#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 8ca2 n GLY 6 N 0.00 3.54 0.08 -1.67 0.00 0.04 -5.03 105.19 102.15 8ca2 n GLY 6 Ca 0.00 -0.60 0.04 0.00 0.00 0.00 0.00 46.02 45.46 8ca2 n GLY 6 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 8ca2 n TYR 7 N 0.00 0.00 -1.73 1.61 4.01 -1.26 -3.63 117.16 116.16 8ca2 n TYR 7 Ca 0.00 -0.57 -0.30 0.00 -0.16 0.00 0.00 57.90 56.87 8ca2 n TYR 7 Cb 0.00 -0.08 0.19 0.00 -0.31 0.00 0.00 39.34 39.14 8ca2 n TYR 7 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 8ca2 s GLY 8 N -1.56 1.72 0.42 2.72 0.00 -1.26 -4.67 107.32 104.69 8ca2 s GLY 8 Ca 0.12 -1.11 0.16 0.00 0.00 0.00 0.00 44.72 43.88 8ca2 s GLY 8 CO 0.01 -0.33 1.91 1.70 0.00 0.00 0.00 173.10 176.40 8ca2 h LYS 9 N -1.83 0.00 0.00 2.90 1.63 -1.97 -1.02 116.57 116.27 8ca2 h LYS 9 Ca -0.45 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.35 8ca2 h LYS 9 Cb 1.25 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.88 8ca2 h LYS 9 CO 0.39 0.27 -1.16 0.72 -3.45 0.00 0.00 179.45 176.22 8ca2 n HIS 10 N -4.09 0.00 -1.21 1.91 8.25 -1.26 -4.64 115.22 114.18 8ca2 n HIS 10 Ca -0.02 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.44 8ca2 n HIS 10 Cb 0.33 -0.12 0.00 0.00 1.12 0.00 0.00 29.99 31.32 8ca2 n HIS 10 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 8ca2 n ASN 11 N -1.64 0.22 -3.65 0.41 6.94 -1.22 -4.97 115.26 111.35 8ca2 n ASN 11 Ca 0.02 -1.42 -0.30 0.00 -0.02 0.00 0.00 54.58 52.85 8ca2 n ASN 11 Cb 0.35 -0.07 0.25 0.00 -2.36 0.00 0.00 39.78 37.94 8ca2 n ASN 11 CO 0.00 0.00 0.00 -0.83 -1.03 0.00 0.00 177.26 175.40 8ca2 s GLY 12 N -0.44 1.64 0.55 4.83 0.00 -0.39 -0.78 107.32 112.73 8ca2 s GLY 12 Ca 0.01 -1.15 0.45 0.00 0.00 0.00 0.00 44.72 44.03 8ca2 s GLY 12 CO 0.00 -0.22 1.66 -2.55 0.00 0.00 0.00 173.10 171.99 8ca2 h PRO 13 N -2.56 0.00 0.00 2.90 0.11 -1.85 0.29 132.00 130.90 8ca2 h PRO 13 Ca -0.42 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.69 8ca2 h PRO 13 Cb 1.27 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 8ca2 h PRO 13 CO 0.28 0.00 0.00 -0.85 -0.21 0.00 0.00 178.00 177.22 8ca2 n GLU 14 N -4.05 0.15 0.00 1.05 0.00 -1.26 -3.10 120.64 113.44 8ca2 n GLU 14 Ca 0.37 0.29 0.05 0.00 0.00 0.00 0.00 57.16 57.87 8ca2 n GLU 14 Cb 1.72 -1.74 -0.03 0.00 0.00 0.00 0.00 31.44 31.39 8ca2 n GLU 14 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.13 177.85 8ca2 n HIS 15 N -2.02 0.00 0.26 -1.84 8.25 0.09 -4.65 115.22 115.31 8ca2 n HIS 15 Ca 0.04 0.00 0.08 0.00 -0.26 0.00 0.00 57.72 57.58 8ca2 n HIS 15 Cb 0.28 0.00 0.64 0.00 1.12 0.00 0.00 29.99 32.03 8ca2 n HIS 15 CO 0.00 0.00 0.00 -1.49 0.64 0.00 0.00 176.34 175.49 8ca2 h TRP 16 N 0.42 0.00 -0.01 4.41 6.55 -1.52 -2.92 115.95 122.88 8ca2 h TRP 16 Ca 0.00 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.84 8ca2 h TRP 16 Cb 0.26 0.00 -0.00 0.00 -0.86 0.00 0.00 29.16 28.56 8ca2 h TRP 16 CO 0.00 0.01 0.02 1.12 -1.05 0.00 0.00 178.44 178.54 8ca2 h HIS 17 N 0.00 0.00 -0.17 0.49 2.07 -1.81 1.00 115.15 116.73 8ca2 h HIS 17 Ca -0.00 0.00 -0.05 0.00 -2.85 0.00 0.00 60.37 57.47 8ca2 h HIS 17 Cb 0.02 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 29.99 8ca2 h HIS 17 CO 0.00 0.00 -0.08 0.87 -3.07 0.00 0.00 177.93 175.65 8ca2 h LYS 18 N 0.00 0.35 0.00 5.12 1.57 -1.88 -2.28 116.57 119.45 8ca2 h LYS 18 Ca 0.01 -0.15 -0.24 0.00 -1.87 0.00 0.00 60.65 58.39 8ca2 h LYS 18 Cb 0.05 -0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.31 8ca2 h LYS 18 CO -0.00 0.66 -1.66 -0.25 -0.57 0.00 0.00 179.45 177.63 8ca2 n ASP 19 N -4.62 0.76 -3.59 0.86 8.00 -1.09 -4.67 116.55 112.20 8ca2 n ASP 19 Ca -0.05 0.35 -0.28 0.00 0.71 0.00 0.00 54.79 55.52 8ca2 n ASP 19 Cb 0.30 0.18 -0.11 0.00 -0.02 0.00 0.00 41.12 41.48 8ca2 n ASP 19 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 8ca2 s PHE 20 N -2.75 2.02 -0.55 1.24 0.40 0.33 -4.98 117.98 113.69 8ca2 s PHE 20 Ca -0.05 -2.68 0.07 0.00 -0.60 0.00 0.00 56.93 53.68 8ca2 s PHE 20 Cb 0.08 -1.62 0.40 0.00 0.51 0.00 0.00 43.02 42.39 8ca2 s PHE 20 CO 0.82 -0.72 1.16 -2.30 0.70 0.00 0.00 175.22 174.88 8ca2 n PRO 21 N 2.60 0.05 0.03 0.24 -0.01 -0.86 -1.11 135.00 135.94 8ca2 n PRO 21 Ca 0.25 0.50 0.10 0.00 -0.01 0.00 0.00 63.50 64.34 8ca2 n PRO 21 Cb 0.42 -1.75 0.44 0.00 -0.01 0.00 0.00 33.50 32.60 8ca2 n PRO 21 CO 0.00 0.00 0.00 1.51 -0.01 0.00 0.00 175.50 177.00 8ca2 n ILE 22 N -1.72 0.65 -0.23 4.25 3.06 -1.26 -2.84 119.36 121.26 8ca2 n ILE 22 Ca -0.00 0.12 0.31 0.00 -2.50 0.00 0.00 62.75 60.67 8ca2 n ILE 22 Cb 0.10 -0.84 0.73 0.00 0.54 0.00 0.00 39.64 40.18 8ca2 n ILE 22 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 8ca2 h ALA 23 N 2.60 2.94 -0.43 1.51 0.00 -1.43 0.27 119.26 124.73 8ca2 h ALA 23 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 8ca2 h ALA 23 Cb 0.39 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.26 8ca2 h ALA 23 CO 0.00 -1.25 0.00 1.63 0.00 0.00 0.00 179.25 179.63 8ca2 n LYS 24 N -4.20 3.94 -0.25 0.00 5.02 -1.13 -4.96 118.16 116.58 8ca2 n LYS 24 Ca 0.21 -3.00 -0.13 0.00 -2.02 0.00 0.00 58.31 53.37 8ca2 n LYS 24 Cb 1.07 -2.05 0.12 0.00 -0.02 0.00 0.00 35.03 34.15 8ca2 n LYS 24 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 8ca2 n GLY 25 N 0.11 -3.31 0.03 0.72 0.00 0.95 -5.00 105.19 98.69 8ca2 n GLY 25 Ca 0.25 -1.35 0.12 0.00 0.00 0.00 0.00 46.02 45.04 8ca2 n GLY 25 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 8ca2 n GLU 26 N -3.36 0.14 -2.74 1.61 -0.58 -1.26 -4.46 120.64 109.99 8ca2 n GLU 26 Ca 0.06 0.03 -0.05 0.00 -0.42 0.00 0.00 57.16 56.79 8ca2 n GLU 26 Cb 0.26 -1.58 0.04 0.00 -0.57 0.00 0.00 31.44 29.59 8ca2 n GLU 26 CO 0.00 0.00 0.00 2.89 -0.48 0.00 0.00 177.13 179.54 8ca2 n ARG 27 N -1.78 1.41 -2.48 3.49 1.85 -1.26 -4.82 116.66 113.06 8ca2 n ARG 27 Ca 0.04 -3.34 -0.33 0.00 -1.00 0.00 0.00 57.85 53.22 8ca2 n ARG 27 Cb 0.39 -1.39 -0.03 0.00 -1.05 0.00 0.00 32.46 30.37 8ca2 n ARG 27 CO 0.00 0.00 0.00 -0.65 -0.01 0.00 0.00 177.63 176.97 8ca2 s GLN 28 N -3.39 3.82 0.22 2.89 -1.52 -1.26 -2.69 119.66 117.73 8ca2 s GLN 28 Ca 0.27 1.22 0.08 0.00 -1.95 0.00 0.00 55.36 54.98 8ca2 s GLN 28 Cb 0.40 -2.11 -0.05 0.00 -0.22 0.00 0.00 33.01 31.03 8ca2 s GLN 28 CO 0.00 -0.40 -0.13 -1.12 -0.25 0.00 0.00 175.29 173.39 8ca2 s SER 29 N -2.34 2.66 1.02 5.90 0.01 -1.26 -4.69 113.70 115.00 8ca2 s SER 29 Ca 0.64 -1.05 -0.17 0.00 1.31 0.00 0.00 55.95 56.68 8ca2 s SER 29 Cb -0.14 -0.15 0.23 0.00 0.21 0.00 0.00 66.02 66.17 8ca2 s SER 29 CO 0.23 -0.19 1.31 -0.81 0.41 0.00 0.00 173.24 174.19 8ca2 n PRO 30 N -0.43 -1.42 -4.41 12.44 -0.04 -1.26 -4.58 135.00 135.29 8ca2 n PRO 30 Ca -0.07 -2.02 -0.22 0.00 -0.04 0.00 0.00 63.50 61.14 8ca2 n PRO 30 Cb 0.61 -1.38 -0.08 0.00 -0.04 0.00 0.00 33.50 32.60 8ca2 n PRO 30 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 8ca2 s VAL 31 N -3.82 0.40 -0.19 0.52 -7.23 -1.26 -0.73 120.40 108.09 8ca2 s VAL 31 Ca 0.75 -2.00 -0.09 0.00 -1.81 0.00 0.00 61.98 58.82 8ca2 s VAL 31 Cb -0.02 -2.44 -0.05 0.00 0.56 0.00 0.00 36.38 34.43 8ca2 s VAL 31 CO 0.53 0.00 0.12 -0.62 -0.31 0.00 0.00 175.10 174.81 8ca2 s ASP 32 N -3.48 6.10 -0.47 4.85 2.15 -1.26 -2.80 116.67 121.76 8ca2 s ASP 32 Ca 0.31 0.22 -0.16 0.00 0.43 0.00 0.00 52.55 53.35 8ca2 s ASP 32 Cb 0.03 -2.06 0.06 0.00 -0.30 0.00 0.00 42.92 40.66 8ca2 s ASP 32 CO 0.18 0.20 0.43 -0.63 -0.17 0.00 0.00 175.17 175.18 8ca2 s ILE 33 N 0.23 5.17 -0.45 4.11 1.01 0.06 -4.95 121.20 126.37 8ca2 s ILE 33 Ca 0.08 -0.91 -0.26 0.00 0.00 0.00 0.00 60.65 59.56 8ca2 s ILE 33 Cb -0.11 -4.14 0.03 0.00 0.01 0.00 0.00 42.46 38.25 8ca2 s ILE 33 CO -0.01 -0.59 0.93 -0.62 0.00 0.00 0.00 174.94 174.65 8ca2 s ASP 34 N 2.51 6.52 0.48 3.58 -1.08 -1.26 -0.39 116.67 127.02 8ca2 s ASP 34 Ca 0.06 0.18 0.17 0.00 -0.52 0.00 0.00 52.55 52.44 8ca2 s ASP 34 Cb -0.23 -2.46 1.14 0.00 -1.46 0.00 0.00 42.92 39.92 8ca2 s ASP 34 CO 0.08 -1.03 2.05 0.71 0.52 0.00 0.00 175.17 177.49 8ca2 h THR 35 N 6.06 1.02 0.00 1.71 1.35 -1.95 -1.93 112.91 119.17 8ca2 h THR 35 Ca -0.24 -0.45 -0.07 0.00 -0.55 0.00 0.00 66.41 65.10 8ca2 h THR 35 Cb 1.08 1.25 -0.01 0.00 -1.73 0.00 0.00 68.15 68.73 8ca2 h THR 35 CO 1.02 0.13 -0.68 0.45 -0.25 0.00 0.00 175.52 176.19 8ca2 h HIS 36 N 0.00 0.00 0.00 4.73 3.86 -2.03 -3.33 115.15 118.38 8ca2 h HIS 36 Ca -0.00 0.00 -0.19 0.00 -1.16 0.00 0.00 60.37 59.02 8ca2 h HIS 36 Cb 0.24 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 28.68 8ca2 h HIS 36 CO 0.00 0.27 -1.34 1.15 0.86 0.00 0.00 177.93 178.87 8ca2 h THR 37 N 0.00 0.70 -4.02 2.45 2.02 -1.91 -3.47 112.91 108.68 8ca2 h THR 37 Ca -0.04 -2.27 -0.56 0.00 0.77 0.00 0.00 66.41 64.32 8ca2 h THR 37 Cb 1.24 2.22 0.15 0.00 -1.74 0.00 0.00 68.15 