#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dcr h SER 2 N 0.00 -0.29 -4.27 1.61 0.87 -2.13 -3.44 113.55 105.90 2dcr h SER 2 Ca 0.00 -0.22 -0.52 0.00 -1.23 0.00 0.00 61.79 59.82 2dcr h SER 2 Cb 0.00 0.08 0.14 0.00 -0.44 0.00 0.00 62.40 62.17 2dcr h SER 2 CO 0.00 0.11 0.32 -0.94 -0.53 0.00 0.00 176.83 175.79 2dcr s SER 3 N -5.19 4.35 0.00 6.23 1.04 -1.26 -4.95 113.70 113.92 2dcr s SER 3 Ca -0.14 1.97 0.00 0.00 0.48 0.00 0.00 55.95 58.26 2dcr s SER 3 Cb 0.02 -2.54 0.00 0.00 0.10 0.00 0.00 66.02 63.60 2dcr s SER 3 CO 0.54 -2.14 0.00 0.61 0.98 0.00 0.00 173.24 173.23 2dcr n GLY 4 N -0.68 -1.98 1.57 7.32 0.00 -1.26 -5.15 105.19 105.00 2dcr n GLY 4 Ca 0.10 0.60 -0.14 0.00 0.00 0.00 0.00 46.02 46.59 2dcr n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2dcr n SER 5 N -0.89 -2.10 0.00 1.61 3.41 -1.26 -5.05 113.62 109.35 2dcr n SER 5 Ca 0.00 -0.65 0.00 0.00 -0.26 0.00 0.00 58.87 57.96 2dcr n SER 5 Cb 0.00 -0.47 0.00 0.00 -0.26 0.00 0.00 64.21 63.48 2dcr n SER 5 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2dcr n SER 6 N -4.04 0.00 -3.98 4.04 7.64 -1.26 -5.12 113.62 110.90 2dcr n SER 6 Ca 0.07 -1.00 -0.09 0.00 1.01 0.00 0.00 58.87 58.86 2dcr n SER 6 Cb 0.28 0.00 -0.08 0.00 -1.01 0.00 0.00 64.21 63.40 2dcr n SER 6 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2dcr s GLY 7 N 0.00 0.48 0.00 0.23 0.00 -1.26 -5.08 107.32 101.69 2dcr s GLY 7 Ca 0.00 -0.95 0.03 0.00 0.00 0.00 0.00 44.72 43.80 2dcr s GLY 7 CO 0.00 -0.95 0.91 1.18 0.00 0.00 0.00 173.10 174.24 2dcr n GLU 8 N -0.14 0.00 0.35 2.90 4.71 -1.26 -4.96 120.64 122.24 2dcr n GLU 8 Ca -0.09 -0.89 -0.16 0.00 -0.01 0.00 0.00 57.16 56.01 2dcr n GLU 8 Cb 0.63 -0.30 -0.08 0.00 -1.01 0.00 0.00 31.44 30.68 2dcr n GLU 8 CO 0.00 0.00 0.00 0.28 0.09 0.00 0.00 177.13 177.50 2dcr h VAL 9 N 6.49 0.20 0.00 2.62 2.07 -1.97 -3.19 116.25 122.48 2dcr h VAL 9 Ca -0.05 -0.26 0.00 0.00 0.82 0.00 0.00 66.70 67.21 2dcr h VAL 9 Cb 1.37 0.26 0.00 0.00 -1.52 0.00 0.00 31.29 31.40 2dcr h VAL 9 CO 0.00 0.02 0.00 0.00 0.02 0.00 0.00 177.57 177.61 2dcr n GLN 10 N -5.40 0.20 -1.16 1.57 1.13 -1.26 -3.74 117.38 108.71 2dcr n GLN 10 Ca -0.12 0.23 -0.32 0.00 -1.94 0.00 0.00 57.00 54.85 2dcr n GLN 10 Cb 0.37 -1.77 0.11 0.00 0.11 0.00 0.00 30.24 29.07 2dcr n GLN 10 CO 0.00 0.00 0.00 0.15 -1.44 0.00 0.00 177.06 175.77 2dcr s LYS 11 N -3.13 1.84 0.74 -1.09 1.02 -1.21 -4.98 119.74 112.93 2dcr s LYS 11 Ca 0.10 1.49 -0.14 0.00 0.02 0.00 0.00 55.97 57.43 2dcr s LYS 11 Cb 0.12 -1.83 0.04 0.00 -0.52 0.00 0.00 37.83 35.65 2dcr s LYS 11 CO 0.53 -2.01 1.18 -1.25 -0.92 0.00 0.00 175.35 172.88 2dcr s PRO 12 N -4.46 2.15 0.41 -1.68 0.04 -1.26 -4.91 135.00 125.29 2dcr s PRO 12 Ca 0.67 1.63 0.09 0.00 0.04 0.00 0.00 61.00 63.44 2dcr s PRO 12 Cb -0.23 -1.85 0.90 0.00 0.04 0.00 0.00 34.50 33.37 2dcr s PRO 12 CO 