 0.00 0.00 0.00 0.00 51.96 53.12 1za2 s ALA 274 Cb -0.20 -3.43 1.44 0.00 0.00 0.00 0.00 23.12 20.93 1za2 s ALA 274 CO -0.05 -1.27 1.96 1.79 0.00 0.00 0.00 175.76 178.19 1za2 h THR 275 N 0.60 0.00 0.00 0.00 1.35 -1.93 -2.63 112.91 110.30 1za2 h THR 275 Ca -0.49 -0.34 0.00 0.00 -0.55 0.00 0.00 66.41 65.03 1za2 h THR 275 Cb 1.29 1.24 0.00 0.00 -1.73 0.00 0.00 68.15 68.95 1za2 h THR 275 CO 0.54 0.00 0.00 -0.90 -0.25 0.00 0.00 175.52 174.91 1za2 n ASP 276 N -2.84 0.00 0.06 5.36 3.85 -1.26 -1.19 116.55 120.53 1za2 n ASP 276 Ca 0.00 -0.08 0.03 0.00 -0.71 0.00 0.00 54.79 54.03 1za2 n ASP 276 Cb 0.24 -0.21 -0.05 0.00 -1.35 0.00 0.00 41.12 39.75 1za2 n ASP 276 CO 0.00 0.00 0.00 0.58 -1.01 0.00 0.00 177.20 176.77 1za2 h VAL 277 N 0.00 0.44 -0.57 2.12 2.07 -1.83 -3.39 116.25 115.08 1za2 h VAL 277 Ca 0.00 -1.82 0.11 0.00 0.82 0.00 0.00 66.70 65.81 1za2 h VAL 277 Cb 0.10 1.97 -0.11 0.00 -1.52 0.00 0.00 31.29 31.73 1za2 h VAL 277 CO 0.00 0.25 -0.29 0.44 0.02 0.00 0.00 177.57 177.99 1za2 h ASP 278 N 0.00 -1.00 -0.04 0.57 3.45 -1.32 -1.37 116.42 116.71 1za2 h ASP 278 Ca -0.11 0.21 0.00 0.00 0.43 0.00 0.00 57.03 57.56 1za2 h ASP 278 Cb 1.45 0.52 0.00 0.00 -0.56 0.00 0.00 39.33 40.73 1za2 h ASP 278 CO 0.04 -0.28 0.00 2.29 -1.57 0.00 0.00 179.24 179.71 1za2 n LYS 279 N -5.43 1.19 -2.55 3.56 -0.00 -1.26 -4.67 118.16 108.99 1za2 n LYS 279 Ca 0.05 -0.29 -0.33 0.00 -0.00 0.00 0.00 58.31 57.74 1za2 n LYS 279 Cb 0.35 -1.33 -0.04 0.00 -0.00 0.00 0.00 35.03 34.01 1za2 n LYS 279 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.40 178.35 1za2 s THR 280 N -1.95 4.27 -1.06 0.58 -4.23 -0.52 -4.92 115.64 107.81 1za2 s THR 280 Ca 0.30 1.27 0.08 0.00 -1.18 0.00 0.00 61.69 62.16 1za2 s THR 280 Cb 0.14 -3.59 0.07 0.00 1.34 0.00 0.00 72.50 70.47 1za2 s THR 280 CO 0.23 -0.45 1.23 -0.81 -0.54 0.00 0.00 174.62 174.29 1za2 n PRO 281 N -1.15 0.02 0.05 3.99 -0.04 -1.26 -2.36 135.00 134.24 1za2 n PRO 281 Ca 0.07 0.35 -0.06 0.00 -0.04 0.00 0.00 63.50 63.82 1za2 n PRO 281 Cb 0.54 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.39 1za2 n PRO 281 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1za2 h HIS 282 N 0.00 0.00 -1.94 0.54 3.86 -1.88 -3.46 115.15 112.28 1za2 h HIS 282 Ca 0.00 0.00 -0.60 0.00 -1.16 0.00 0.00 60.37 58.61 1za2 h HIS 282 Cb 0.12 0.00 0.01 0.00 1.06 0.00 0.00 27.41 28.60 1za2 h HIS 282 CO 0.00 0.90 1.32 0.00 0.86 0.00 0.00 177.93 181.01 1za2 n ALA 283 N -2.39 1.38 -1.17 2.45 0.00 -1.00 -0.92 120.51 118.86 