70.01 8ca2 h THR 37 CO 0.03 0.40 0.54 0.00 0.37 0.00 0.00 175.52 176.86 8ca2 n ALA 38 N -2.41 1.35 -2.60 6.16 0.00 -0.75 -4.88 120.51 117.37 8ca2 n ALA 38 Ca -0.09 0.08 -0.41 0.00 0.00 0.00 0.00 53.44 53.01 8ca2 n ALA 38 Cb 0.88 -2.33 -0.11 0.00 0.00 0.00 0.00 19.45 17.89 8ca2 n ALA 38 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 8ca2 s LYS 39 N -3.04 3.15 -0.25 0.00 2.36 0.46 -4.86 119.74 117.55 8ca2 s LYS 39 Ca 0.76 -0.88 -0.28 0.00 -2.55 0.00 0.00 55.97 53.02 8ca2 s LYS 39 Cb -0.41 -3.82 -0.04 0.00 -1.05 0.00 0.00 37.83 32.51 8ca2 s LYS 39 CO 0.46 -0.60 1.96 -0.47 1.55 0.00 0.00 175.35 178.24 8ca2 s TYR 40 N 1.66 1.55 -0.27 4.03 5.04 -1.26 -0.61 117.35 127.50 8ca2 s TYR 40 Ca 0.05 0.52 -0.06 0.00 -2.44 0.00 0.00 57.07 55.14 8ca2 s TYR 40 Cb -0.18 -4.04 0.00 0.00 0.35 0.00 0.00 41.96 38.09 8ca2 s TYR 40 CO 0.09 -3.56 0.04 0.34 -1.34 0.00 0.00 175.55 171.12 8ca2 s ASP 41 N 6.66 4.88 0.25 4.32 2.15 -0.28 -4.91 116.67 129.74 8ca2 s ASP 41 Ca 0.88 -0.57 0.26 0.00 0.43 0.00 0.00 52.55 53.54 8ca2 s ASP 41 Cb -0.28 -1.84 0.84 0.00 -0.30 0.00 0.00 42.92 41.34 8ca2 s ASP 41 CO 0.34 -0.12 1.76 1.55 -0.17 0.00 0.00 175.17 178.53 8ca2 h PRO 42 N 8.19 0.00 -0.28 4.34 0.13 -1.92 -3.09 132.00 139.38 8ca2 h PRO 42 Ca -0.35 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.78 8ca2 h PRO 42 Cb 1.14 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.27 8ca2 h PRO 42 CO 0.60 0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 177.24 8ca2 n SER 43 N -2.35 1.57 -4.66 1.44 3.41 -1.26 -4.81 113.62 106.95 8ca2 n SER 43 Ca 0.04 -1.96 -0.41 0.00 -0.26 0.00 0.00 58.87 56.29 8ca2 n SER 43 Cb 0.38 -0.18 -0.05 0.00 -0.26 0.00 0.00 64.21 64.09 8ca2 n SER 43 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 8ca2 s LEU 44 N -1.07 4.14 0.52 1.04 1.02 -1.17 -5.04 118.68 118.11 8ca2 s LEU 44 Ca 0.21 0.93 -0.11 0.00 0.02 0.00 0.00 54.13 55.19 8ca2 s LEU 44 Cb 0.11 -3.01 -0.05 0.00 0.02 0.00 0.00 46.19 43.26 8ca2 s LEU 44 CO 0.15 -0.34 0.90 -0.54 0.02 0.00 0.00 176.35 176.54 8ca2 s LYS 45 N 2.12 3.70 0.55 1.70 1.02 -1.25 -5.02 119.74 122.55 8ca2 s LYS 45 Ca 0.32 0.60 -0.20 0.00 0.02 0.00 0.00 55.97 56.70 8ca2 s LYS 45 Cb -0.16 -2.23 -0.05 0.00 -0.52 0.00 0.00 37.83 34.87 8ca2 s LYS 45 CO 0.10 -0.30 1.20 -2.14 -0.92 0.00 0.00 175.35 173.29 8ca2 s PRO 46 N -4.54 3.25 0.44 -1.68 0.02 -1.26 -3.07 135.00 128.15 8ca2 s PRO 46 Ca 0.53 1.81 -0.24 0.00 0.02 0.00 0.00 61.00 63.13 8ca2 s PRO 46 Cb -0.10 -2.09 -0.08 0.00 0.02 0.00 0.00 34.50 32.25 8ca2 s PRO 46 CO 0.42 -0.98 1.18 -0.51 -0.33 0.00 0.00 177.00 176.78 8ca2 s LEU 47 N -3.72 4.07 -0.29 -5.54 1.43 -1.26 -1.92 118.68 111.44 8ca2 s LEU 47 Ca 0.73 2.35 0.00 0.00 -1.03 0.00 0.00 54.13 56.19 8ca2 s LEU 47 Cb -0.30 -4.16 0.09 0.00 0.03 0.00 0.00 46.19 41.85 8ca2 s LEU 47 CO 0.34 -0.87 0.06 -0.55 0.23 0.00 0.00 176.35 175.55 8ca2 s SER 48 N -1.25 4.08 -0.24 2.29 0.15 0.09 -4.88 113.70 113.94 8ca2 s SER 48 Ca 0.62 -1.61 -0.03 0.00 0.70 0.00 0.00 55.95 55.62 8ca2 s SER 48 Cb -0.30 -1.07 0.01 0.00 -1.71 0.00 0.00 66.02 62.95 8ca2 s SER 48 CO 0.37 -0.37 -0.04 -0.69 1.20 0.00 0.00 173.24 173.71 8ca2 s VAL 49 N 1.44 3.21 -0.62 4.45 1.01 -1.26 -0.25 120.40 128.38 8ca2 s VAL 49 Ca 0.07 -0.76 0.00 0.00 0.00 0.00 0.00 61.98 61.29 8ca2 s VAL 49 Cb -0.18 -2.55 0.16 0.00 0.00 0.00 0.00 36.38 33.80 8ca2 s VAL 49 CO -0.17 0.28 0.41 -0.44 0.00 0.00 0.00 175.10 175.18 8ca2 s SER 50 N 1.41 4.93 -0.06 3.32 0.01 -0.22 -4.89 113.70 118.19 8ca2 s SER 50 Ca 0.03 -3.06 0.11 0.00 1.31 0.00 0.00 55.95 54.34 8ca2 s SER 50 Cb -0.16 -1.77 0.28 0.00 0.21 0.00 0.00 66.02 64.59 8ca2 s SER 50 CO -0.03 -0.28 1.22 -1.22 0.41 0.00 0.00 173.24 173.33 8ca2 n TYR 51 N 3.14 0.41 -0.22 2.43 4.01 -1.26 -1.64 117.16 124.03 8ca2 n TYR 51 Ca 0.09 -0.65 -0.00 0.00 -0.16 0.00 0.00 57.90 57.18 8ca2 n TYR 51 Cb 0.35 -0.11 0.11 0.00 -0.31 0.00 0.00 39.34 39.38 8ca2 n TYR 51 CO 0.00 0.00 0.00 0.38 -0.46 0.00 0.00 176.86 176.78 8ca2 h ASP 52 N 1.25 0.37 -0.92 7.72 2.03 -1.90 -3.00 116.42 121.96 8ca2 h ASP 52 Ca 0.00 0.06 -0.62 0.00 -0.73 0.00 0.00 57.03 55.74 8ca2 h ASP 52 Cb 0.87 0.00 -0.31 0.00 -0.83 0.00 0.00 39.33 39.07 8ca2 h ASP 52 CO 0.05 0.22 0.51 1.67 -1.03 0.00 0.00 179.24 180.66 8ca2 n GLN 53 N -4.91 2.77 -2.92 4.15 -0.06 -1.26 -5.01 117.38 110.14 8ca2 n GLN 53 Ca 0.09 -3.42 -0.39 0.00 -2.00 0.00 0.00 57.00 51.28 8ca2 n GLN 53 Cb 0.25 -2.26 -0.06 0.00 -4.06 0.00 0.00 30.24 24.11 8ca2 n GLN 53 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 8ca2 s ALA 54 N -3.71 3.41 -0.29 1.69 0.00 -1.14 -4.46 121.76 117.27 8ca2 s ALA 54 Ca 0.61 0.42 0.03 0.00 0.00 0.00 0.00 51.96 53.02 8ca2 s ALA 54 Cb 0.48 -3.02 0.07 0.00 0.00 0.00 0.00 23.12 20.66 8ca2 s ALA 54 CO 0.01 0.27 -0.05 0.99 0.00 0.00 0.00 175.76 176.99 8ca2 s THR 55 N -1.19 2.28 0.22 0.00 2.01 -1.26 -4.88 115.64 112.82 8ca2 s THR 55 Ca 0.38 -1.86 -0.21 0.00 0.31 0.00 0.00 61.69 60.31 8ca2 s THR 55 Cb -0.23 -2.46 -0.08 0.00 0.01 0.00 0.00 72.50 69.74 8ca2 s THR 55 CO 0.27 -0.23 0.75 -0.94 -0.69 0.00 0.00 174.62 173.79 8ca2 s SER 56 N 1.06 7.14 -0.03 3.53 1.04 -1.26 -1.68 113.70 123.50 8ca2 s SER 56 Ca -0.02 1.50 -0.01 0.00 0.48 0.00 0.00 55.95 57.90 8ca2 s SER 56 Cb -0.20 -2.45 -0.01 0.00 0.10 0.00 0.00 66.02 63.46 8ca2 s SER 56 CO -0.06 0.05 -0.03 0.18 0.98 0.00 0.00 173.24 174.36 8ca2 n LEU 57 N 0.85 1.44 -3.76 2.42 4.77 -0.32 -3.62 117.00 118.78 8ca2 n LEU 57 Ca -0.02 0.01 -0.03 0.00 -0.03 0.00 0.00 56.01 55.94 8ca2 n LEU 57 Cb 0.51 -0.09 -0.01 0.00 -2.33 0.00 0.00 43.42 41.50 8ca2 n LEU 57 CO 0.44 0.27 0.75 0.00 -1.33 0.00 0.00 177.39 177.52 8ca2 s ARG 58 N -2.05 1.16 -0.04 3.23 1.04 -1.21 -1.64 118.95 119.44 8ca2 s ARG 58 Ca -0.04 -0.65 0.03 0.00 -1.04 0.00 0.00 55.73 54.03 8ca2 s ARG 58 Cb 0.01 0.39 0.00 0.00 -2.04 0.00 0.00 34.95 33.32 8ca2 s ARG 58 CO 0.06 -0.53 -0.11 -1.50 -0.04 0.00 0.00 175.30 173.17 8ca2 s ILE 59 N -3.15 0.96 -0.03 4.99 2.07 0.23 -0.43 121.20 125.84 8ca2 s ILE 59 Ca 0.13 -0.44 -0.03 0.00 -1.41 0.00 0.00 60.65 58.90 8ca2 s ILE 59 Cb -0.01 -0.85 0.01 0.00 0.13 0.00 0.00 42.46 41.73 8ca2 s ILE 59 CO 0.02 0.30 0.09 -0.22 -1.91 0.00 0.00 174.94 173.21 8ca2 s LEU 60 N 0.26 1.68 -0.42 8.50 2.96 -0.49 0.38 118.68 131.54 8ca2 s LEU 60 Ca -0.05 0.10 -0.18 0.00 -0.22 0.00 0.00 54.13 53.79 8ca2 s LEU 60 Cb -0.10 0.33 0.02 0.00 0.50 0.00 0.00 46.19 46.94 8ca2 s LEU 60 CO 0.01 -0.08 0.45 0.21 -1.32 0.00 0.00 176.35 175.63 8ca2 s ASN 61 N -0.18 6.20 0.00 3.68 3.84 0.21 -1.56 114.94 127.13 8ca2 s ASN 61 Ca -0.02 -0.67 0.20 0.00 0.21 0.00 0.00 52.86 52.58 8ca2 s ASN 61 Cb -0.02 -2.23 0.53 0.00 -0.55 0.00 0.00 41.25 38.98 8ca2 s ASN 61 CO 0.00 -0.60 1.44 -0.46 -2.79 0.00 0.00 177.10 174.69 8ca2 n ASN 62 N 5.65 2.87 0.00 -4.21 0.23 -0.71 0.81 115.26 119.90 8ca2 n ASN 62 Ca -0.07 -1.93 0.00 0.00 -0.53 0.00 0.00 54.58 52.05 8ca2 n ASN 62 Cb 0.47 -0.27 0.00 0.00 -2.08 0.00 0.00 39.78 37.91 8ca2 n ASN 62 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 8ca2 n GLY 63 N 1.38 0.80 0.00 4.83 0.00 -1.26 -4.77 105.19 106.17 8ca2 n GLY 63 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 8ca2 n GLY 63 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 8ca2 n HIS 64 N -2.00 0.00 0.00 1.61 1.44 -1.26 -4.66 115.22 110.35 8ca2 n HIS 64 Ca 0.00 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.71 8ca2 n HIS 64 Cb 0.00 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.11 8ca2 n HIS 64 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 8ca2 n ALA 65 N -0.00 0.00 -3.03 1.59 0.00 -1.26 -4.90 120.51 112.90 8ca2 n ALA 65 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.11 8ca2 n ALA 65 Cb 0.06 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.37 8ca2 n ALA 65 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 8ca2 s PHE 66 N -2.00 2.76 -0.04 0.00 -0.12 -1.26 -1.73 117.98 115.59 8ca2 s PHE 66 Ca 0.00 -0.66 0.05 0.00 -0.05 0.00 0.00 56.93 56.27 8ca2 s PHE 66 Cb 0.00 -1.80 -0.02 0.00 -0.63 0.00 0.00 43.02 40.57 8ca2 s PHE 66 CO 0.00 -0.20 -0.18 -0.80 -0.05 0.00 0.00 175.22 173.99 8ca2 s ASN 67 N 0.23 3.76 -0.22 1.98 0.02 -0.60 -4.30 114.94 115.81 8ca2 s ASN 67 Ca -0.10 -0.28 -0.05 0.00 -1.02 0.00 0.00 52.86 51.42 8ca2 s ASN 67 Cb -0.16 -0.70 -0.01 0.00 0.02 0.00 0.00 41.25 40.40 8ca2 s ASN 67 CO 0.06 0.33 -0.02 -0.69 0.02 0.00 0.00 177.10 176.80 8ca2 s VAL 68 N -0.71 3.58 -0.01 1.60 1.01 -0.69 -1.40 120.40 123.78 8ca2 s VAL 68 Ca 0.11 -0.42 -0.02 0.00 0.00 0.00 0.00 61.98 61.65 8ca2 s VAL 68 Cb -0.10 -2.64 -0.04 0.00 0.00 0.00 0.00 36.38 33.60 8ca2 s VAL 68 CO 0.00 0.41 0.16 -1.61 0.00 0.00 0.00 175.10 174.06 8ca2 