0.52 -1.80 2.01 1.25 0.04 0.00 0.00 177.00 179.02 2dcr h LEU 13 N -0.45 0.47 0.00 -3.56 6.46 -1.95 -2.82 115.31 113.45 2dcr h LEU 13 Ca -0.47 -0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.29 2dcr h LEU 13 Cb 1.28 -0.10 0.00 0.00 -0.73 0.00 0.00 40.66 41.11 2dcr h LEU 13 CO 0.50 0.31 0.00 0.00 -0.62 0.00 0.00 178.44 178.63 2dcr n HIS 14 N -4.47 0.00 0.11 1.25 1.44 -1.26 -2.71 115.22 109.57 2dcr n HIS 14 Ca 0.07 0.00 0.01 0.00 -2.01 0.00 0.00 57.72 55.79 2dcr n HIS 14 Cb 0.21 -0.16 0.01 0.00 0.12 0.00 0.00 29.99 30.17 2dcr n HIS 14 CO 0.00 0.00 0.00 -1.91 -2.81 0.00 0.00 176.34 171.62 2dcr n GLU 15 N -1.16 0.15 -1.22 -1.40 2.13 -1.07 -4.70 120.64 113.38 2dcr n GLU 15 Ca 0.13 -0.57 -0.29 0.00 0.66 0.00 0.00 57.16 57.08 2dcr n GLU 15 Cb 0.13 -1.00 0.16 0.00 0.27 0.00 0.00 31.44 31.00 2dcr n GLU 15 CO 0.00 0.00 0.00 -0.65 -0.41 0.00 0.00 177.13 176.07 2dcr s GLN 16 N -0.33 0.83 -0.13 5.31 -1.52 -1.10 -4.52 119.66 118.20 2dcr s GLN 16 Ca 0.03 0.61 -0.11 0.00 -1.95 0.00 0.00 55.36 53.94 2dcr s GLN 16 Cb 0.02 -1.78 -0.04 0.00 -0.22 0.00 0.00 33.01 31.00 2dcr s GLN 16 CO 0.04 -2.48 -0.22 1.47 -0.25 0.00 0.00 175.29 173.85 2dcr n LEU 17 N -4.02 1.49 0.17 2.90 -0.00 -1.26 -4.26 117.00 112.01 2dcr n LEU 17 Ca 0.06 0.39 0.11 0.00 -0.00 0.00 0.00 56.01 56.56 2dcr n LEU 17 Cb 0.57 -0.73 0.58 0.00 -0.00 0.00 0.00 43.42 43.84 2dcr n LEU 17 CO 0.57 -0.39 0.83 -2.67 -0.00 0.00 0.00 177.39 175.73 2dcr n TRP 18 N -4.08 0.73 -2.55 1.47 4.27 -1.10 -0.47 117.44 115.71 2dcr n TRP 18 Ca -0.09 0.38 -0.42 0.00 -3.89 0.00 0.00 57.50 53.49 2dcr n TRP 18 Cb 0.32 -1.09 -0.03 0.00 -1.36 0.00 0.00 31.31 29.15 2dcr n TRP 18 CO 0.00 0.00 0.00 -0.47 -2.29 0.00 0.00 177.69 174.93 2dcr s TYR 19 N -3.54 2.43 -0.11 -2.67 5.04 -1.26 -0.33 117.35 116.90 2dcr s TYR 19 Ca -0.02 0.21 0.16 0.00 -2.44 0.00 0.00 57.07 54.97 2dcr s TYR 19 Cb 0.06 -4.56 -0.15 0.00 0.35 0.00 0.00 41.96 37.66 2dcr s TYR 19 CO 0.19 -1.85 0.79 0.72 -1.34 0.00 0.00 175.55 174.07 2dcr n HIS 20 N 8.99 0.98 -0.70 4.97 8.25 -0.61 -4.66 115.22 132.44 2dcr n HIS 20 Ca 0.06 0.33 0.00 0.00 -0.26 0.00 0.00 57.72 57.85 2dcr n HIS 20 Cb 0.49 -1.10 0.00 0.00 1.12 0.00 0.00 29.99 30.50 2dcr n HIS 20 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2dcr n GLY 21 N 1.43 0.52 3.56 -1.41 0.00 -1.24 -4.33 105.19 103.72 2dcr n GLY 21 Ca -0.11 -1.59 -0.35 0.00 0.00 0.00 0.00 46.02 43.97 2dcr n GLY 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dcr s ALA 22 N -1.93 2.12 0.08 4.61 0.00 -1.26 -0.60 121.76 124.79 2dcr s ALA 22 Ca 0.00 -1.30 0.05 0.00 0.00 0.00 0.00 51.96 50.71 2dcr s ALA 22 Cb 0.00 -4.43 -0.03 0.00 0.00 0.00 0.00 23.12 18.66 2dcr s ALA 22 CO 0.00 -4.13 -0.13 -1.50 0.00 0.00 0.00 175.76 169.99 2dcr s ILE 23 N 8.46 1.08 0.00 0.00 2.07 -1.26 -4.94 121.20 126.61 2dcr s ILE 23 Ca 0.61 -1.37 