1za2 n ALA 283 Ca -0.05 0.03 0.01 0.00 0.00 0.00 0.00 53.44 53.43 1za2 n ALA 283 Cb 0.94 -2.69 0.02 0.00 0.00 0.00 0.00 19.45 17.71 1za2 n ALA 283 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 177.50 179.37 1za2 n TRP 284 N 9.09 0.00 0.17 0.00 -0.00 -0.74 -4.85 117.44 121.12 1za2 n TRP 284 Ca 0.27 -0.20 0.02 0.00 -0.00 0.00 0.00 57.50 57.60 1za2 n TRP 284 Cb 0.36 -0.04 0.29 0.00 -0.00 0.00 0.00 31.31 31.92 1za2 n TRP 284 CO 0.00 0.00 0.00 0.10 -0.00 0.00 0.00 177.69 177.79 1za2 h TYR 285 N 0.00 0.00 0.09 5.87 -0.00 -1.86 0.48 116.97 121.55 1za2 h TYR 285 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 58.73 58.45 1za2 h TYR 285 Cb 1.05 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 37.77 1za2 h TYR 285 CO 0.03 0.46 -1.36 0.74 -0.00 0.00 0.00 178.16 178.03 1za2 h PHE 286 N 0.00 0.34 -0.69 0.10 0.04 -1.90 -2.12 116.94 112.71 1za2 h PHE 286 Ca -0.00 -0.25 -0.07 0.00 2.80 0.00 0.00 57.97 60.44 1za2 h PHE 286 Cb 0.89 -0.01 -0.03 0.00 2.20 0.00 0.00 35.95 39.00 1za2 h PHE 286 CO 0.00 1.25 0.14 1.96 -0.60 0.00 0.00 178.31 181.06 1za2 h GLN 287 N 0.05 1.12 -0.08 1.51 7.50 -1.87 0.52 115.11 123.86 1za2 h GLN 287 Ca -0.17 -0.28 0.03 0.00 0.50 0.00 0.00 58.65 58.73 1za2 h GLN 287 Cb 1.96 -0.14 -0.04 0.00 0.05 0.00 0.00 27.48 29.31 1za2 h GLN 287 CO 0.16 1.00 -0.12 0.37 -1.50 0.00 0.00 178.83 178.74 1za2 h GLN 288 N 1.05 -0.16 -0.70 1.46 4.15 -0.88 -0.01 115.11 120.03 1za2 h GLN 288 Ca 0.21 0.01 0.02 0.00 0.77 0.00 0.00 58.65 59.66 1za2 h GLN 288 Cb 0.41 0.04 -0.04 0.00 0.21 0.00 0.00 27.48 28.10 1za2 h GLN 288 CO 0.01 -0.10 0.45 0.00 -1.93 0.00 0.00 178.83 177.25 1za2 h ALA 289 N 0.87 0.90 -0.02 3.38 0.00 -0.87 -1.20 119.26 122.32 1za2 h ALA 289 Ca 0.07 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 1za2 h ALA 289 Cb 0.26 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 1za2 h ALA 289 CO -0.18 0.26 -0.03 0.78 0.00 0.00 0.00 179.25 180.08 1za2 h GLY 290 N 0.90 0.03 1.71 0.00 0.00 -0.23 0.93 103.07 106.41 1za2 h GLY 290 Ca 0.27 -0.01 0.00 0.00 0.00 0.00 0.00 47.33 47.58 1za2 h GLY 290 CO -0.08 0.01 0.00 0.70 0.00 0.00 0.00 176.54 177.17 1za2 n ASN 291 N -4.49 0.00 -0.04 0.19 5.03 -0.08 -2.55 115.26 113.33 1za2 n ASN 291 Ca -0.03 0.16 -0.03 0.00 0.87 0.00 0.00 54.58 55.56 1za2 n ASN 291 Cb 0.12 -0.36 0.22 0.00 -1.02 0.00 0.00 39.78 38.75 1za2 n ASN 291 CO 0.00 0.00 0.00 1.23 -1.83 0.00 0.00 177.26 176.66 1za2 h GLY 292 N 3.29 0.66 0.60 7.41 0.00 -0.68 -3.12 103.07 