s GLU 69 N 1.47 3.36 0.17 2.72 2.02 0.42 -2.09 118.70 126.77 8ca2 s GLU 69 Ca 0.06 -0.35 0.10 0.00 0.02 0.00 0.00 54.97 54.80 8ca2 s GLU 69 Cb -0.14 -3.05 -0.04 0.00 0.10 0.00 0.00 34.13 30.99 8ca2 s GLU 69 CO -0.02 0.67 -0.23 -0.06 0.02 0.00 0.00 175.26 175.65 8ca2 s PHE 70 N -1.29 2.15 -0.37 1.61 0.40 -0.71 -1.17 117.98 118.61 8ca2 s PHE 70 Ca 0.26 -0.39 -0.29 0.00 -0.60 0.00 0.00 56.93 55.91 8ca2 s PHE 70 Cb -0.12 -1.10 0.01 0.00 0.51 0.00 0.00 43.02 42.32 8ca2 s PHE 70 CO 0.17 0.40 1.27 0.34 0.70 0.00 0.00 175.22 178.11 8ca2 s ASP 71 N -2.47 6.61 -0.30 1.36 2.15 -0.67 -4.78 116.67 118.56 8ca2 s ASP 71 Ca 0.17 0.95 0.08 0.00 0.43 0.00 0.00 52.55 54.17 8ca2 s ASP 71 Cb -0.08 -2.54 0.46 0.00 -0.30 0.00 0.00 42.92 40.45 8ca2 s ASP 71 CO 0.08 -1.18 1.31 -0.90 -0.17 0.00 0.00 175.17 174.30 8ca2 n ASP 72 N 7.89 3.83 0.07 -0.34 5.75 -1.26 -4.65 116.55 127.84 8ca2 n ASP 72 Ca 0.14 -3.81 0.13 0.00 -0.01 0.00 0.00 54.79 51.25 8ca2 n ASP 72 Cb 0.47 -0.49 0.38 0.00 -1.03 0.00 0.00 41.12 40.45 8ca2 n ASP 72 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 8ca2 n SER 73 N -0.91 0.62 -3.86 -1.12 3.41 -1.26 -4.87 113.62 105.62 8ca2 n SER 73 Ca 0.37 0.39 -0.09 0.00 -0.26 0.00 0.00 58.87 59.28 8ca2 n SER 73 Cb 0.88 -0.44 -0.07 0.00 -0.26 0.00 0.00 64.21 64.33 8ca2 n SER 73 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 8ca2 s GLN 74 N -3.09 0.94 -0.45 4.33 -0.21 -1.26 -5.06 119.66 114.86 8ca2 s GLN 74 Ca 0.10 -0.99 -0.26 0.00 0.02 0.00 0.00 55.36 54.23 8ca2 s GLN 74 Cb 0.14 0.36 -0.26 0.00 1.00 0.00 0.00 33.01 34.26 8ca2 s GLN 74 CO 0.62 -0.32 1.78 -0.25 -2.12 0.00 0.00 175.29 175.00 8ca2 n ASP 75 N -0.11 1.81 -0.08 5.90 9.92 -1.26 -4.54 116.55 128.19 8ca2 n ASP 75 Ca -0.13 -2.59 -0.10 0.00 -0.53 0.00 0.00 54.79 51.43 8ca2 n ASP 75 Cb 0.63 -0.88 -0.05 0.00 -0.64 0.00 0.00 41.12 40.17 8ca2 n ASP 75 CO 0.00 0.00 0.00 0.11 0.13 0.00 0.00 177.20 177.44 8ca2 h LYS 76 N 9.05 0.00 -4.35 -1.24 1.57 -1.86 -3.44 116.57 116.30 8ca2 h LYS 76 Ca 0.33 0.00 -0.62 0.00 -1.87 0.00 0.00 60.65 58.49 8ca2 h LYS 76 Cb 0.71 0.00 -0.38 0.00 0.08 0.00 0.00 32.23 32.63 8ca2 h LYS 76 CO 1.94 0.40 -0.78 0.00 -0.57 0.00 0.00 179.45 180.44 8ca2 s ALA 77 N -2.55 2.04 0.16 3.86 0.00 -1.26 -4.03 121.76 119.98 8ca2 s ALA 77 Ca -0.17 -1.51 0.10 0.00 0.00 0.00 0.00 51.96 50.38 8ca2 s ALA 77 Cb 0.02 -1.50 -0.04 0.00 0.00 0.00 0.00 23.12 21.60 8ca2 s ALA 77 CO 0.34 -1.27 -0.23 0.14 0.00 0.00 0.00 175.76 174.74 8ca2 s VAL 78 N 1.35 2.11 -0.08 0.00 -7.23 -0.65 -1.47 120.40 114.43 8ca2 s VAL 78 Ca -0.03 -1.87 0.05 0.00 -1.81 0.00 0.00 61.98 58.32 8ca2 s VAL 78 Cb -0.19 -1.94 -0.00 0.00 0.56 0.00 0.00 36.38 34.81 8ca2 s VAL 78 CO -0.08 -0.10 -0.23 -0.22 -0.31 0.00 0.00 175.10 174.16 8ca2 s LEU 79 N -2.40 2.05 0.34 1.32 0.20 0.83 -1.06 118.68 119.95 8ca2 s LEU 79 Ca 0.16 -0.52 -0.10 0.00 0.69 0.00 0.00 54.13 54.36 8ca2 s LEU 79 Cb -0.08 -1.34 0.02 0.00 -0.43 0.00 0.00 46.19 44.36 8ca2 s LEU 79 CO 0.07 0.18 0.60 -1.59 -0.29 0.00 0.00 176.35 175.32 8ca2 s LYS 80 N 0.18 1.95 1.46 1.98 -2.85 0.66 -1.49 119.74 121.63 8ca2 s LYS 80 Ca -0.13 -1.50 0.00 0.00 -1.00 0.00 0.00 55.97 53.34 8ca2 s LYS 80 Cb -0.16 0.52 0.00 0.00 -2.06 0.00 0.00 37.83 36.13 8ca2 s LYS 80 CO 0.07 -0.86 0.00 0.41 0.10 0.00 0.00 175.35 175.07 8ca2 n GLY 81 N -0.51 -1.61 7.00 0.59 0.00 -1.26 -0.73 105.19 108.66 8ca2 n GLY 81 Ca -0.03 -1.29 0.00 0.00 0.00 0.00 0.00 46.02 44.70 8ca2 n GLY 81 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 8ca2 n GLY 82 N 0.00 1.50 0.01 -0.02 0.00 -0.81 -2.36 105.19 103.51 8ca2 n GLY 82 Ca 0.00 -0.58 0.14 0.00 0.00 0.00 0.00 46.02 45.57 8ca2 n GLY 82 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 8ca2 n PRO 83 N 12.79 0.10 -2.73 1.61 -0.04 -1.26 -3.94 135.00 141.52 8ca2 n PRO 83 Ca 0.00 -0.02 -0.32 0.00 -0.04 0.00 0.00 63.50 63.12 8ca2 n PRO 83 Cb 0.00 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 31.91 8ca2 n PRO 83 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 8ca2 s LEU 84 N -2.92 3.83 -0.21 1.53 1.43 -0.99 -5.07 118.68 116.29 8ca2 s LEU 84 Ca 0.16 1.48 0.01 0.00 -1.03 0.00 0.00 54.13 54.75 8ca2 s LEU 84 Cb 0.19 -4.36 0.05 0.00 0.03 0.00 0.00 46.19 42.09 8ca2 s LEU 84 CO 0.56 -0.42 -0.09 -1.81 0.23 0.00 0.00 176.35 174.82 8ca2 s ASP 85 N -2.67 3.48 0.00 2.29 1.01 -1.26 -4.38 116.67 115.14 8ca2 s ASP 85 Ca 0.58 -0.95 0.00 0.00 0.71 0.00 0.00 52.55 52.89 8ca2 s ASP 85 Cb -0.10 -1.21 0.00 0.00 1.01 0.00 0.00 42.92 42.62 8ca2 s ASP 85 CO 0.23 -0.17 0.00 0.61 0.21 0.00 0.00 175.17 176.05 8ca2 n GLY 86 N 4.69 -2.73 3.71 0.21 0.00 -1.26 -4.99 105.19 104.81 8ca2 n GLY 86 Ca -0.14 -2.03 -0.35 0.00 0.00 0.00 0.00 46.02 43.50 8ca2 n GLY 86 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 8ca2 s THR 87 N -0.41 4.50 -0.12 2.61 2.01 -1.26 -4.49 115.64 118.49 8ca2 s THR 87 Ca 0.00 -0.17 0.03 0.00 0.31 0.00 0.00 61.69 61.86 8ca2 s THR 87 Cb 0.00 -2.91 0.01 0.00 0.01 0.00 0.00 72.50 69.61 8ca2 s THR 87 CO 0.00 0.60 -0.23 -0.31 -0.69 0.00 0.00 174.62 173.99 8ca2 s TYR 88 N -0.84 2.60 -0.12 4.92 1.51 -0.55 -1.67 117.35 123.19 8ca2 s TYR 88 Ca 0.13 -1.19 -0.12 0.00 -1.01 0.00 0.00 57.07 54.88 8ca2 s TYR 88 Cb -0.12 -1.75 -0.05 0.00 -0.11 0.00 0.00 41.96 39.93 8ca2 s TYR 88 CO 0.02 -0.52 0.26 1.03 -1.11 0.00 0.00 175.55 175.24 8ca2 s ARG 89 N 0.59 3.98 0.15 -0.62 0.52 -0.37 -0.12 118.95 123.08 8ca2 s ARG 89 Ca -0.13 0.06 -0.30 0.00 -0.52 0.00 0.00 55.73 54.84 8ca2 s ARG 89 Cb -0.17 -3.33 -0.08 0.00 0.52 0.00 0.00 34.95 31.90 8ca2 s ARG 89 CO 0.03 0.47 1.27 -1.17 0.02 0.00 0.00 175.30 175.93 8ca2 s LEU 90 N -0.22 4.41 -0.04 2.53 2.96 -0.54 -1.74 118.68 126.04 8ca2 s LEU 90 Ca 0.16 2.26 0.03 0.00 -0.22 0.00 0.00 54.13 56.37 8ca2 s LEU 90 Cb -0.13 -3.60 -0.04 0.00 0.50 0.00 0.00 46.19 42.92 8ca2 s LEU 90 CO 0.05 -0.50 0.01 0.00 -1.32 0.00 0.00 176.35 174.59 8ca2 n ILE 91 N 3.14 0.24 -3.61 6.68 3.06 -0.72 -4.55 119.36 123.60 8ca2 n ILE 91 Ca 0.07 -0.15 -0.01 0.00 -2.50 0.00 0.00 62.75 60.17 8ca2 n ILE 91 Cb 0.44 -0.89 -0.01 0.00 0.54 0.00 0.00 39.64 39.72 8ca2 n ILE 91 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 8ca2 s GLN 92 N -2.09 0.36 0.06 9.51 1.03 -1.25 -1.74 119.66 125.54 8ca2 s GLN 92 Ca -0.02 -0.18 0.02 0.00 0.04 0.00 0.00 55.36 55.21 8ca2 s GLN 92 Cb 0.01 0.14 -0.03 0.00 0.03 0.00 0.00 33.01 33.16 8ca2 s GLN 92 CO 0.14 -0.16 -0.07 -0.59 -2.54 0.00 0.00 175.29 172.07 8ca2 s PHE 93 N -2.42 0.67 0.33 9.60 -0.12 -0.89 -0.62 117.98 124.54 8ca2 s PHE 93 Ca 0.12 -0.65 -0.14 0.00 -0.05 0.00 0.00 56.93 56.21 8ca2 s PHE 93 Cb 0.03 -0.41 0.03 0.00 -0.63 0.00 0.00 43.02 42.04 8ca2 s PHE 93 CO -0.04 -0.13 0.66 -3.38 -0.05 0.00 0.00 175.22 172.28 8ca2 s HIS 94 N -2.15 0.26 0.15 3.49 -3.43 -0.67 -1.71 115.29 111.23 8ca2 s HIS 94 Ca -0.04 -0.76 0.02 0.00 -0.80 0.00 0.00 55.06 53.49 8ca2 s HIS 94 Cb -0.05 0.53 -0.04 0.00 -1.43 0.00 0.00 32.58 31.59 8ca2 s HIS 94 CO -0.02 -1.32 -0.04 -0.06 -2.00 0.00 0.00 174.74 171.30 8ca2 s PHE 95 N -3.10 1.13 -0.08 0.38 0.40 -1.26 -1.19 117.98 114.27 8ca2 s PHE 95 Ca 0.18 -0.93 0.01 0.00 -0.60 0.00 0.00 56.93 55.59 8ca2 s PHE 95 Cb -0.04 -0.63 0.02 0.00 0.51 0.00 0.00 43.02 42.88 8ca2 s PHE 95 CO 0.12 -0.13 -0.07 -1.01 0.70 0.00 0.00 175.22 174.83 8ca2 s HIS 96 N -3.57 1.17 0.16 0.36 3.76 -0.68 -4.81 115.29 111.68 8ca2 s HIS 96 Ca 0.19 -0.46 0.04 0.00 -0.15 0.00 0.00 55.06 54.67 8ca2 s HIS 96 Cb 0.05 -0.98 -0.05 0.00 1.11 0.00 0.00 32.58 32.72 8ca2 s HIS 96 CO 0.01 -0.34 -0.06 1.67 -0.85 0.00 0.00 174.74 175.17 8ca2 s TRP 97 N 1.24 1.29 0.28 1.40 -2.14 -1.25 -1.46 118.94 118.30 8ca2 s TRP 97 Ca -0.05 -0.84 0.04 0.00 2.66 0.00 0.00 56.10 57.92 8ca2 s TRP 97 Cb -0.14 -0.69 0.04 0.00 -3.10 0.00 0.00 33.47 29.58 8ca2 s TRP 97 CO -0.02 0.00 0.36 0.41 -2.66 0.00 0.00 176.95 175.03 8ca2 n GLY 98 N -0.24 2.09 0.09 3.67 0.00 -1.19 -1.28 105.19 108.33 8ca2 n GLY 98 Ca -0.09 -2.18 -0.01 0.00 0.00 0.00 0.00 46.02 43.74 8ca2 n GLY 98 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 8ca2 n SER 99 N -2.56 0.82 -4.46 1.61 3.41 -1.26 -4.11 113.62 107.06 8ca2 n SER 99 Ca 0.07 0.36 -0.23 0.00 -0.26 0.00 0.00 58.87 58.81 8ca2 n SER 99 Cb 0.29 0.21 -0.10 0.00 -0.26 0.00 0.00 64.21 64.34 8ca2 n SER 99 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 8ca2 s LEU 100 N -5.76 2.26 0.00 1.04 2.01 -1.26 -5.04 118.68 111.93 8ca2 s LEU 100 Ca -0.03 -1.40 0.29 0.00 0.01 0.00 0.00 54.13 52.99 8ca2 s LEU 100 Cb 0.09 -0.44 1.39 0.00 0.01 0.00 0.00 46.19 47.24 8ca2 s LEU 100 CO 0.81 -0.61 1.97 0.47 1.01 0.00 0.00 176.35 180.00 8ca2 n ASP 101 N -0.77 0.00 -0.82 2.29 8.00 -1.26 -3.36 116.55 120.63 