0.00 0.00 -1.41 0.00 0.00 60.65 58.48 2dcr s ILE 23 Cb -0.08 -1.12 0.00 0.00 0.13 0.00 0.00 42.46 41.39 2dcr s ILE 23 CO 0.07 -0.30 0.00 -0.81 -1.91 0.00 0.00 174.94 172.00 2dcr n PRO 24 N 1.12 0.70 -0.00 3.50 -0.04 -1.26 -4.61 135.00 134.41 2dcr n PRO 24 Ca -0.20 0.00 0.09 0.00 -0.04 0.00 0.00 63.50 63.35 2dcr n PRO 24 Cb 0.55 0.00 -0.11 0.00 -0.04 0.00 0.00 33.50 33.89 2dcr n PRO 24 CO 0.00 0.00 0.00 2.89 -0.04 0.00 0.00 175.50 178.35 2dcr n ARG 25 N -0.21 0.78 0.14 0.54 1.85 -1.26 -4.64 116.66 113.86 2dcr n ARG 25 Ca 0.00 -0.03 0.12 0.00 -1.00 0.00 0.00 57.85 56.94 2dcr n ARG 25 Cb 0.00 -1.40 0.12 0.00 -1.05 0.00 0.00 32.46 30.13 2dcr n ARG 25 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2dcr h ALA 26 N 2.50 0.73 0.00 2.89 0.00 -2.03 -3.31 119.26 120.03 2dcr h ALA 26 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.79 2dcr h ALA 26 Cb 0.52 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 2dcr h ALA 26 CO 0.00 0.00 -1.14 0.93 0.00 0.00 0.00 179.25 179.04 2dcr h GLU 27 N 0.00 0.00 -0.59 0.00 4.39 -1.97 -3.40 114.58 113.00 2dcr h GLU 27 Ca 0.00 0.00 0.07 0.00 0.34 0.00 0.00 59.36 59.77 2dcr h GLU 27 Cb 0.94 0.00 -0.10 0.00 -0.10 0.00 0.00 28.75 29.50 2dcr h GLU 27 CO 0.00 0.26 -0.54 0.28 -1.16 0.00 0.00 179.01 177.85 2dcr h VAL 28 N 0.00 0.02 0.00 3.13 2.07 -1.83 -2.29 116.25 117.35 2dcr h VAL 28 Ca -0.10 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.42 2dcr h VAL 28 Cb 1.42 0.02 0.00 0.00 -1.52 0.00 0.00 31.29 31.20 2dcr h VAL 28 CO 0.04 0.00 0.00 0.00 0.02 0.00 0.00 177.57 177.63 2dcr n ALA 29 N -3.14 1.33 0.09 1.67 0.00 -1.26 -0.59 120.51 118.60 2dcr n ALA 29 Ca -0.01 0.15 -0.20 0.00 0.00 0.00 0.00 53.44 53.38 2dcr n ALA 29 Cb 0.33 -1.36 -0.11 0.00 0.00 0.00 0.00 19.45 18.30 2dcr n ALA 29 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 2dcr h GLU 30 N 0.00 0.56 -0.24 0.00 4.81 -1.71 -3.37 114.58 114.63 2dcr h GLU 30 Ca 0.00 -0.72 -0.20 0.00 -0.13 0.00 0.00 59.36 58.31 2dcr h GLU 30 Cb 0.17 0.23 0.00 0.00 0.63 0.00 0.00 28.75 29.79 2dcr h GLU 30 CO 0.00 1.31 -0.63 -0.07 -0.73 0.00 0.00 179.01 178.89 2dcr h LEU 31 N 0.26 0.97-10.28 1.64 3.38 -0.85 -3.43 115.31 107.01 2dcr h LEU 31 Ca -0.16 -0.56 -0.49 0.00 0.09 0.00 0.00 57.88 56.75 2dcr h LEU 31 Cb 1.85 -0.28 0.04 0.00 0.09 0.00 0.00 40.66 42.36 2dcr h LEU 31 CO 0.22 1.37 0.40 -0.76 0.09 0.00 0.00 178.44 179.75 2dcr s LEU 32 N -8.60 3.41 0.05 1.67 1.43 -0.80 -4.87 118.68 110.97 2dcr s LEU 32 Ca -0.11 1.48 0.00 0.00 -1.03 0.00 0.00 54.13 54.48 2dcr s LEU 32 Cb 0.10 -4.48 0.00 0.00 0.03 0.00 0.00 46.19 41.84 2dcr s LEU 32 CO 0.90 -0.74 0.00 0.52 0.23 0.00 0.00 176.35 177.26 2dcr n VAL 33 N -2.22 0.00 -4.56 -1.59 0.31 -1.26 -4.84 118.33 104.17 2dcr n VAL 33 Ca 0.06 0.00 -0.26 0.00 -0.01 0.00 0.00 64.34 64.13 2dcr n VAL 33 Cb 0.54 -0.41 -0.11 