111.22 1za2 h GLY 292 Ca 0.00 -0.45 -0.02 0.00 0.00 0.00 0.00 47.33 46.86 1za2 h GLY 292 CO 0.00 0.41 -0.49 -2.22 0.00 0.00 0.00 176.54 174.24 1za2 h ILE 293 N 0.57 0.00 -3.91 2.60 1.08 -1.65 -2.02 117.51 114.18 1za2 h ILE 293 Ca 0.11 0.00 -0.50 0.00 -0.39 0.00 0.00 64.86 64.08 1za2 h ILE 293 Cb 0.47 0.00 0.03 0.00 -3.07 0.00 0.00 36.82 34.25 1za2 h ILE 293 CO 0.02 0.00 0.46 -0.36 -0.69 0.00 0.00 178.15 177.58 1za2 s PHE 294 N -5.77 3.31 0.00 1.37 0.08 -1.18 -0.34 117.98 115.45 1za2 s PHE 294 Ca -0.18 1.64 0.00 0.00 0.12 0.00 0.00 56.93 58.51 1za2 s PHE 294 Cb 0.04 -3.25 0.00 0.00 -0.57 0.00 0.00 43.02 39.24 1za2 s PHE 294 CO 0.58 -0.79 0.00 0.00 -0.10 0.00 0.00 175.22 174.90 1za2 n ALA 295 N 0.35 0.00 -0.07 5.36 0.00 -1.26 -4.50 120.51 120.39 1za2 n ALA 295 Ca 0.03 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.40 1za2 n ALA 295 Cb 0.47 0.00 0.10 0.00 0.00 0.00 0.00 19.45 20.02 1za2 n ALA 295 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 1za2 h ARG 296 N 0.00 0.72 -0.22 0.00 9.65 -1.22 0.64 114.38 123.95 1za2 h ARG 296 Ca 0.00 -0.30 -0.10 0.00 -1.10 0.00 0.00 59.98 58.48 1za2 h ARG 296 Cb 0.00 -0.03 -0.00 0.00 -1.39 0.00 0.00 29.97 28.55 1za2 h ARG 296 CO 0.00 0.90 -0.27 0.37 2.80 0.00 0.00 179.97 183.76 1za2 h GLN 297 N 0.62 0.57 -0.64 0.20 4.15 -0.88 -2.11 115.11 117.03 1za2 h GLN 297 Ca 0.08 -0.32 -0.06 0.00 0.77 0.00 0.00 58.65 59.12 1za2 h GLN 297 Cb 0.75 0.02 -0.03 0.00 0.21 0.00 0.00 27.48 28.44 1za2 h GLN 297 CO 0.06 0.92 0.17 0.00 -1.93 0.00 0.00 178.83 178.04 1za2 h ALA 298 N 0.64 0.84 0.04 3.38 0.00 -1.71 -1.43 119.26 121.01 1za2 h ALA 298 Ca 0.03 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1za2 h ALA 298 Cb 0.84 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 1za2 h ALA 298 CO 0.06 0.54 -0.04 1.25 0.00 0.00 0.00 179.25 181.06 1za2 h LEU 299 N 0.93 -0.11 -1.03 0.00 5.85 0.32 -1.07 115.31 120.20 1za2 h LEU 299 Ca 0.20 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.93 1za2 h LEU 299 Cb 0.34 0.04 -0.04 0.00 0.37 0.00 0.00 40.66 41.37 1za2 h LEU 299 CO 0.00 -0.07 0.53 -0.07 -0.34 0.00 0.00 178.44 178.49 1za2 h LEU 300 N -0.09 1.05 -0.46 2.25 3.38 -1.19 -1.74 115.31 118.50 1za2 h LEU 300 Ca 0.01 -0.06 -0.07 0.00 0.09 0.00 0.00 57.88 57.84 1za2 h LEU 300 Cb 0.10 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.56 1za2 h LEU 300 CO -0.02 0.81 0.02 0.00 0.09 0.00 0.00 178.44 179.34 1za2 h ALA 301 N 1.37 0.62 -0.53 1.53 0.00 -0.98 -0.55 119.26 