8ca2 n ASP 101 Ca -0.03 0.01 0.08 0.00 0.71 0.00 0.00 54.79 55.56 8ca2 n ASP 101 Cb 0.67 -0.33 0.23 0.00 -0.02 0.00 0.00 41.12 41.67 8ca2 n ASP 101 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 8ca2 n GLY 102 N 1.20 1.03 3.69 0.44 0.00 -1.26 -3.68 105.19 106.61 8ca2 n GLY 102 Ca 0.12 -0.50 -0.08 0.00 0.00 0.00 0.00 46.02 45.56 8ca2 n GLY 102 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 8ca2 s GLN 103 N -1.47 1.63 0.00 1.61 -2.07 -1.21 -4.75 119.66 113.39 8ca2 s GLN 103 Ca 0.32 -1.10 0.00 0.00 -1.82 0.00 0.00 55.36 52.75 8ca2 s GLN 103 Cb 0.17 0.53 0.00 0.00 -1.09 0.00 0.00 33.01 32.62 8ca2 s GLN 103 CO 0.23 -0.71 0.00 0.41 -1.32 0.00 0.00 175.29 173.90 8ca2 n GLY 104 N -0.41 4.33 3.76 2.60 0.00 -0.95 -3.61 105.19 110.91 8ca2 n GLY 104 Ca -0.04 -0.78 -0.32 0.00 0.00 0.00 0.00 46.02 44.88 8ca2 n GLY 104 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 8ca2 s SER 105 N 0.00 4.55 -0.23 1.61 1.04 -0.44 -3.74 113.70 116.49 8ca2 s SER 105 Ca 0.00 1.97 -0.19 0.00 0.48 0.00 0.00 55.95 58.21 8ca2 s SER 105 Cb 0.00 -2.54 -0.17 0.00 0.10 0.00 0.00 66.02 63.40 8ca2 s SER 105 CO 0.00 -2.01 0.05 -0.62 0.98 0.00 0.00 173.24 171.65 8ca2 n GLU 106 N -3.11 0.58 -3.08 4.02 1.02 -1.26 -4.81 120.64 113.99 8ca2 n GLU 106 Ca 0.10 0.48 -0.33 0.00 -0.02 0.00 0.00 57.16 57.39 8ca2 n GLU 106 Cb 0.52 -1.67 -0.06 0.00 -0.02 0.00 0.00 31.44 30.21 8ca2 n GLU 106 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 8ca2 s HIS 107 N -2.41 3.43 0.19 -0.32 3.76 -1.26 -4.40 115.29 114.29 8ca2 s HIS 107 Ca -0.32 1.31 0.09 0.00 -0.15 0.00 0.00 55.06 55.99 8ca2 s HIS 107 Cb 0.08 -2.60 -0.04 0.00 1.11 0.00 0.00 32.58 31.13 8ca2 s HIS 107 CO 0.57 0.13 -0.17 0.95 -0.85 0.00 0.00 174.74 175.37 8ca2 s THR 108 N -1.90 1.85 -0.25 1.30 -4.23 -1.12 -4.72 115.64 106.57 8ca2 s THR 108 Ca 0.53 -2.10 0.02 0.00 -1.18 0.00 0.00 61.69 58.96 8ca2 s THR 108 Cb -0.12 -1.98 0.06 0.00 1.34 0.00 0.00 72.50 71.81 8ca2 s THR 108 CO 0.18 -0.45 -0.10 -0.69 -0.54 0.00 0.00 174.62 173.02 8ca2 s VAL 109 N -2.50 2.01 -1.53 2.29 1.01 -0.68 -0.76 120.40 120.24 8ca2 s VAL 109 Ca 0.20 -1.52 -0.04 0.00 0.00 0.00 0.00 61.98 60.62 8ca2 s VAL 109 Cb -0.03 -2.15 0.01 0.00 0.00 0.00 0.00 36.38 34.21 8ca2 s VAL 109 CO 0.08 -0.03 0.47 0.47 0.00 0.00 0.00 175.10 176.08 8ca2 n ASP 110 N 4.49 -5.64 0.00 3.32 8.00 0.47 -0.36 116.55 126.84 8ca2 n ASP 110 Ca -0.14 -0.23 0.00 0.00 0.71 0.00 0.00 54.79 55.13 8ca2 n ASP 110 Cb 0.43 -4.60 0.00 0.00 -0.02 0.00 0.00 41.12 36.93 8ca2 n ASP 110 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 8ca2 n LYS 111 N -3.77 0.00 -2.40 -1.24 4.76 -1.26 -5.00 118.16 109.25 8ca2 n LYS 111 Ca -0.12 0.00 -0.42 0.00 -2.87 0.00 0.00 58.31 54.90 8ca2 n LYS 111 Cb 0.62 -2.40 -0.03 0.00 -1.84 0.00 0.00 35.03 31.38 8ca2 n LYS 111 CO 0.00 0.00 0.00 0.21 -1.37 0.00 0.00 177.40 176.24 8ca2 s LYS 112 N -0.09 4.46 -0.08 1.97 2.20 0.52 -4.96 119.74 123.77 8ca2 s LYS 112 Ca 0.00 1.82 0.00 0.00 -0.36 0.00 0.00 55.97 57.43 8ca2 s LYS 112 Cb 0.00 -3.30 -0.03 0.00 -1.51 0.00 0.00 37.83 32.99 8ca2 s LYS 112 CO 0.00 -0.18 -0.06 0.15 -0.36 0.00 0.00 175.35 174.89 8ca2 s LYS 113 N 0.50 2.85 0.51 4.03 1.02 -1.26 -1.69 119.74 125.71 8ca2 s LYS 113 Ca 0.56 -0.54 0.03 0.00 0.02 0.00 0.00 55.97 56.04 8ca2 s LYS 113 Cb -0.31 -2.63 0.02 0.00 -0.52 0.00 0.00 37.83 34.40 8ca2 s LYS 113 CO 0.32 0.62 0.71 0.71 -0.92 0.00 0.00 175.35 176.79 8ca2 s TYR 114 N -0.68 2.86 -0.13 3.18 2.02 -1.26 -4.57 117.35 118.77 8ca2 s TYR 114 Ca 0.10 -0.12 0.28 0.00 -0.37 0.00 0.00 57.07 56.97 8ca2 s TYR 114 Cb -0.11 -2.62 0.89 0.00 -0.40 0.00 0.00 41.96 39.72 8ca2 s TYR 114 CO 0.02 -0.71 1.81 0.00 -1.57 0.00 0.00 175.55 175.09 8ca2 h ALA 115 N 0.26 0.99 -2.14 3.71 0.00 -1.55 -1.05 119.26 119.48 8ca2 h ALA 115 Ca -0.42 -0.02 0.20 0.00 0.00 0.00 0.00 54.91 54.68 8ca2 h ALA 115 Cb 1.29 -0.00 -0.10 0.00 0.00 0.00 0.00 17.79 18.98 8ca2 h ALA 115 CO 0.50 0.02 0.56 0.00 0.00 0.00 0.00 179.25 180.33 8ca2 s ALA 116 N -3.46 -1.80 -0.07 0.00 0.00 -1.18 -3.17 121.76 112.08 8ca2 s ALA 116 Ca 0.04 0.39 -0.03 0.00 0.00 0.00 0.00 51.96 52.35 8ca2 s ALA 116 Cb 0.07 0.54 0.04 0.00 0.00 0.00 0.00 23.12 23.77 8ca2 s ALA 116 CO 0.60 -0.99 0.15 -2.00 0.00 0.00 0.00 175.76 173.53 8ca2 s GLU 117 N -3.08 0.06 -0.20 0.00 2.12 -0.53 -2.16 118.70 114.91 8ca2 s GLU 117 Ca 0.12 0.46 -0.13 0.00 0.36 0.00 0.00 54.97 55.77 8ca2 s GLU 117 Cb -0.00 -0.22 -0.05 0.00 0.26 0.00 0.00 34.13 34.12 8ca2 s GLU 117 CO -0.01 -0.23 0.28 -1.17 -0.54 0.00 0.00 175.26 173.59 8ca2 s LEU 118 N 1.69 4.17 -0.10 2.70 2.96 0.12 -1.68 118.68 128.54 8ca2 s LEU 118 Ca -0.04 0.37 0.03 0.00 -0.22 0.00 0.00 54.13 54.28 8ca2 s LEU 118 Cb -0.12 -2.32 0.00 0.00 0.50 0.00 0.00 46.19 44.26 8ca2 s LEU 118 CO -0.06 0.04 -0.22 -1.00 -1.32 0.00 0.00 176.35 173.79 8ca2 s HIS 119 N 0.92 2.41 -0.25 5.38 3.76 -0.33 -0.88 115.29 126.30 8ca2 s HIS 119 Ca 0.14 -1.04 -0.05 0.00 -0.15 0.00 0.00 55.06 53.96 8ca2 s HIS 119 Cb -0.14 -1.63 -0.00 0.00 1.11 0.00 0.00 32.58 31.92 8ca2 s HIS 119 CO 0.05 -0.44 0.01 -0.51 -0.85 0.00 0.00 174.74 172.99 8ca2 s LEU 120 N 0.51 3.29 -0.19 0.89 1.02 -0.65 -1.67 118.68 121.88 8ca2 s LEU 120 Ca -0.15 -0.52 -0.15 0.00 0.02 0.00 0.00 54.13 53.32 8ca2 s LEU 120 Cb -0.17 -1.80 -0.04 0.00 0.02 0.00 0.00 46.19 44.20 8ca2 s LEU 120 CO 0.06 -0.09 0.37 -0.69 0.02 0.00 0.00 176.35 176.02 8ca2 s VAL 121 N 1.48 5.23 0.09 -1.59 1.01 0.21 -1.26 120.40 125.56 8ca2 s VAL 121 Ca 0.04 0.66 0.07 0.00 0.00 0.00 0.00 61.98 62.76 8ca2 s VAL 121 Cb -0.16 -3.70 -0.03 0.00 0.00 0.00 0.00 36.38 32.49 8ca2 s VAL 121 CO -0.01 0.29 -0.19 -1.00 0.00 0.00 0.00 175.10 174.18 8ca2 s HIS 122 N 1.10 1.67 -0.05 5.22 3.76 0.81 -1.75 115.29 126.05 8ca2 s HIS 122 Ca 0.18 -0.42 0.04 0.00 -0.15 0.00 0.00 55.06 54.72 8ca2 s HIS 122 Cb -0.14 -0.93 -0.00 0.00 1.11 0.00 0.00 32.58 32.61 8ca2 s HIS 122 CO 0.07 0.16 -0.16 1.67 -0.85 0.00 0.00 174.74 175.63 8ca2 s TRP 123 N -1.11 1.66 -0.15 1.40 1.48 -0.71 -0.27 118.94 121.24 8ca2 s TRP 123 Ca 0.05 -0.50 -0.29 0.00 -1.06 0.00 0.00 56.10 54.30 8ca2 s TRP 123 Cb -0.10 -1.13 -0.06 0.00 -1.16 0.00 0.00 33.47 31.02 8ca2 s TRP 123 CO 0.03 -0.19 2.15 1.21 -4.06 0.00 0.00 176.95 176.09 8ca2 s ASN 124 N 0.15 5.74 0.04 -2.66 3.84 0.12 -1.23 114.94 120.94 8ca2 s ASN 124 Ca -0.06 2.12 0.15 0.00 0.21 0.00 0.00 52.86 55.27 8ca2 s ASN 124 Cb -0.12 -2.52 0.63 0.00 -0.55 0.00 0.00 41.25 38.69 8ca2 s ASN 124 CO 0.03 -1.70 1.47 0.35 -2.79 0.00 0.00 177.10 174.45 8ca2 n THR 125 N 7.11 1.06 0.37 -5.21 -2.24 -0.67 -2.87 114.28 111.83 8ca2 n THR 125 Ca 0.27 0.27 0.10 0.00 -2.27 0.00 0.00 64.05 62.43 8ca2 n THR 125 Cb 0.44 -1.08 0.45 0.00 -2.10 0.00 0.00 70.33 68.04 8ca2 n THR 125 CO 0.00 0.00 0.00 2.29 -0.57 0.00 0.00 175.07 176.79 8ca2 n LYS 127 N -1.62 0.14 0.00 -0.78 2.85 -1.26 -0.32 118.16 117.17 8ca2 n LYS 127 Ca 0.03 0.42 0.15 0.00 -1.05 0.00 0.00 58.31 57.86 8ca2 n LYS 127 Cb 0.16 -1.79 0.78 0.00 -0.65 0.00 0.00 35.03 33.53 8ca2 n LYS 127 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 8ca2 n TYR 128 N -2.06 0.00 0.00 5.58 4.01 -1.14 -4.99 117.16 118.56 8ca2 n TYR 128 Ca 0.02 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.76 8ca2 n TYR 128 Cb 0.18 -0.01 0.00 0.00 -0.31 0.00 0.00 39.34 39.20 8ca2 n TYR 128 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 8ca2 n GLY 129 N 1.08 0.97 3.43 2.72 0.00 0.57 -4.53 105.19 109.43 8ca2 n GLY 129 Ca 0.22 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.14 8ca2 n GLY 129 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 8ca2 s ASP 130 N -0.09 -0.11 0.17 1.61 1.47 -1.26 -5.05 116.67 113.41 8ca2 s ASP 130 Ca 0.00 -0.66 -0.11 0.00 1.18 0.00 0.00 52.55 52.96 8ca2 s ASP 130 Cb 0.00 0.51 0.07 0.00 -0.34 0.00 0.00 42.92 43.16 8ca2 s ASP 130 CO 0.00 -0.98 1.67 0.15 0.68 0.00 0.00 175.17 176.70 8ca2 h PHE 131 N 2.36 1.04 -0.86 2.11 3.57 -1.94 -2.64 116.94 120.59 8ca2 h PHE 131 Ca -0.30 -0.13 0.15 0.00 3.53 0.00 0.00 57.97 61.22 8ca2 h PHE 131 Cb 1.25 -0.29 -0.10 0.00 2.79 0.00 0.00 35.95 39.60 8ca2 h PHE 131 CO 0.37 0.89 0.45 0.78 -2.23 0.00 0.00 178.31 178.57 8ca2 h GLY 132 N 0.89 1.41 1.93 2.40 0.00 -1.96 -1.78 103.07 105.96 8ca2 h GLY 132 Ca 0.19 -0.26 -0.20 0.00 0.00 0.00 0.00 47.33 47.06 8ca2 h GLY 132 CO 0.01 -0.04 -0.99 0.50 0.00 0.00 0.00 176.54 176.01 8ca2 h LYS 133 N 0.63 0.00 -0.44 4.80 1.79 -1.80 -3.32 116.57 118.23 8ca2 h LYS 133 Ca 0.47 0.00 -0.05 0.00 -2.18 0.00 0.00 60.65 58.89 8ca2 h LYS 133 Cb 0.68 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 31.30 8ca2 h LYS 133 CO -0.37 0.91 0.04 0.00 -1.08 0.00 0.00 179.45 178.96 8ca2 h ALA 134 