0.00 -0.91 0.00 0.00 33.84 32.96 2dcr n VAL 33 CO 0.00 0.00 0.00 -1.00 -1.32 0.00 0.00 176.83 174.51 2dcr s HIS 34 N -2.00 2.38 0.41 3.52 3.76 -1.26 -5.09 115.29 117.01 2dcr s HIS 34 Ca 0.00 -0.62 -0.26 0.00 -0.15 0.00 0.00 55.06 54.03 2dcr s HIS 34 Cb 0.00 -1.52 -0.10 0.00 1.11 0.00 0.00 32.58 32.08 2dcr s HIS 34 CO 0.00 0.46 1.37 0.43 -0.85 0.00 0.00 174.74 176.15 2dcr n SER 35 N -0.84 3.10 0.00 1.40 7.64 -1.26 -2.99 113.62 120.67 2dcr n SER 35 Ca -0.05 1.15 0.00 0.00 1.01 0.00 0.00 58.87 60.98 2dcr n SER 35 Cb 0.65 -1.56 0.00 0.00 -1.01 0.00 0.00 64.21 62.29 2dcr n SER 35 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dcr n GLY 36 N 0.65 3.39 3.70 0.23 0.00 -0.22 -4.80 105.19 108.14 2dcr n GLY 36 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 2dcr n GLY 36 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2dcr s ASP 37 N -0.73 6.44 0.12 1.61 1.01 -1.16 -1.29 116.67 122.67 2dcr s ASP 37 Ca 0.00 2.76 0.01 0.00 0.71 0.00 0.00 52.55 56.03 2dcr s ASP 37 Cb 0.00 -2.58 -0.04 0.00 1.01 0.00 0.00 42.92 41.31 2dcr s ASP 37 CO 0.00 -0.96 -0.02 0.72 0.21 0.00 0.00 175.17 175.12 2dcr s PHE 38 N 1.97 0.93 0.11 4.23 -0.71 -0.64 -1.55 117.98 122.32 2dcr s PHE 38 Ca 0.77 -1.02 0.01 0.00 -1.04 0.00 0.00 56.93 55.65 2dcr s PHE 38 Cb -0.47 -0.54 -0.04 0.00 -1.21 0.00 0.00 43.02 40.76 2dcr s PHE 38 CO 0.34 -0.26 -0.04 -0.48 -1.34 0.00 0.00 175.22 173.44 2dcr s LEU 39 N -3.07 2.36 -0.16 -1.99 0.05 -0.48 -1.87 118.68 113.53 2dcr s LEU 39 Ca 0.17 -1.06 -0.03 0.00 0.05 0.00 0.00 54.13 53.25 2dcr s LEU 39 Cb 0.06 -0.02 -0.02 0.00 -2.05 0.00 0.00 46.19 44.16 2dcr s LEU 39 CO -0.02 -0.52 -0.05 -0.69 -0.55 0.00 0.00 176.35 174.52 2dcr s VAL 40 N -3.69 3.69 0.27 1.48 1.01 0.55 -1.41 120.40 122.31 2dcr s VAL 40 Ca 0.15 -0.42 0.04 0.00 0.00 0.00 0.00 61.98 61.75 2dcr s VAL 40 Cb 0.06 -2.62 -0.06 0.00 0.00 0.00 0.00 36.38 33.76 2dcr s VAL 40 CO -0.03 0.48 0.02 0.00 0.00 0.00 0.00 175.10 175.57 2dcr s ARG 41 N 0.56 1.48 0.57 2.72 1.70 0.17 -1.57 118.95 124.58 2dcr s ARG 41 Ca -0.04 -1.78 -0.08 0.00 -0.47 0.00 0.00 55.73 53.37 2dcr s ARG 41 Cb -0.15 -0.74 -0.02 0.00 -0.57 0.00 0.00 34.95 33.47 2dcr s ARG 41 CO 0.03 -0.13 0.92 -2.00 -1.08 0.00 0.00 175.30 173.04 2dcr s GLU 42 N -3.87 3.34 0.00 3.89 -6.30 0.23 0.04 118.70 116.04 2dcr s GLU 42 Ca 0.32 0.34 0.00 0.00 -2.50 0.00 0.00 54.97 53.13 2dcr s GLU 42 Cb 0.07 -2.23 0.00 0.00 0.00 0.00 0.00 34.13 31.97 2dcr s GLU 42 CO 0.12 -0.51 0.00 0.45 0.02 0.00 0.00 175.26 175.34 2dcr n SER 43 N -2.55 0.00 -4.30 -1.70 2.88 0.68 -4.35 113.62 104.28 2dcr n SER 43 Ca 0.04 0.00 -0.45 0.00 -1.33 0.00 0.00 58.87 57.13 2dcr n SER 43 Cb 0.56 0.00 -0.00 0.00 -0.75 0.00 0.00 64.21 64.02 2dcr n SER 43 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2dcr n GLN 44 N 0.00 3.62 -3.58 -1.46 6.02 -1.26 -4.66 117.38 