120.73 1za2 h ALA 301 Ca 0.31 -0.26 -0.12 0.00 0.00 0.00 0.00 54.91 54.85 1za2 h ALA 301 Cb -0.05 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 1za2 h ALA 301 CO -0.06 0.40 -0.12 -0.07 0.00 0.00 0.00 179.25 179.40 1za2 h LEU 302 N 0.66 1.01 -0.20 0.00 3.38 -0.88 0.28 115.31 119.56 1za2 h LEU 302 Ca 0.13 -0.34 -0.19 0.00 0.09 0.00 0.00 57.88 57.58 1za2 h LEU 302 Cb 0.47 -0.28 0.01 0.00 0.09 0.00 0.00 40.66 40.95 1za2 h LEU 302 CO 0.02 1.13 -0.61 0.58 0.09 0.00 0.00 178.44 179.65 1za2 h VAL 303 N 0.89 1.29 0.00 1.22 2.07 -1.25 -2.98 116.25 117.50 1za2 h VAL 303 Ca 0.14 -1.82 -0.03 0.00 0.82 0.00 0.00 66.70 65.81 1za2 h VAL 303 Cb 0.69 1.88 -0.00 0.00 -1.52 0.00 0.00 31.29 32.33 1za2 h VAL 303 CO 0.05 0.58 -1.52 0.18 0.02 0.00 0.00 177.57 176.88 1za2 n LEU 304 N -4.05 0.45 -4.48 2.57 4.77 -0.22 -0.50 117.00 115.53 1za2 n LEU 304 Ca -0.06 0.18 -0.39 0.00 -0.03 0.00 0.00 56.01 55.70 1za2 n LEU 304 Cb 0.66 -0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.63 1za2 n LEU 304 CO 0.50 -0.06 -0.17 0.21 -1.33 0.00 0.00 177.39 176.54 1za2 s ASN 305 N -5.03 5.77 0.00 -1.43 3.04 0.96 -4.98 114.94 113.28 1za2 s ASN 305 Ca -0.04 -0.45 0.00 0.00 0.04 0.00 0.00 52.86 52.41 1za2 s ASN 305 Cb 0.11 -2.06 0.00 0.00 -1.54 0.00 0.00 41.25 37.76 1za2 s ASN 305 CO 0.85 -0.20 0.00 -1.14 -3.04 0.00 0.00 177.10 173.57 1za2 n ARG 306 N 5.03 0.00 -1.43 0.43 0.63 -1.26 -4.67 116.66 115.39 1za2 n ARG 306 Ca -0.13 0.00 -0.34 0.00 -0.92 0.00 0.00 57.85 56.45 1za2 n ARG 306 Cb 0.50 0.00 0.09 0.00 0.45 0.00 0.00 32.46 33.50 1za2 n ARG 306 CO 0.00 0.00 0.00 0.16 -2.51 0.00 0.00 177.63 175.28 1za2 s ASP 307 N -2.95 4.20 1.26 6.15 3.84 -1.26 -2.60 116.67 125.31 1za2 s ASP 307 Ca 0.00 2.35 -0.18 0.00 -0.00 0.00 0.00 52.55 54.72 1za2 s ASP 307 Cb 0.00 -2.59 0.28 0.00 -1.38 0.00 0.00 42.92 39.23 1za2 s ASP 307 CO 0.00 -2.26 0.63 -0.11 -0.00 0.00 0.00 175.17 173.44 1za2 n LEU 308 N -2.72 0.00 0.00 2.11 0.00 -1.26 -4.75 117.00 110.38 1za2 n LEU 308 Ca 0.13 -0.64 0.00 0.00 0.00 0.00 0.00 56.01 55.51 1za2 n LEU 308 Cb 0.50 -0.80 0.00 0.00 0.00 0.00 0.00 43.42 43.12 1za2 n LEU 308 CO 0.48 -2.56 0.00 0.52 0.00 0.00 0.00 177.39 175.83 1za2 n VAL 309 N -5.06 0.00 0.00 1.96 0.31 -1.26 -5.02 118.33 109.26 1za2 n VAL 309 Ca 0.10 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.43 1za2 n VAL 309 Cb 0.44 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.37 1za2 n VAL 309 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69