N 1.06 1.26 -0.04 3.86 0.00 -0.97 -2.66 119.26 121.77 8ca2 h ALA 134 Ca -0.03 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.65 8ca2 h ALA 134 Cb 1.74 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 19.34 8ca2 h ALA 134 CO 0.12 0.50 0.02 1.33 0.00 0.00 0.00 179.25 181.22 8ca2 n VAL 135 N -4.26 0.72 -0.42 0.00 0.24 -0.87 -2.46 118.33 111.28 8ca2 n VAL 135 Ca 0.03 -0.08 0.00 0.00 -2.04 0.00 0.00 64.34 62.24 8ca2 n VAL 135 Cb 0.25 -0.78 0.00 0.00 -1.47 0.00 0.00 33.84 31.84 8ca2 n VAL 135 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 8ca2 n GLN 136 N 0.27 0.86 -4.50 7.34 6.02 -1.00 -4.97 117.38 121.39 8ca2 n GLN 136 Ca 0.02 -0.78 -0.28 0.00 -0.01 0.00 0.00 57.00 55.96 8ca2 n GLN 136 Cb 0.45 -0.79 -0.13 0.00 1.02 0.00 0.00 30.24 30.79 8ca2 n GLN 136 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 8ca2 s GLN 137 N -0.36 1.41 0.60 -1.09 -1.52 -1.03 -5.01 119.66 112.66 8ca2 s GLN 137 Ca 0.00 -1.20 0.38 0.00 -1.95 0.00 0.00 55.36 52.59 8ca2 s GLN 137 Cb 0.00 -1.74 1.80 0.00 -0.22 0.00 0.00 33.01 32.85 8ca2 s GLN 137 CO 0.00 0.42 2.14 -1.00 -0.25 0.00 0.00 175.29 176.61 8ca2 h PRO 138 N 4.25 0.00 0.00 2.91 0.13 -1.86 -2.81 132.00 134.62 8ca2 h PRO 138 Ca -0.48 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.61 8ca2 h PRO 138 Cb 1.17 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 32.21 8ca2 h PRO 138 CO 0.41 0.01 -0.52 -0.40 -0.23 0.00 0.00 178.00 177.27 8ca2 n ASP 139 N -3.12 1.52 -0.09 1.44 5.75 -1.26 -4.37 116.55 116.42 8ca2 n ASP 139 Ca -0.01 -3.14 -0.10 0.00 -0.01 0.00 0.00 54.79 51.53 8ca2 n ASP 139 Cb 0.21 -0.43 -0.03 0.00 -1.03 0.00 0.00 41.12 39.84 8ca2 n ASP 139 CO 0.00 0.00 0.00 1.23 -0.11 0.00 0.00 177.20 178.32 8ca2 h GLY 140 N 0.70 0.48 -2.21 6.12 0.00 -1.31 -3.44 103.07 103.41 8ca2 h GLY 140 Ca -0.05 -0.29 -0.60 0.00 0.00 0.00 0.00 47.33 46.39 8ca2 h GLY 140 CO 0.02 0.27 -0.71 1.08 0.00 0.00 0.00 176.54 177.21 8ca2 s LEU 141 N -9.71 2.78 -0.06 3.11 1.43 -0.61 -0.71 118.68 114.92 8ca2 s LEU 141 Ca -0.13 -0.99 -0.02 0.00 -1.03 0.00 0.00 54.13 51.96 8ca2 s LEU 141 Cb 0.08 -1.23 0.03 0.00 0.03 0.00 0.00 46.19 45.11 8ca2 s LEU 141 CO 0.74 -0.05 0.05 0.00 0.23 0.00 0.00 176.35 177.32 8ca2 s ALA 142 N -2.50 0.35 -0.18 4.21 0.00 0.63 -2.26 121.76 122.02 8ca2 s ALA 142 Ca 0.31 0.07 -0.04 0.00 0.00 0.00 0.00 51.96 52.30 8ca2 s ALA 142 Cb -0.03 -0.69 -0.03 0.00 0.00 0.00 0.00 23.12 22.37 8ca2 s ALA 142 CO 0.17 -0.56 -0.02 -1.01 0.00 0.00 0.00 175.76 174.34 8ca2 s HIS 143 N 2.12 3.03 -0.36 0.00 3.76 -0.55 -0.14 115.29 123.15 8ca2 s HIS 143 Ca 0.05 -0.40 -0.13 0.00 -0.15 0.00 0.00 55.06 54.43 8ca2 s HIS 143 Cb -0.13 -2.02 0.00 0.00 1.11 0.00 0.00 32.58 31.54 8ca2 s HIS 143 CO -0.04 -0.15 0.25 -1.17 -0.85 0.00 0.00 174.74 172.78 8ca2 s LEU 144 N 0.70 4.69 -0.14 0.89 0.20 -0.39 -1.24 118.68 123.39 8ca2 s LEU 144 Ca -0.01 -0.65 -0.05 0.00 0.69 0.00 0.00 54.13 54.11 8ca2 s LEU 144 Cb -0.14 -2.12 -0.03 0.00 -0.43 0.00 0.00 46.19 43.46 8ca2 s LEU 144 CO 0.02 -0.32 0.02 -0.83 -0.29 0.00 0.00 176.35 174.96 8ca2 s GLY 145 N 1.68 1.86 -0.06 7.98 0.00 0.95 -1.63 107.32 118.10 8ca2 s GLY 145 Ca 0.05 -0.77 0.01 0.00 0.00 0.00 0.00 44.72 44.01 8ca2 s GLY 145 CO 0.09 -0.18 -0.07 -0.42 0.00 0.00 0.00 173.10 172.53 8ca2 s ILE 146 N -0.07 0.76 0.11 0.90 1.01 -0.06 -0.98 121.20 122.86 8ca2 s ILE 146 Ca 0.05 -0.23 -0.19 0.00 0.00 0.00 0.00 60.65 60.27 8ca2 s ILE 146 Cb -0.13 -0.75 -0.07 0.00 0.01 0.00 0.00 42.46 41.52 8ca2 s ILE 146 CO 0.02 0.28 0.61 -0.36 0.00 0.00 0.00 174.94 175.49 8ca2 s PHE 147 N 1.00 3.78 -0.16 3.97 0.08 -1.26 0.14 117.98 125.52 8ca2 s PHE 147 Ca -0.09 1.30 -0.00 0.00 0.12 0.00 0.00 56.93 58.25 8ca2 s PHE 147 Cb -0.14 -2.53 -0.00 0.00 -0.57 0.00 0.00 43.02 39.78 8ca2 s PHE 147 CO -0.00 0.53 -0.13 -0.51 -0.10 0.00 0.00 175.22 175.01 8ca2 s LEU 148 N -1.32 2.56 0.29 -0.37 1.02 -0.92 -0.66 118.68 119.28 8ca2 s LEU 148 Ca 0.32 -0.45 0.10 0.00 0.02 0.00 0.00 54.13 54.13 8ca2 s LEU 148 Cb -0.19 -1.60 -0.05 0.00 0.02 0.00 0.00 46.19 44.38 8ca2 s LEU 148 CO 0.20 0.07 -0.07 -1.59 0.02 0.00 0.00 176.35 174.99 8ca2 s LYS 149 N 0.89 2.03 -0.18 1.70 -2.85 -0.30 -2.42 119.74 118.61 8ca2 s LYS 149 Ca -0.03 -1.61 -0.12 0.00 -1.00 0.00 0.00 55.97 53.20 8ca2 s LYS 149 Cb -0.15 -1.97 -0.05 0.00 -2.06 0.00 0.00 37.83 33.60 8ca2 s LYS 149 CO -0.01 0.30 0.23 0.08 0.10 0.00 0.00 175.35 176.05 8ca2 s VAL 150 N -2.43 5.35 0.00 1.79 1.01 -1.26 -0.93 120.40 123.93 8ca2 s VAL 150 Ca 0.32 0.40 0.00 0.00 0.00 0.00 0.00 61.98 62.69 8ca2 s VAL 150 Cb -0.04 -3.57 0.00 0.00 0.00 0.00 0.00 36.38 32.77 8ca2 s VAL 150 CO 0.18 0.41 0.00 0.61 0.00 0.00 0.00 175.10 176.30 8ca2 n GLY 151 N 3.48 0.74 3.77 4.51 0.00 -0.01 -4.90 105.19 112.78 8ca2 n GLY 151 Ca -0.14 0.42 -0.34 0.00 0.00 0.00 0.00 46.02 45.96 8ca2 n GLY 151 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 8ca2 s SER 152 N 2.00 5.43 0.54 1.61 0.01 -1.26 -3.85 113.70 118.18 8ca2 s SER 152 Ca 0.00 2.08 -0.20 0.00 1.31 0.00 0.00 55.95 59.14 8ca2 s SER 152 Cb 0.00 -2.56 -0.06 0.00 0.21 0.00 0.00 66.02 63.60 8ca2 s SER 152 CO 0.00 -1.41 1.12 0.00 0.41 0.00 0.00 173.24 173.36 8ca2 s ALA 153 N -2.07 2.72 -0.36 1.44 0.00 -1.26 -2.16 121.76 120.06 8ca2 s ALA 153 Ca 0.70 0.81 -0.06 0.00 0.00 0.00 0.00 51.96 53.40 8ca2 s ALA 153 Cb -0.22 -3.35 0.06 0.00 0.00 0.00 0.00 23.12 19.61 8ca2 s ALA 153 CO 0.34 -0.73 0.15 0.21 0.00 0.00 0.00 175.76 175.73 8ca2 s LYS 154 N -3.27 2.54 0.19 0.00 2.47 -1.26 -4.78 119.74 115.64 8ca2 s LYS 154 Ca 0.72 -1.32 -0.13 0.00 -1.56 0.00 0.00 55.97 53.68 8ca2 s LYS 154 Cb -0.23 -3.53 0.20 0.00 -1.46 0.00 0.00 37.83 32.81 8ca2 s LYS 154 CO 0.26 -0.78 1.70 -1.00 0.16 0.00 0.00 175.35 175.70 8ca2 h PRO 155 N 8.23 0.20 0.00 4.03 0.13 -1.93 -2.56 132.00 140.10 8ca2 h PRO 155 Ca -0.22 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.90 8ca2 h PRO 155 Cb 1.08 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 32.16 8ca2 h PRO 155 CO 0.64 0.13 0.00 0.41 -0.23 0.00 0.00 178.00 178.95 8ca2 n GLY 156 N -1.30 -0.74 0.02 1.56 0.00 -1.26 -2.76 105.19 100.71 8ca2 n GLY 156 Ca 0.06 0.09 0.11 0.00 0.00 0.00 0.00 46.02 46.28 8ca2 n GLY 156 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 8ca2 n LEU 157 N -1.89 0.41 -0.36 0.99 7.94 -0.96 -4.58 117.00 118.55 8ca2 n LEU 157 Ca -0.00 -0.11 0.02 0.00 -1.11 0.00 0.00 56.01 54.81 8ca2 n LEU 157 Cb 0.04 -0.02 0.17 0.00 0.53 0.00 0.00 43.42 44.14 8ca2 n LEU 157 CO 0.06 0.06 1.25 -0.61 -1.11 0.00 0.00 177.39 177.04 8ca2 h GLN 158 N 0.00 1.09 -0.99 1.96 5.75 -1.56 -2.59 115.11 118.76 8ca2 h GLN 158 Ca 0.00 -0.07 0.20 0.00 -0.15 0.00 0.00 58.65 58.63 8ca2 h GLN 158 Cb 0.82 -0.25 -0.10 0.00 1.07 0.00 0.00 27.48 29.03 8ca2 h GLN 158 CO 0.00 0.72 0.62 0.87 -2.65 0.00 0.00 178.83 178.38 8ca2 h LYS 159 N 1.12 0.66 -0.04 1.69 1.57 -1.81 0.53 116.57 120.29 8ca2 h LYS 159 Ca 0.42 -0.04 -0.03 0.00 -1.87 0.00 0.00 60.65 59.14 8ca2 h LYS 159 Cb 0.19 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 32.35 8ca2 h LYS 159 CO -0.18 0.44 -0.08 0.28 -0.57 0.00 0.00 179.45 179.33 8ca2 h VAL 160 N 0.68 1.43 -0.61 0.50 2.07 -1.83 -3.09 116.25 115.41 8ca2 h VAL 160 Ca 0.57 -1.40 0.10 0.00 0.82 0.00 0.00 66.70 66.78 8ca2 h VAL 160 Cb 0.99 2.27 -0.07 0.00 -1.52 0.00 0.00 31.29 32.96 8ca2 h VAL 160 CO -0.34 0.38 0.22 0.58 0.02 0.00 0.00 177.57 178.42 8ca2 h VAL 161 N -0.39 0.75 0.00 2.57 2.07 -0.85 -2.03 116.25 118.37 8ca2 h VAL 161 Ca 0.00 -0.13 -0.07 0.00 0.82 0.00 0.00 66.70 67.32 8ca2 h VAL 161 Cb 0.66 0.33 -0.01 0.00 -1.52 0.00 0.00 31.29 30.75 8ca2 h VAL 161 CO 0.02 0.07 -0.34 0.44 0.02 0.00 0.00 177.57 177.77 8ca2 h ASP 162 N 0.39 0.00 1.20 0.57 3.32 -1.00 -3.21 116.42 117.69 8ca2 h ASP 162 Ca 0.31 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.36 8ca2 h ASP 162 Cb 0.40 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.95 8ca2 h ASP 162 CO -0.32 0.34 -0.46 1.62 -1.72 0.00 0.00 179.24 178.70 8ca2 h VAL 163 N 0.00 0.00 -0.24 -1.35 3.04 -1.28 -3.36 116.25 113.06 8ca2 h VAL 163 Ca -0.00 -0.66 0.07 0.00 -1.01 0.00 0.00 66.70 65.10 8ca2 h VAL 163 Cb 0.71 1.38 -0.01 0.00 -2.01 0.00 0.00 31.29 31.37 8ca2 h VAL 163 CO 0.04 0.00 0.20 -0.07 -1.01 0.00 0.00 177.57 176.73 8ca2 h LEU 164 N 0.00 0.00 -1.84 3.16 3.38 -1.49 0.20 115.31 118.72 8ca2 h LEU 164 Ca 0.00 0.00 0.07 0.00 0.09 0.00 0.00 57.88 58.04 8ca2 h LEU 164 Cb 0.83 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.56 8ca2 h LEU 164 CO 0.00 0.00 0.26 0.44 0.09 0.00 0.00 178.44 179.23 8ca2 h ASP 165 N 0.00 0.17 1.46 -0.43 3.32 -1.80 -2.00 116.42 117.15 8ca2 h ASP 165 Ca 0.11 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 