116.07 2dcr n GLN 44 Ca 0.00 -4.47 -0.23 0.00 -0.01 0.00 0.00 57.00 52.29 2dcr n GLN 44 Cb 0.00 -2.54 0.08 0.00 1.02 0.00 0.00 30.24 28.80 2dcr n GLN 44 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2dcr n GLY 45 N 2.53 -0.52 0.60 1.08 0.00 -1.26 -4.90 105.19 102.72 2dcr n GLY 45 Ca 0.24 0.24 0.08 0.00 0.00 0.00 0.00 46.02 46.58 2dcr n GLY 45 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2dcr n LYS 46 N -4.90 1.29 -1.79 1.61 4.76 -1.26 -4.97 118.16 112.89 2dcr n LYS 46 Ca -0.03 -1.36 -0.13 0.00 -2.87 0.00 0.00 58.31 53.92 2dcr n LYS 46 Cb 0.57 -1.30 -0.04 0.00 -1.84 0.00 0.00 35.03 32.43 2dcr n LYS 46 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07 2dcr n GLN 47 N 0.76 -1.63 -4.67 1.97 6.02 -1.26 -4.96 117.38 113.61 2dcr n GLN 47 Ca 0.09 0.74 -0.33 0.00 -0.01 0.00 0.00 57.00 57.49 2dcr n GLN 47 Cb 0.39 -5.12 -0.15 0.00 1.02 0.00 0.00 30.24 26.37 2dcr n GLN 47 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 177.06 174.05 2dcr s GLU 48 N -3.87 3.29 0.53 -1.09 2.56 -1.26 -5.01 118.70 113.86 2dcr s GLU 48 Ca 0.00 -0.72 -0.09 0.00 0.00 0.00 0.00 54.97 54.16 2dcr s GLU 48 Cb 0.00 -2.62 -0.05 0.00 2.00 0.00 0.00 34.13 33.46 2dcr s GLU 48 CO 0.00 0.11 0.90 0.71 -0.56 0.00 0.00 175.26 176.42 2dcr s TYR 49 N 0.59 3.57 -0.04 5.30 2.02 -1.26 -0.23 117.35 127.30 2dcr s TYR 49 Ca -0.08 1.10 -0.00 0.00 -0.37 0.00 0.00 57.07 57.71 2dcr s TYR 49 Cb -0.16 -2.53 0.03 0.00 -0.40 0.00 0.00 41.96 38.90 2dcr s TYR 49 CO 0.03 -0.42 0.01 0.08 -1.57 0.00 0.00 175.55 173.68 2dcr s VAL 50 N -2.85 0.16 0.30 0.71 1.01 0.11 -0.93 120.40 118.90 2dcr s VAL 50 Ca 0.52 0.14 -0.27 0.00 0.00 0.00 0.00 61.98 62.37 2dcr s VAL 50 Cb -0.11 -0.28 -0.10 0.00 0.00 0.00 0.00 36.38 35.89 2dcr s VAL 50 CO 0.45 0.16 0.93 -0.22 0.00 0.00 0.00 175.10 176.43 2dcr s LEU 51 N 1.29 4.41 -0.03 3.92 2.96 0.80 -0.66 118.68 131.37 2dcr s LEU 51 Ca -0.06 1.84 -0.00 0.00 -0.22 0.00 0.00 54.13 55.69 2dcr s LEU 51 Cb -0.13 -3.90 0.03 0.00 0.50 0.00 0.00 46.19 42.69 2dcr s LEU 51 CO -0.02 -0.01 0.02 -0.44 -1.32 0.00 0.00 176.35 174.57 2dcr s SER 52 N -1.52 0.55 -0.14 3.68 0.01 -0.50 -1.63 113.70 114.15 2dcr s SER 52 Ca 0.48 -0.00 -0.10 0.00 1.31 0.00 0.00 55.95 57.64 2dcr s SER 52 Cb -0.20 -0.20 0.05 0.00 0.21 0.00 0.00 66.02 65.88 2dcr s SER 52 CO 0.25 -0.14 0.35 0.54 0.41 0.00 0.00 173.24 174.66 2dcr s VAL 53 N 1.28 -0.02 -0.20 3.43 0.11 -0.32 -1.38 120.40 123.30 2dcr s VAL 53 Ca -0.06 0.07 -0.22 0.00 -2.93 0.00 0.00 61.98 58.83 2dcr s VAL 53 Cb -0.13 -0.51 -0.02 0.00 -1.53 0.00 0.00 36.38 34.19 2dcr s VAL 53 CO -0.02 0.03 0.69 -0.22 -3.33 0.00 0.00 175.10 172.24 2dcr s LEU 54 N 0.86 4.13 -0.08 2.54 1.98 -0.59 -0.18 118.68 127.34 2dcr s LEU 54 Ca -0.06 0.90 0.01 0.00 -2.89 0.00 0.00 54.13 52.10 2dcr s LEU 54 Cb -0.06 -2.98 0.02 0.00 0.66 0.00 0.00 46.19 