57.10 8ca2 h ASP 165 Cb 0.51 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 40.01 8ca2 h ASP 165 CO -0.00 0.11 -0.31 0.28 -1.72 0.00 0.00 179.24 177.60 8ca2 h SER 166 N 0.19 0.00 -1.02 6.45 0.02 -0.87 -3.32 113.55 115.00 8ca2 h SER 166 Ca 0.17 0.00 -0.52 0.00 -0.84 0.00 0.00 61.79 60.60 8ca2 h SER 166 Cb 0.43 0.00 -0.42 0.00 0.14 0.00 0.00 62.40 62.55 8ca2 h SER 166 CO -0.03 0.31 -0.85 2.30 -1.14 0.00 0.00 176.83 177.42 8ca2 n ILE 167 N -3.23 2.23 0.09 3.27 -5.35 -0.76 -4.78 119.36 110.83 8ca2 n ILE 167 Ca 0.02 -4.26 -0.16 0.00 -0.27 0.00 0.00 62.75 58.08 8ca2 n ILE 167 Cb 0.60 -0.80 -0.10 0.00 -1.74 0.00 0.00 39.64 37.61 8ca2 n ILE 167 CO 0.00 0.00 0.00 0.50 -1.76 0.00 0.00 176.55 175.29 8ca2 h LYS 168 N 2.43 -0.69 -6.68 6.28 3.64 -1.65 -3.42 116.57 116.48 8ca2 h LYS 168 Ca 0.26 0.05 -0.45 0.00 -1.27 0.00 0.00 60.65 59.23 8ca2 h LYS 168 Cb 1.26 0.16 0.03 0.00 -0.41 0.00 0.00 32.23 33.27 8ca2 h LYS 168 CO 0.71 -0.46 -0.11 0.95 -2.27 0.00 0.00 179.45 178.27 8ca2 s THR 169 N -5.78 3.84 0.03 1.00 -4.23 -1.26 -2.00 115.64 107.23 8ca2 s THR 169 Ca -0.16 -0.56 -0.31 0.00 -1.18 0.00 0.00 61.69 59.48 8ca2 s THR 169 Cb 0.06 -3.41 -0.10 0.00 1.34 0.00 0.00 72.50 70.39 8ca2 s THR 169 CO 0.61 -0.28 1.94 1.17 -0.54 0.00 0.00 174.62 177.53 8ca2 n LYS 170 N -2.07 2.76 0.00 3.99 4.81 -0.39 -2.35 118.16 124.91 8ca2 n LYS 170 Ca 0.02 1.01 0.00 0.00 -0.87 0.00 0.00 58.31 58.47 8ca2 n LYS 170 Cb 0.58 -2.95 0.00 0.00 0.02 0.00 0.00 35.03 32.68 8ca2 n LYS 170 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 8ca2 n GLY 171 N 4.49 2.06 3.77 3.14 0.00 0.24 -4.38 105.19 114.50 8ca2 n GLY 171 Ca 0.20 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.86 8ca2 n GLY 171 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 8ca2 s LYS 172 N -0.12 3.55 0.02 1.61 -0.14 -0.99 -4.80 119.74 118.87 8ca2 s LYS 172 Ca 0.00 1.69 -0.08 0.00 -1.36 0.00 0.00 55.97 56.21 8ca2 s LYS 172 Cb 0.00 -2.19 0.00 0.00 -1.68 0.00 0.00 37.83 33.96 8ca2 s LYS 172 CO 0.00 -0.71 0.17 -1.54 -0.76 0.00 0.00 175.35 172.51 8ca2 s SER 173 N -1.58 0.04 -0.01 2.83 1.04 -1.26 -0.62 113.70 114.14 8ca2 s SER 173 Ca 0.68 -0.31 -0.04 0.00 0.48 0.00 0.00 55.95 56.76 8ca2 s SER 173 Cb -0.26 0.25 -0.00 0.00 0.10 0.00 0.00 66.02 66.11 8ca2 s SER 173 CO 0.30 -0.48 0.08 0.00 0.98 0.00 0.00 173.24 174.12 8ca2 s ALA 174 N -2.09 -0.18 0.47 5.32 0.00 0.16 -4.96 121.76 120.50 8ca2 s ALA 174 Ca -0.09 -0.11 -0.24 0.00 0.00 0.00 0.00 51.96 51.51 8ca2 s ALA 174 Cb -0.04 0.03 -0.07 0.00 0.00 0.00 0.00 23.12 23.03 8ca2 s ALA 174 CO -0.02 -0.14 1.42 -0.51 0.00 0.00 0.00 175.76 176.52 8ca2 s ASP 175 N -0.89 5.70 -0.47 0.00 1.01 -1.26 -0.60 116.67 120.15 8ca2 s ASP 175 Ca -0.10 2.91 0.06 0.00 0.71 0.00 0.00 52.55 56.14 8ca2 s ASP 175 Cb -0.06 -2.65 0.25 0.00 1.01 0.00 0.00 42.92 41.48 8ca2 s ASP 175 CO 0.00 -1.29 0.89 0.33 0.21 0.00 0.00 175.17 175.31 8ca2 n PHE 176 N -0.40 -2.95 -2.82 4.23 7.35 -0.65 -4.70 117.46 117.52 8ca2 n PHE 176 Ca 0.06 -2.01 -0.23 0.00 -0.76 0.00 0.00 57.45 54.51 8ca2 n PHE 176 Cb 0.42 1.37 0.02 0.00 0.35 0.00 0.00 39.48 41.64 8ca2 n PHE 176 CO 0.00 0.00 0.00 0.95 -0.76 0.00 0.00 176.76 176.95 8ca2 s THR 177 N 0.40 3.69 -1.48 -2.13 -4.23 -1.24 -2.80 115.64 107.86 8ca2 s THR 177 Ca 0.31 -0.44 -0.12 0.00 -1.18 0.00 0.00 61.69 60.27 8ca2 s THR 177 Cb 0.24 -3.39 0.07 0.00 1.34 0.00 0.00 72.50 70.76 8ca2 s THR 177 CO -0.20 -0.30 0.84 0.59 -0.54 0.00 0.00 174.62 175.01 8ca2 n ASN 178 N -2.22 -4.86 -4.69 3.99 4.13 -1.25 -4.92 115.26 105.44 8ca2 n ASN 178 Ca 0.03 -0.62 -0.37 0.00 1.68 0.00 0.00 54.58 55.30 8ca2 n ASN 178 Cb 0.58 -3.90 -0.08 0.00 -1.54 0.00 0.00 39.78 34.83 8ca2 n ASN 178 CO 0.00 0.00 0.00 0.12 0.28 0.00 0.00 177.26 177.66 8ca2 s PHE 179 N -3.21 3.37 -0.32 3.10 5.36 -1.26 -5.02 117.98 120.00 8ca2 s PHE 179 Ca 0.56 0.39 -0.10 0.00 -0.96 0.00 0.00 56.93 56.83 8ca2 s PHE 179 Cb -0.28 -2.32 -0.00 0.00 -0.34 0.00 0.00 43.02 40.08 8ca2 s PHE 179 CO 0.70 0.12 0.17 0.34 -1.46 0.00 0.00 175.22 175.08 8ca2 s ASP 180 N 0.83 5.61 0.55 6.13 -1.08 -1.26 -4.41 116.67 123.03 8ca2 s ASP 180 Ca 0.12 -0.61 0.30 0.00 -0.52 0.00 0.00 52.55 51.83 8ca2 s ASP 180 Cb -0.13 -2.01 1.63 0.00 -1.46 0.00 0.00 42.92 40.94 8ca2 s ASP 180 CO 0.04 -0.23 2.14 1.55 0.52 0.00 0.00 175.17 179.19 8ca2 h PRO 181 N 8.37 0.00 0.00 4.34 0.13 -1.96 -3.06 132.00 139.82 8ca2 h PRO 181 Ca -0.31 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.82 8ca2 h PRO 181 Cb 1.14 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.27 8ca2 h PRO 181 CO 0.63 0.07 0.17 0.00 -0.23 0.00 0.00 178.00 178.64 8ca2 h ARG 182 N 0.00 0.00 0.00 0.86 3.08 -1.93 0.12 114.38 116.51 8ca2 h ARG 182 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 8ca2 h ARG 182 Cb 0.22 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.27 8ca2 h ARG 182 CO 0.01 0.00 0.00 0.41 -1.07 0.00 0.00 179.97 179.32 8ca2 n GLY 183 N -1.21 -1.48 0.68 0.04 0.00 -1.16 -3.12 105.19 98.94 8ca2 n GLY 183 Ca -0.02 0.03 0.12 0.00 0.00 0.00 0.00 46.02 46.15 8ca2 n GLY 183 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 8ca2 n LEU 184 N -2.23 2.37 -4.86 0.99 4.77 0.42 -4.51 117.00 113.94 8ca2 n LEU 184 Ca 0.04 -0.82 -0.33 0.00 -0.03 0.00 0.00 56.01 54.87 8ca2 n LEU 184 Cb 0.32 -0.01 -0.06 0.00 -2.33 0.00 0.00 43.42 41.35 8ca2 n LEU 184 CO 0.25 0.41 0.29 -0.76 -1.33 0.00 0.00 177.39 176.25 8ca2 s LEU 185 N -2.24 4.16 0.90 2.23 1.43 -1.18 -4.95 118.68 119.03 8ca2 s LEU 185 Ca 0.24 1.06 -0.14 0.00 -1.03 0.00 0.00 54.13 54.27 8ca2 s LEU 185 Cb 0.19 -3.76 0.14 0.00 0.03 0.00 0.00 46.19 42.80 8ca2 s LEU 185 CO 0.44 -0.09 1.23 -2.16 0.23 0.00 0.00 176.35 176.00 8ca2 s PRO 186 N -2.74 1.18 0.00 1.29 0.04 -1.26 -5.00 135.00 128.51 8ca2 s PRO 186 Ca 0.48 -0.09 -0.25 0.00 0.04 0.00 0.00 61.00 61.18 8ca2 s PRO 186 Cb -0.11 -1.88 -0.17 0.00 0.04 0.00 0.00 34.50 32.37 8ca2 s PRO 186 CO 0.20 -2.10 1.27 1.49 0.04 0.00 0.00 177.00 177.90 8ca2 h GLU 187 N -1.42 -0.23 -6.33 4.56 4.81 -1.91 -3.44 114.58 110.61 8ca2 h GLU 187 Ca -0.46 0.02 -0.56 0.00 -0.13 0.00 0.00 59.36 58.23 8ca2 h GLU 187 Cb 1.29 0.05 -0.04 0.00 0.63 0.00 0.00 28.75 30.68 8ca2 h GLU 187 CO 0.53 0.11 -0.06 0.45 -0.73 0.00 0.00 179.01 179.31 8ca2 s SER 188 N -5.29 6.88 -0.23 1.04 0.15 -1.26 -5.01 113.70 109.98 8ca2 s SER 188 Ca -0.14 1.14 0.14 0.00 0.70 0.00 0.00 55.95 57.78 8ca2 s SER 188 Cb 0.02 -2.31 0.65 0.00 -1.71 0.00 0.00 66.02 62.67 8ca2 s SER 188 CO 0.59 0.12 1.59 0.18 1.20 0.00 0.00 173.24 176.93 8ca2 n LEU 189 N 0.94 4.85 -4.73 3.45 4.77 -1.26 -4.73 117.00 120.29 8ca2 n LEU 189 Ca -0.06 -3.11 -0.42 0.00 -0.03 0.00 0.00 56.01 52.40 8ca2 n LEU 189 Cb 0.52 -0.63 -0.03 0.00 -2.33 0.00 0.00 43.42 40.94 8ca2 n LEU 189 CO 0.42 0.74 1.01 -1.81 -1.33 0.00 0.00 177.39 176.43 8ca2 s ASP 190 N -1.52 6.86 0.21 -1.43 1.01 -1.26 -4.71 116.67 115.83 8ca2 s ASP 190 Ca 0.48 2.39 -0.06 0.00 0.71 0.00 0.00 52.55 56.08 8ca2 s ASP 190 Cb 0.39 -2.60 -0.03 0.00 1.01 0.00 0.00 42.92 41.69 8ca2 s ASP 190 CO 0.11 -0.58 0.25 -0.72 0.21 0.00 0.00 175.17 174.44 8ca2 s TYR 191 N 0.41 0.80 0.05 4.23 -0.85 -1.26 -1.05 117.35 119.68 8ca2 s TYR 191 Ca 0.59 -1.09 0.08 0.00 -0.52 0.00 0.00 57.07 56.12 8ca2 s TYR 191 Cb -0.37 -0.26 -0.03 0.00 0.38 0.00 0.00 41.96 41.68 8ca2 s TYR 191 CO 0.36 -0.75 -0.19 -1.58 -1.52 0.00 0.00 175.55 171.87 8ca2 s TRP 192 N -4.09 2.52 -0.04 -3.49 0.51 0.66 -1.10 118.94 113.90 8ca2 s TRP 192 Ca 0.30 -0.28 -0.06 0.00 -2.12 0.00 0.00 56.10 53.94 8ca2 s TRP 192 Cb 0.04 -1.44 0.01 0.00 -0.81 0.00 0.00 33.47 31.28 8ca2 s TRP 192 CO 0.09 0.25 0.16 -0.08 -0.51 0.00 0.00 176.95 176.86 8ca2 s THR 193 N -0.93 0.02 -0.01 2.01 -1.32 -0.47 0.02 115.64 114.97 8ca2 s THR 193 Ca 0.14 -0.20 -0.29 0.00 -1.21 0.00 0.00 61.69 60.14 8ca2 s THR 193 Cb -0.10 -0.29 0.08 0.00 -1.51 0.00 0.00 72.50 70.67 8ca2 s THR 193 CO 0.05 -0.11 0.72 -0.72 -2.21 0.00 0.00 174.62 172.36 8ca2 s TYR 194 N -0.33 -0.56 -0.16 9.09 1.13 -0.98 -1.57 117.35 123.97 8ca2 s TYR 194 Ca -0.04 0.76 -0.29 0.00 -1.41 0.00 0.00 57.07 56.09 8ca2 s TYR 194 Cb -0.03 0.47 -0.00 0.00 -1.10 0.00 0.00 41.96 41.29 8ca2 s TYR 194 CO 0.01 -0.63 1.06 -2.14 -2.51 0.00 0.00 175.55 171.34 8ca2 s PRO 195 N -2.04 4.33 0.00 -3.49 0.02 -1.26 -1.30 135.00 131.27 8ca2 s PRO 195 Ca -0.05 1.43 0.00 0.00 0.02 0.00 0.00 61.00 62.40 8ca2 s PRO 195 Cb -0.00 -3.60 0.00 0.00 0.02 0.00 0.00 34.50 30.91 8ca2 s PRO 195 CO 0.01 -0.49 0.00 0.41 -0.33 0.00 0.00 177.00 176.60 8ca2 n GLY 196 N 3.26 5.07 1.67 0.52 0.00 0.21 -4.82 105.19 111.10 8ca2 n GLY 196 Ca 0.11 -1.07 -0.11 0.00 0.00 0.00 0.00 46.02 44.95 8ca2 n GLY 196 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 8ca2 n SER 197 N 0.00 0.04 -4.84 1.61 3.41 -1.09 -2.75 113.62 109.99 8ca2 n SER 197 Ca 0.00 -2.13 -0.32 0.00 -0.26 0.00 0.00 58.87 56.17 8ca2 n SER 197 Cb 0.00 0.77 -0.00 0.00 -0.26 0.00 0.00 64.21 64.72 8ca2 n SER 197 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 8ca2 s LEU 198 N 0.00 3.41 -0.10 1.04 1.43 -0.27 -4.63 118.68 119.57 8ca2 s LEU 198 Ca 0.18 1.57 0.15 0.00 -1.03 0.00 0.00 54.13 55.00 8ca2 s LEU 198 Cb 0.01 -4.50 0.54 0.00 0.03 0.00 0.00 46.19 42.27 8ca2 s LEU 198 CO 0.13 -0.90 1.45 0.35 0.23 0.00 0.00 176.35 177.61 8ca2 n THR 199 N -2.24 1.72 -3.98 5.49 -2.24 -1.26 -4.54 114.28 107.22 8ca2 n THR 199 Ca 0.07 -1.34 -0.09 0.00 -2.27 0.00 0.00 64.05 60.42 8ca2 n THR 199 Cb 0.54 0.13 -0.10 0.00 -2.10 0.00 0.00 70.33 68.79 8ca2 n THR 199 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 8ca2 s THR 200 N -1.88 0.14 0.26 4.28 -4.23 -1.26 -4.74 115.64 108.20 8ca2 s THR 200 Ca 0.40 -1.12 -0.31 0.00 -1.18 0.00 0.00 61.69 59.48 8ca2 s THR 200 Cb 0.27 -0.66 -0.13 0.00 1.34 0.00 0.00 72.50 73.31 8ca2 s THR 200 CO 0.17 -0.62 1.38 -2.65 -0.54 0.00 0.00 174.62 172.37 8ca2 n PRO 201 N 1.11 2.04 -0.41 3.99 -0.02 -1.26 0.30 135.00 140.75 8ca2 n PRO 201 Ca -0.21 0.72 -0.07 0.00 -2.02 0.00 0.00 63.50 61.93 8ca2 n PRO 201 Cb 0.57 -2.36 0.08 0.00 -0.02 0.00 0.00 33.50 31.76 8ca2 n PRO 201 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 8ca2 n PRO 202 N 1.77 1.59 -3.19 0.52 -0.04 -1.26 -5.00 135.00 129.40 8ca2 n PRO 202 Ca 0.10 -1.06 -0.23 0.00 -0.04 0.00 0.00 63.50 62.28 8ca2 n PRO 202 Cb 0.32 -1.47 -0.04 0.00 -0.04 0.00 0.00 33.50 32.27 8ca2 n PRO 202 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 8ca2 n LEU 203 N -0.03 -0.46 -4.77 1.53 4.77 0.15 -4.84 117.00 113.35 8ca2 n LEU 203 Ca 0.19 -0.68 -0.41 0.00 -0.03 0.00 0.00 56.01 55.08 8ca2 n LEU 203 Cb 0.86 -0.87 -0.01 0.00 -2.33 0.00 0.00 43.42 41.07 8ca2 n LEU 203 CO 0.20 0.07 1.09 -0.76 -1.33 0.00 0.00 177.39 176.66 8ca2 s LEU 204 N -4.48 4.36 -1.16 2.23 1.43 -1.26 -4.45 118.68 115.35 8ca2 s LEU 204 Ca 0.41 2.91 -0.03 0.00 -1.03 0.00 0.00 54.13 56.39 8ca2 s LEU 204 Cb -0.24 -3.66 0.24 0.00 0.03 0.00 0.00 46.19 42.56 8ca2 s LEU 204 CO 0.56 -0.75 2.05 -0.62 0.23 0.00 0.00 176.35 177.81 8ca2 n GLU 205 N 0.74 5.05 0.00 1.70 1.02 -1.26 -1.11 120.64 126.78 8ca2 n GLU 205 Ca 0.01 -4.15 0.02 0.00 -0.02 0.00 0.00 57.16 53.02 8ca2 n GLU 205 Cb 0.40 -2.55 0.00 0.00 -0.02 0.00 0.00 31.44 29.28 8ca2 n GLU 205 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 8ca2 s VAL 207 N -0.73 5.14 -0.45 0.00 1.01 -1.11 -1.57 120.40 122.69 8ca2 s VAL 207 Ca 0.04 0.08 -0.17 0.00 0.00 0.00 0.00 61.98 61.93 8ca2 s VAL 207 Cb 0.04 -3.29 0.04 0.00 0.00 0.00 0.00 36.38 33.16 8ca2 s VAL 207 CO 0.10 0.51 0.45 -0.89 0.00 0.00 0.00 175.10 175.27 8ca2 s THR 208 N -0.10 5.09 0.02 3.92 2.01 -0.96 0.65 115.64 126.27 8ca2 s THR 208 Ca 0.09 -0.59 -0.18 0.00 0.31 0.00 0.00 61.69 61.32 8ca2 s THR 208 Cb -0.12 -4.11 -0.06 0.00 0.01 0.00 0.00 72.50 68.23 8ca2 s THR 208 CO 0.01 -0.54 0.52 0.26 -0.69 0.00 0.00 174.62 174.18 8ca2 s TRP 209 N 2.08 3.73 -0.29 4.92 0.52 -0.42 -1.48 118.94 128.00 8ca2 s TRP 209 Ca 0.10 1.15 -0.01 0.00 0.02 0.00 0.00 56.10 57.35 8ca2 s TRP 209 Cb -0.19 -2.47 0.09 0.00 -1.15 0.00 0.00 33.47 29.75 8ca2 s TRP 209 CO 0.11 0.51 0.09 0.42 0.02 0.00 0.00 176.95 178.10 8ca2 s ILE 210 N -0.72 0.76 -0.25 2.03 1.01 -0.37 -2.32 121.20 121.35 8ca2 s ILE 210 Ca 0.28 -1.24 -0.08 0.00 0.00 0.00 0.00 60.65 59.60 8ca2 s ILE 210 Cb -0.18 -1.54 -0.03 0.00 0.01 0.00 0.00 42.46 40.72 8ca2 s ILE 210 CO 0.16 -0.62 0.09 -0.69 0.00 0.00 0.00 174.94 173.89 8ca2 s VAL 211 N 1.68 4.58 0.18 2.92 1.01 0.10 -0.03 120.40 130.85 8ca2 s VAL 211 Ca 0.08 -0.08 -0.30 0.00 0.00 0.00 0.00 61.98 61.68 8ca2 s VAL 211 Cb -0.17 -3.14 -0.08 0.00 0.00 0.00 0.00 36.38 32.99 8ca2 s VAL 211 CO -0.24 0.33 1.08 -0.76 0.00 0.00 0.00 175.10 175.51 8ca2 s LEU 212 N 1.50 4.50 0.08 3.92 2.01 -0.16 -0.25 118.68 130.29 8ca2 s LEU 212 Ca 0.06 2.07 -0.24 0.00 0.01 0.00 0.00 54.13 56.03 8ca2 s LEU 212 Cb -0.15 -3.60 -0.16 0.00 0.01 0.00 0.00 46.19 42.29 8ca2 s LEU 212 CO 0.05 -0.18 1.70 0.50 1.01 0.00 0.00 176.35 179.43 8ca2 h LYS 213 N 4.99 -0.12 -5.80 1.70 3.64 -1.43 -3.43 116.57 116.12 8ca2 h LYS 213 Ca -0.44 0.01 -0.58 0.00 -1.27 0.00 0.00 60.65 58.36 8ca2 h LYS 213 Cb 1.21 0.03 -0.08 0.00 -0.41 0.00 0.00 32.23 32.98 8ca2 h LYS 213 CO 0.72 -0.06 0.13 -2.00 -2.27 0.00 0.00 179.45 175.96 8ca2 s GLU 214 N -6.10 4.29 0.53 1.90 2.12 -1.26 -5.03 118.70 115.16 8ca2 s GLU 214 Ca -0.14 0.72 -0.09 0.00 0.36 0.00 0.00 54.97 55.83 8ca2 s GLU 214 Cb 0.05 -3.53 -0.04 0.00 0.26 0.00 0.00 34.13 30.87 8ca2 s GLU 214 CO 0.65 -0.14 0.90 -1.25 -0.54 0.00 0.00 175.26 174.88 8ca2 s PRO 215 N 1.54 3.62 0.13 4.30 0.04 -1.26 -4.70 135.00 138.67 8ca2 s PRO 215 Ca 0.32 0.51 0.05 0.00 0.04 0.00 0.00 61.00 61.91 8ca2 s PRO 215 Cb -0.16 -2.24 -0.04 0.00 0.04 0.00 0.00 34.50 32.10 8ca2 s PRO 215 CO 0.13 -0.33 0.10 0.96 0.04 0.00 0.00 177.00 177.89 8ca2 s ILE 216 N -2.86 4.39 0.01 0.56 -4.36 0.17 -4.91 121.20 114.19 8ca2 s ILE 216 Ca 0.52 -1.01 0.05 0.00 -0.26 0.00 0.00 60.65 59.94 8ca2 s ILE 216 Cb -0.11 -3.19 -0.03 0.00 1.25 0.00 0.00 42.46 40.38 8ca2 s ILE 216 CO 0.46 -0.02 -0.12 -0.94 0.24 0.00 0.00 174.94 174.56 8ca2 s SER 217 N -2.81 4.23 0.17 4.36 1.04 -1.26 -1.15 113.70 118.28 8ca2 s SER 217 Ca 0.30 -0.26 0.04 0.00 0.48 0.00 0.00 55.95 56.51 8ca2 s SER 217 Cb -0.11 -0.87 -0.05 0.00 0.10 0.00 0.00 66.02 65.09 8ca2 s SER 217 CO 0.22 0.28 -0.07 0.68 0.98 0.00 0.00 173.24 175.33 8ca2 s VAL 218 N -0.93 1.11 0.43 5.02 -7.23 -0.10 -4.03 120.40 114.67 8ca2 s VAL 218 Ca 0.15 -2.05 -0.07 0.00 -1.81 0.00 0.00 61.98 58.20 8ca2 s VAL 218 Cb -0.11 -1.99 -0.05 0.00 0.56 0.00 0.00 36.38 34.79 8ca2 s VAL 218 CO 0.06 -0.62 0.75 -0.94 -0.31 0.00 0.00 175.10 174.03 8ca2 s SER 219 N -3.20 6.38 0.27 4.85 1.04 -1.07 -0.83 113.70 121.14 8ca2 s SER 219 Ca 0.20 0.97 -0.02 0.00 0.48 0.00 0.00 55.95 57.58 8ca2 s SER 219 Cb 0.04 -2.26 0.41 0.00 0.10 0.00 0.00 66.02 64.31 8ca2 s SER 219 CO 0.03 -0.47 1.90 -1.28 0.98 0.00 0.00 173.24 174.40 8ca2 h SER 220 N 0.76 1.03 0.50 7.02 0.87 -1.92 -0.59 113.55 121.21 8ca2 h SER 220 Ca -0.47 0.00 -0.06 0.00 -1.23 0.00 0.00 61.79 60.03 8ca2 h SER 220 Cb 1.20 -0.22 -0.01 0.00 -0.44 0.00 0.00 62.40 62.93 8ca2 h SER 220 CO 0.63 0.68 -0.29 1.05 -0.53 0.00 0.00 176.83 178.37 8ca2 h GLU 221 N 1.18 0.00 0.21 2.24 9.09 -1.95 -0.31 114.58 125.04 8ca2 h GLU 221 Ca 0.41 0.00 -0.01 0.00 0.05 0.00 0.00 59.36 59.81 8ca2 h GLU 221 Cb 0.11 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.21 8ca2 h GLU 221 CO -0.15 0.29 -0.10 1.96 0.05 0.00 0.00 179.01 181.05 8ca2 h GLN 222 N 0.00 -0.28 0.00 1.06 4.20 -1.52 -3.24 115.11 115.33 8ca2 h GLN 222 Ca -0.00 0.02 -0.07 0.00 0.06 0.00 0.00 58.65 58.66 8ca2 h GLN 222 Cb 0.61 0.06 -0.01 0.00 0.30 0.00 0.00 27.48 28.45 8ca2 h GLN 222 CO 0.04 0.10 -0.31 -0.24 -0.67 0.00 0.00 178.83 177.75 8ca2 h VAL 223 N -0.79 0.92 -0.57 -0.54 3.04 -1.24 -2.97 116.25 114.11 8ca2 h VAL 223 Ca -0.03 -1.21 -0.01 0.00 -1.01 0.00 0.00 66.70 64.45 8ca2 h VAL 223 Cb 0.51 1.71 -0.03 0.00 -2.01 0.00 0.00 31.29 31.48 8ca2 h VAL 223 CO 0.05 0.31 0.33 -0.07 -1.01 0.00 0.00 177.57 177.18 8ca2 h LEU 224 N 0.00 0.68 -1.66 3.16 3.38 -1.13 -2.44 115.31 117.28 8ca2 h LEU 224 Ca -0.00 -0.04 -0.04 0.00 0.09 0.00 0.00 57.88 57.89 8ca2 h LEU 224 Cb 0.69 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.26 8ca2 h LEU 224 CO 0.04 0.53 -0.17 0.11 0.09 0.00 0.00 178.44 179.04 8ca2 h LYS 225 N 0.78 0.00 -0.22 1.13 1.57 -1.54 -2.85 116.57 115.44 8ca2 h LYS 225 Ca 0.20 0.00 -0.16 0.00 -1.87 0.00 0.00 60.65 58.82 8ca2 h LYS 225 Cb -0.01 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.30 8ca2 h LYS 225 CO -0.04 0.17 -0.49 0.74 -0.57 0.00 0.00 179.45 179.26 8ca2 h PHE 226 N 0.00 0.92 0.00 -1.35 -1.00 -1.55 -3.04 116.94 110.92 8ca2 h PHE 226 Ca -0.00 -0.34 0.00 0.00 2.81 0.00 0.00 57.97 60.43 8ca2 h PHE 226 Cb 0.46 -0.17 0.00 0.00 3.61 0.00 0.00 35.95 39.85 8ca2 h PHE 226 CO 0.00 1.14 0.00 0.54 -1.61 0.00 0.00 178.31 178.38 8ca2 n ARG 227 N -4.13 0.07 0.00 1.51 1.74 -1.08 -2.14 116.66 112.63 8ca2 n ARG 227 Ca -0.06 0.30 0.13 0.00 -0.77 0.00 0.00 57.85 57.45 8ca2 n ARG 227 Cb 0.59 -1.63 0.44 0.00 -1.02 0.00 0.00 32.46 30.84 8ca2 n ARG 227 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 8ca2 n LYS 228 N -1.77 0.18 -1.28 5.56 5.02 -1.15 -4.44 118.16 120.28 8ca2 n LYS 228 Ca 0.03 -0.07 -0.30 0.00 -2.02 0.00 0.00 58.31 55.95 8ca2 n LYS 228 Cb 0.21 -1.50 0.11 