43.82 2dcr s LEU 54 CO -0.06 -0.33 -0.08 0.86 -1.89 0.00 0.00 176.35 174.84 2dcr s TRP 55 N 2.13 1.32 -0.71 5.38 -0.00 -0.71 -1.06 118.94 125.29 2dcr s TRP 55 Ca 0.31 -0.56 -0.15 0.00 -0.00 0.00 0.00 56.10 55.70 2dcr s TRP 55 Cb -0.16 -1.07 0.02 0.00 -0.00 0.00 0.00 33.47 32.27 2dcr s TRP 55 CO 0.10 -0.37 0.43 -3.47 -0.00 0.00 0.00 176.95 173.64 2dcr n ASP 56 N 4.43 -2.83 -1.45 5.86 -0.08 -1.26 -1.16 116.55 120.06 2dcr n ASP 56 Ca -0.18 -0.79 -0.15 0.00 -1.51 0.00 0.00 54.79 52.17 2dcr n ASP 56 Cb 0.51 -1.03 -0.03 0.00 2.34 0.00 0.00 41.12 42.90 2dcr n ASP 56 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2dcr n GLY 57 N -1.55 0.46 2.68 0.27 0.00 -1.26 -4.98 105.19 100.81 2dcr n GLY 57 Ca -0.12 -0.30 -0.28 0.00 0.00 0.00 0.00 46.02 45.33 2dcr n GLY 57 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2dcr s LEU 58 N -3.86 0.99 -0.75 0.99 0.20 -0.31 -5.09 118.68 110.86 2dcr s LEU 58 Ca 0.00 -0.91 -0.26 0.00 0.69 0.00 0.00 54.13 53.65 2dcr s LEU 58 Cb 0.00 -0.50 -0.10 0.00 -0.43 0.00 0.00 46.19 45.17 2dcr s LEU 58 CO 0.00 -0.35 2.26 -2.16 -0.29 0.00 0.00 176.35 175.81 2dcr s PRO 59 N 1.94 1.99 0.73 0.98 0.04 -1.26 -1.74 135.00 137.67 2dcr s PRO 59 Ca 0.02 0.48 -0.14 0.00 0.04 0.00 0.00 61.00 61.41 2dcr s PRO 59 Cb -0.17 -4.78 0.04 0.00 0.04 0.00 0.00 34.50 29.63 2dcr s PRO 59 CO -0.14 -3.86 1.15 1.03 0.04 0.00 0.00 177.00 175.22 2dcr s ARG 60 N 8.20 2.30 -0.13 4.56 1.81 0.75 -4.81 118.95 131.64 2dcr s ARG 60 Ca 0.86 1.51 -0.01 0.00 -1.72 0.00 0.00 55.73 56.38 2dcr s ARG 60 Cb -0.12 -1.88 0.04 0.00 -0.45 0.00 0.00 34.95 32.54 2dcr s ARG 60 CO 0.10 -1.66 -0.03 -1.01 -0.68 0.00 0.00 175.30 172.02 2dcr s HIS 61 N -2.31 1.25 -0.14 -0.53 3.76 -1.26 -1.18 115.29 114.88 2dcr s HIS 61 Ca 0.69 -0.70 0.01 0.00 -0.15 0.00 0.00 55.06 54.91 2dcr s HIS 61 Cb -0.23 -1.10 -0.00 0.00 1.11 0.00 0.00 32.58 32.35 2dcr s HIS 61 CO 0.46 -0.51 -0.17 -0.06 -0.85 0.00 0.00 174.74 173.62 2dcr s PHE 62 N 1.78 2.74 0.32 1.40 0.08 -0.65 -5.00 117.98 118.66 2dcr s PHE 62 Ca 0.03 -0.98 -0.28 0.00 0.12 0.00 0.00 56.93 55.81 2dcr s PHE 62 Cb -0.14 -1.84 -0.13 0.00 -0.57 0.00 0.00 43.02 40.34 2dcr s PHE 62 CO -0.07 -0.42 1.24 -0.89 -0.10 0.00 0.00 175.22 174.98 2dcr n ILE 63 N 3.86 1.91 -0.71 0.64 2.08 -1.26 -0.14 119.36 125.73 2dcr n ILE 63 Ca -0.19 -0.48 -0.30 0.00 0.56 0.00 0.00 62.75 62.34 2dcr n ILE 63 Cb 0.52 -1.44 0.18 0.00 -0.75 0.00 0.00 39.64 38.15 2dcr n ILE 63 CO 0.00 0.00 0.00 -0.63 0.56 0.00 0.00 176.55 176.48 2dcr s ILE 64 N -1.00 2.16 1.01 1.39 -1.09 -0.11 -4.67 121.20 118.89 2dcr s ILE 64 Ca 0.57 0.05 -0.15 0.00 -2.23 0.00 0.00 60.65 58.89 2dcr s ILE 64 Cb -0.60 -2.13 0.19 0.00 -1.58 0.00 0.00 42.46 38.34 2dcr s ILE 64 CO 0.61 -0.07 1.16 -1.10 -1.23 0.00 0.00 174.94 174.31 2dcr s GLN 65 N -4.63 0.35 0.00 2.79 1.11 -1.26 -4.93 119.66 