0.00 -0.02 0.00 0.00 35.03 33.83 8ca2 n LYS 228 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 8ca2 s LEU 229 N -2.87 2.66 -0.06 -0.35 1.02 -0.91 -4.90 118.68 113.27 8ca2 s LEU 229 Ca 0.16 1.61 0.06 0.00 0.02 0.00 0.00 54.13 55.98 8ca2 s LEU 229 Cb 0.19 -4.19 -0.01 0.00 0.02 0.00 0.00 46.19 42.19 8ca2 s LEU 229 CO 0.59 -2.26 -0.23 0.20 0.02 0.00 0.00 176.35 174.67 8ca2 s ASN 230 N -3.48 2.86 -0.05 2.29 0.02 -0.85 -0.28 114.94 115.46 8ca2 s ASN 230 Ca 0.62 -0.48 -0.22 0.00 -1.02 0.00 0.00 52.86 51.76 8ca2 s ASN 230 Cb -0.17 -0.81 -0.30 0.00 0.02 0.00 0.00 41.25 39.99 8ca2 s ASN 230 CO 0.56 0.22 0.91 -0.26 0.02 0.00 0.00 177.10 178.55 8ca2 h PHE 231 N 6.13 0.53 -3.64 2.20 0.04 -1.55 -3.34 116.94 117.30 8ca2 h PHE 231 Ca -0.31 -0.37 -0.47 0.00 2.80 0.00 0.00 57.97 59.61 8ca2 h PHE 231 Cb 1.18 -0.03 0.21 0.00 2.20 0.00 0.00 35.95 39.51 8ca2 h PHE 231 CO 0.43 1.28 0.06 0.27 -0.60 0.00 0.00 178.31 179.75 8ca2 n ASN 232 N -4.16 -0.89 -4.97 2.17 6.94 -1.26 -4.37 115.26 108.73 8ca2 n ASN 232 Ca -0.13 0.09 -0.21 0.00 -0.02 0.00 0.00 54.58 54.30 8ca2 n ASN 232 Cb 0.79 -1.35 0.01 0.00 -2.36 0.00 0.00 39.78 36.88 8ca2 n ASN 232 CO 0.00 0.00 0.00 -0.83 -1.03 0.00 0.00 177.26 175.40 8ca2 s GLY 233 N -2.49 1.66 0.12 4.83 0.00 -1.26 -1.26 107.32 108.93 8ca2 s GLY 233 Ca 0.68 -1.26 -0.31 0.00 0.00 0.00 0.00 44.72 43.82 8ca2 s GLY 233 CO 0.62 -1.09 1.72 1.85 0.00 0.00 0.00 173.10 176.20 8ca2 s GLU 234 N -4.49 4.17 0.00 2.90 2.12 -1.26 -2.74 118.70 119.40 8ca2 s GLU 234 Ca 0.50 2.47 0.00 0.00 0.36 0.00 0.00 54.97 58.30 8ca2 s GLU 234 Cb -0.10 -3.46 0.00 0.00 0.26 0.00 0.00 34.13 30.83 8ca2 s GLU 234 CO 0.36 -0.76 0.00 0.41 -0.54 0.00 0.00 175.26 174.73 8ca2 n GLY 235 N 4.05 0.67 3.54 -1.50 0.00 -1.26 -5.07 105.19 105.62 8ca2 n GLY 235 Ca 0.16 -0.65 -0.25 0.00 0.00 0.00 0.00 46.02 45.28 8ca2 n GLY 235 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 8ca2 s GLU 236 N -1.43 1.79 0.23 1.61 2.02 -1.11 -5.08 118.70 116.74 8ca2 s GLU 236 Ca 0.00 -1.96 -0.31 0.00 0.02 0.00 0.00 54.97 52.72 8ca2 s GLU 236 Cb 0.00 -1.49 -0.14 0.00 0.10 0.00 0.00 34.13 32.59 8ca2 s GLU 236 CO 0.00 0.03 1.20 -2.30 0.02 0.00 0.00 175.26 174.21 8ca2 n PRO 237 N -0.80 1.54 -2.63 0.39 -0.02 -1.26 -4.85 135.00 127.36 8ca2 n PRO 237 Ca -0.05 0.54 -0.43 0.00 -2.02 0.00 0.00 63.50 61.55 8ca2 n PRO 237 Cb 0.65 -2.06 -0.02 0.00 -0.02 0.00 0.00 33.50 32.05 8ca2 n PRO 237 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 8ca2 s GLU 238 N -0.79 4.14 -0.27 -0.52 2.12 -1.26 -4.76 118.70 117.36 8ca2 s GLU 238 Ca 0.67 1.22 0.03 0.00 0.36 0.00 0.00 54.97 57.24 8ca2 s GLU 238 Cb -0.73 -3.71 0.07 0.00 0.26 0.00 0.00 34.13 30.02 8ca2 s GLU 238 CO 0.54 -0.80 -0.07 -2.00 -0.54 0.00 0.00 175.26 172.40 8ca2 s GLU 239 N 3.49 1.98 0.22 4.30 2.12 -1.26 -5.06 118.70 124.50 8ca2 s GLU 239 Ca 0.46 -1.41 -0.31 0.00 0.36 0.00 0.00 54.97 54.07 8ca2 s GLU 239 Cb -0.14 -2.90 -0.11 0.00 0.26 0.00 0.00 34.13 31.24 8ca2 s GLU 239 CO 0.12 -0.66 1.59 -0.51 -0.54 0.00 0.00 175.26 175.26 8ca2 s LEU 240 N 1.11 4.37 -0.99 2.70 1.43 -1.26 -1.56 118.68 124.47 8ca2 s LEU 240 Ca -0.04 2.77 -0.23 0.00 -1.03 0.00 0.00 54.13 55.60 8ca2 s LEU 240 Cb -0.20 -3.61 0.06 0.00 0.03 0.00 0.00 46.19 42.47 8ca2 s LEU 240 CO -0.06 -0.86 1.40 -0.32 0.23 0.00 0.00 176.35 176.74 8ca2 s MET 241 N 0.43 3.57 0.03 1.70 -2.45 0.62 -4.75 119.30 118.45 8ca2 s MET 241 Ca 0.67 -1.15 -0.01 0.00 -1.25 0.00 0.00 55.69 53.95 8ca2 s MET 241 Cb -0.46 -5.24 -0.03 0.00 1.25 0.00 0.00 34.83 30.35 8ca2 s MET 241 CO 0.38 -2.15 -0.02 0.14 1.05 0.00 0.00 175.02 174.42 8ca2 s VAL 242 N 4.73 0.16 -1.25 10.11 -7.23 -1.26 -4.38 120.40 121.28 8ca2 s VAL 242 Ca 0.44 -1.29 -0.09 0.00 -1.81 0.00 0.00 61.98 59.23 8ca2 s VAL 242 Cb -0.01 -0.83 -0.01 0.00 0.56 0.00 0.00 36.38 36.09 8ca2 s VAL 242 CO -0.09 -0.71 0.68 0.47 -0.31 0.00 0.00 175.10 175.14 8ca2 n ASP 243 N 0.91 -2.97 -2.39 4.85 8.00 -0.41 -4.87 116.55 119.68 8ca2 n ASP 243 Ca -0.19 -0.95 -0.35 0.00 0.71 0.00 0.00 54.79 54.01 8ca2 n ASP 243 Cb 0.58 -3.57 0.07 0.00 -0.02 0.00 0.00 41.12 38.18 8ca2 n ASP 243 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 8ca2 n ASN 244 N -2.89 7.66 -4.49 -2.24 6.94 -1.06 -4.89 115.26 114.29 8ca2 n ASN 244 Ca -0.20 -3.78 -0.24 0.00 -0.02 0.00 0.00 54.58 50.34 8ca2 n ASN 244 Cb 0.64 -0.99 -0.10 0.00 -2.36 0.00 0.00 39.78 36.97 8ca2 n ASN 244 CO 0.00 0.00 0.00 -1.66 -1.03 0.00 0.00 177.26 174.57 8ca2 s TRP 245 N -3.80 2.36 -0.09 -2.53 1.48 -1.26 -4.74 118.94 110.35 8ca2 s TRP 245 Ca 0.63 -0.31 0.01 0.00 -1.06 0.00 0.00 56.10 55.36 8ca2 s TRP 245 Cb 0.49 -1.05 -0.02 0.00 -1.16 0.00 0.00 33.47 31.74 8ca2 s TRP 245 CO -0.06 0.67 -0.11 0.50 -4.06 0.00 0.00 176.95 173.89 8ca2 s ARG 246 N -3.41 2.99 0.67 3.25 3.52 -1.26 -4.96 118.95 119.74 8ca2 s ARG 246 Ca 0.29 -0.64 -0.16 0.00 -0.13 0.00 0.00 55.73 55.08 8ca2 s ARG 246 Cb -0.06 -2.56 0.01 0.00 -1.56 0.00 0.00 34.95 30.78 8ca2 s ARG 246 CO 0.15 0.45 1.21 -2.14 -0.81 0.00 0.00 175.30 174.16 8ca2 s PRO 247 N -0.25 2.49 0.47 5.12 0.02 -1.26 -4.67 135.00 136.91 8ca2 s PRO 247 Ca 0.02 1.79 -0.24 0.00 0.02 0.00 0.00 61.00 62.59 8ca2 s PRO 247 Cb -0.13 -1.87 -0.07 0.00 0.02 0.00 0.00 34.50 32.45 8ca2 s PRO 247 CO 0.03 -1.58 1.35 0.00 -0.33 0.00 0.00 177.00 176.48 8ca2 s ALA 248 N -1.82 3.11 0.38 -1.55 0.00 -1.26 -4.47 121.76 116.15 8ca2 s ALA 248 Ca 0.76 1.32 0.08 0.00 0.00 0.00 0.00 51.96 54.12 8ca2 s ALA 248 Cb -0.30 -3.54 -0.04 0.00 0.00 0.00 0.00 23.12 19.24 8ca2 s ALA 248 CO 0.41 -1.10 0.21 -0.65 0.00 0.00 0.00 175.76 174.63 8ca2 s GLN 249 N -2.54 2.36 0.20 0.00 -1.52 0.09 -4.96 119.66 113.28 8ca2 s GLN 249 Ca 0.63 -1.66 -0.31 0.00 -1.95 0.00 0.00 55.36 52.08 8ca2 s GLN 249 Cb -0.40 -2.15 -0.10 0.00 -0.22 0.00 0.00 33.01 30.14 8ca2 s GLN 249 CO 0.50 -0.04 1.51 -2.14 -0.25 0.00 0.00 175.29 174.86 8ca2 s PRO 250 N -3.93 4.24 0.10 2.91 0.02 -1.26 -4.53 135.00 132.55 8ca2 s PRO 250 Ca 0.41 2.33 -0.14 0.00 0.02 0.00 0.00 61.00 63.63 8ca2 s PRO 250 Cb -0.00 -3.13 -0.11 0.00 0.02 0.00 0.00 34.50 31.28 8ca2 s PRO 250 CO 0.24 -0.52 1.37 1.25 -0.33 0.00 0.00 177.00 179.01 8ca2 h LEU 251 N 5.96 0.86 -3.00 -5.54 5.85 -1.94 -3.43 115.31 114.08 8ca2 h LEU 251 Ca -0.44 -0.54 -0.35 0.00 0.84 0.00 0.00 57.88 57.38 8ca2 h LEU 251 Cb 1.21 -0.25 0.10 0.00 0.37 0.00 0.00 40.66 42.09 8ca2 h LEU 251 CO 0.85 1.24 -0.85 0.29 -0.34 0.00 0.00 178.44 179.63 8ca2 n LYS 252 N -4.11 -1.47 0.00 1.25 5.02 -1.26 -3.24 118.16 114.35 8ca2 n LYS 252 Ca -0.05 0.66 0.00 0.00 -2.02 0.00 0.00 58.31 56.90 8ca2 n LYS 252 Cb 0.59 -4.55 0.00 0.00 -0.02 0.00 0.00 35.03 31.05 8ca2 n LYS 252 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 8ca2 n ASN 253 N -2.71 0.00 -4.27 4.39 2.04 -1.26 -5.01 115.26 108.45 8ca2 n ASN 253 Ca -0.09 0.00 -0.39 0.00 -0.44 0.00 0.00 54.58 53.66 8ca2 n ASN 253 Cb 0.59 0.00 0.01 0.00 -2.53 0.00 0.00 39.78 37.86 8ca2 n ASN 253 CO 0.00 0.00 0.00 0.54 -0.44 0.00 0.00 177.26 177.36 8ca2 n ARG 254 N 0.00 0.05 -5.21 -3.83 1.74 -1.20 -5.00 116.66 103.22 8ca2 n ARG 254 Ca 0.00 0.02 -0.30 0.00 -0.77 0.00 0.00 57.85 56.80 8ca2 n ARG 254 Cb 0.00 -1.08 -0.16 0.00 -1.02 0.00 0.00 32.46 30.20 8ca2 n ARG 254 CO 0.00 0.00 0.00 -1.14 -1.52 0.00 0.00 177.63 174.97 8ca2 s GLN 255 N -1.15 2.13 -0.26 5.56 0.74 -1.26 -5.00 119.66 120.43 8ca2 s GLN 255 Ca 0.58 -0.86 -0.08 0.00 0.05 0.00 0.00 55.36 55.04 8ca2 s GLN 255 Cb -0.49 -1.96 -0.03 0.00 1.10 0.00 0.00 33.01 31.63 8ca2 s GLN 255 CO 0.65 0.47 0.10 0.42 -0.55 0.00 0.00 175.29 176.37 8ca2 s ILE 256 N -0.42 4.52 0.01 -2.34 1.01 -1.26 -4.67 121.20 118.05 8ca2 s ILE 256 Ca 0.05 -0.11 -0.02 0.00 0.00 0.00 0.00 60.65 60.57 8ca2 s ILE 256 Cb -0.11 -3.13 -0.04 0.00 0.01 0.00 0.00 42.46 39.19 8ca2 s ILE 256 CO 0.01 0.31 0.17 -0.54 0.00 0.00 0.00 174.94 174.88 8ca2 s LYS 257 N 1.64 3.35 -0.10 2.79 1.02 -0.61 -0.41 119.74 127.43 8ca2 s LYS 257 Ca 0.06 -0.39 -0.01 0.00 0.02 0.00 0.00 55.97 55.66 8ca2 s LYS 257 Cb -0.15 -3.03 -0.03 0.00 -0.52 0.00 0.00 37.83 34.10 8ca2 s LYS 257 CO 0.05 0.65 -0.07 0.00 -0.92 0.00 0.00 175.35 175.07 8ca2 s ALA 258 N -1.34 2.94 -1.51 5.17 0.00 0.22 -1.37 121.76 125.87 8ca2 s ALA 258 Ca 0.28 -0.87 0.28 0.00 0.00 0.00 0.00 51.96 51.65 8ca2 s ALA 258 Cb -0.13 -1.32 0.99 0.00 0.00 0.00 0.00 23.12 22.66 8ca2 s ALA 258 CO 0.20 0.42 1.72 -1.13 0.00 0.00 0.00 175.76 176.97 8ca2 n SER 259 N 2.79 0.57 0.00 0.00 3.41 -0.26 -1.12 113.62 119.00 8ca2 n SER 259 Ca -0.18 -0.50 0.00 0.00 -0.26 0.00 0.00 58.87 57.93 8ca2 n SER 259 Cb 0.53 -0.01 0.00 0.00 -0.26 0.00 0.00 64.21 64.47 8ca2 n SER 259 CO 0.00 0.00 0.00 2.22 -0.16 0.00 0.00 175.04 177.10