113.09 2dcr s GLN 65 Ca 0.67 0.09 0.00 0.00 0.01 0.00 0.00 55.36 56.12 2dcr s GLN 65 Cb -0.23 -1.77 0.00 0.00 -1.01 0.00 0.00 33.01 30.01 2dcr s GLN 65 CO 0.59 -2.69 0.00 0.45 0.01 0.00 0.00 175.29 173.65 2dcr n SER 66 N -4.07 0.00 0.00 5.90 2.88 -1.25 -4.80 113.62 112.27 2dcr n SER 66 Ca 0.10 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.64 2dcr n SER 66 Cb 0.59 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.05 2dcr n SER 66 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2dcr n LEU 67 N 0.00 0.00 0.02 2.46 -0.00 -1.03 -4.97 117.00 113.48 2dcr n LEU 67 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.01 2dcr n LEU 67 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.42 2dcr n LEU 67 CO 0.00 -0.32 0.00 0.47 -0.00 0.00 0.00 177.39 177.54 2dcr n ASP 68 N -1.97 0.50 -0.11 1.45 9.92 -1.26 -4.94 116.55 120.13 2dcr n ASP 68 Ca 0.00 0.06 0.00 0.00 -0.53 0.00 0.00 54.79 54.33 2dcr n ASP 68 Cb 0.00 -0.15 0.00 0.00 -0.64 0.00 0.00 41.12 40.33 2dcr n ASP 68 CO 0.00 0.00 0.00 -0.46 0.13 0.00 0.00 177.20 176.87 2dcr n ASN 69 N -2.95 0.25 -4.16 -2.24 6.94 -1.26 -5.10 115.26 106.75 2dcr n ASN 69 Ca 0.00 -1.38 -0.13 0.00 -0.02 0.00 0.00 54.58 53.05 2dcr n ASN 69 Cb 0.00 -0.06 -0.10 0.00 -2.36 0.00 0.00 39.78 37.26 2dcr n ASN 69 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 2dcr s LEU 70 N -0.18 1.22 -0.11 -4.53 1.43 -1.26 -4.53 118.68 110.72 2dcr s LEU 70 Ca 0.01 -1.41 0.01 0.00 -1.03 0.00 0.00 54.13 51.71 2dcr s LEU 70 Cb 0.01 0.37 0.02 0.00 0.03 0.00 0.00 46.19 46.62 2dcr s LEU 70 CO 0.00 -0.85 -0.12 -0.31 0.23 0.00 0.00 176.35 175.31 2dcr s TYR 71 N -4.09 1.73 -0.09 0.29 1.51 -0.61 -2.47 117.35 113.62 2dcr s TYR 71 Ca 0.39 -0.83 -0.07 0.00 -1.01 0.00 0.00 57.07 55.55 2dcr s TYR 71 Cb 0.07 -1.31 0.03 0.00 -0.11 0.00 0.00 41.96 40.63 2dcr s TYR 71 CO 0.13 -0.48 0.22 -0.98 -1.11 0.00 0.00 175.55 173.33 2dcr s ARG 72 N 1.25 0.24 0.00 -0.62 1.04 -1.26 -2.43 118.95 117.17 2dcr s ARG 72 Ca -0.02 0.34 0.00 0.00 -1.04 0.00 0.00 55.73 55.01 2dcr s ARG 72 Cb -0.14 0.08 0.00 0.00 -2.04 0.00 0.00 34.95 32.85 2dcr s ARG 72 CO -0.04 -0.06 0.00 -0.11 -0.04 0.00 0.00 175.30 175.05 2dcr n LEU 73 N 3.21 0.00 0.08 -1.89 7.94 -1.26 -4.69 117.00 120.37 2dcr n LEU 73 Ca -0.15 0.00 -0.19 0.00 -1.11 0.00 0.00 56.01 54.56 2dcr n LEU 73 Cb 0.57 -0.02 -0.15 0.00 0.53 0.00 0.00 43.42 44.36 2dcr n LEU 73 CO 0.18 -0.22 -0.38 1.05 -1.11 0.00 0.00 177.39 176.91 2dcr h GLU 74 N 0.00 0.32 0.00 1.96 9.09 -1.81 -3.50 114.58 120.64 2dcr h GLU 74 Ca 0.00 -0.55 0.00 0.00 0.05 0.00 0.00 59.36 58.86 2dcr h GLU 74 Cb 0.00 0.20 0.00 0.00 -1.65 0.00 0.00 28.75 27.30 2dcr h GLU 74 CO 0.00 1.21 0.00 0.41 0.05 0.00 0.00 179.01 180.68 2dcr n GLY 75 N 1.73 4.73 3.99 1.06 0.00 -1.26 -5.16 105.19 110.27 2dcr n GLY 75 Ca -0.19 -1.20 -0.24 0.00 0.00 0.00 0.00 46.02 44.39 2dcr n GLY 75 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2dcr s GLU 76 N 4.79 1.48 0.11 1.61 -1.05 -1.26 -4.90 118.70 119.48 2dcr s GLU 76 Ca 0.00 -1.09 0.04 0.00 -0.15 0.00 0.00 54.97 53.77 2dcr s GLU 76 Cb 0.00 -2.27 -0.04 0.00 -0.44 0.00 0.00 34.13 31.38 2dcr s GLU 76 CO 0.00 -1.62 0.07 0.20 0.95 0.00 0.00 175.26 174.87 2dcr s GLY 77 N -4.78 1.90 0.16 -3.83 0.00 -1.26 -4.43 107.32 95.08 2dcr s GLY 77 Ca 0.68 -1.11 0.07 0.00 0.00 0.00 0.00 44.72 44.36 2dcr s GLY 77 CO 0.46 -1.10 -0.14 -1.36 0.00 0.00 0.00 173.10 170.95 2dcr s PHE 78 N -1.49 1.56 -1.01 1.90 0.40 -1.02 -4.85 117.98 113.46 2dcr s PHE 78 Ca 0.29 -0.58 0.22 0.00 -0.60 0.00 0.00 56.93 56.25 2dcr s PHE 78 Cb -0.11 -0.77 0.93 0.00 0.51 0.00 0.00 43.02 43.58 2dcr s PHE 78 CO 0.21 0.24 1.70 -0.35 0.70 0.00 0.00 175.22 177.73 2dcr n PRO 79 N 0.03 0.01 -4.05 0.24 -0.04 -1.26 -1.58 135.00 128.35 2dcr n PRO 79 Ca -0.11 0.12 -0.12 0.00 -0.04 0.00 0.00 63.50 63.35 2dcr n PRO 79 Cb 0.59 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 32.44 2dcr n PRO 79 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 2dcr s SER 80 N -2.99 0.72 0.07 3.54 0.01 -1.26 -4.87 113.70 108.92 2dcr s SER 80 Ca 0.11 -0.57 -0.22 0.00 1.31 0.00 0.00 55.95 56.58 2dcr s SER 80 Cb 0.14 0.06 -0.13 0.00 0.21 0.00 0.00 66.02 66.30 2dcr s SER 80 CO 0.40 -0.24 1.58 0.40 0.41 0.00 0.00 173.24 175.78 2dcr h ILE 81 N 4.44 1.17 -0.03 1.44 2.04 -1.96 -3.25 117.51 121.36 2dcr h ILE 81 Ca -0.35 -0.52 -0.06 0.00 1.00 0.00 0.00 64.86 64.93 2dcr h ILE 81 Cb 1.20 1.33 -0.01 0.00 -0.74 0.00 0.00 36.82 38.60 2dcr h ILE 81 CO 0.42 0.15 -0.28 1.55 0.00 0.00 0.00 178.15 179.99 2dcr h PRO 82 N -0.02 0.04 -0.68 2.37 0.13 -1.91 -1.33 132.00 130.61 2dcr h PRO 82 Ca 0.03 -0.01 -0.03 0.00 -0.87 0.00 0.00 66.00 65.11 2dcr h PRO 82 Cb 0.21 -0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.30 2dcr h PRO 82 CO -0.00 0.33 0.29 -0.07 -0.23 0.00 0.00 178.00 178.31 2dcr h LEU 83 N 0.04 0.91 0.11 1.56 4.07 -1.64 -2.58 115.31 117.77 2dcr h LEU 83 Ca 0.00 -0.12 -0.27 0.00 0.08 0.00 0.00 57.88 57.58 2dcr h LEU 83 Cb 0.52 -0.23 -0.00 0.00 1.08 0.00 0.00 40.66 42.03 2dcr h LEU 83 CO 0.04 0.80 -1.24 0.25 -1.08 0.00 0.00 178.44 177.21 2dcr h LEU 84 N 0.98 0.36 -0.99 1.67 7.12 -1.37 -3.31 115.31 119.77 2dcr h LEU 84 Ca 0.23 -0.40 0.10 0.00 0.13 0.00 0.00 57.88 57.95 2dcr h LEU 84 Cb 0.17 -0.12 -0.08 0.00 -0.53 0.00 0.00 40.66 40.10 2dcr h LEU 84 CO -0.02 1.31 0.63 0.40 -0.13 0.00 0.00 178.44 180.63 2dcr h ILE 85 N 0.06 0.97 -0.51 4.05 1.08 -0.88 -1.18 117.51 121.10 2dcr h ILE 85 Ca -0.13 -0.36 -0.03 0.00 -0.39 0.00 0.00 64.86 63.95 2dcr h ILE 85 Cb 1.95 -0.16 -0.02 0.00 -3.07 0.00 0.00 36.82 35.52 2dcr h ILE 85 CO 0.19 0.19 0.19 -0.78 -0.69 0.00 0.00 178.15 177.25 2dcr h ASP 86 N 1.04 0.72 0.13 1.72 3.58 -1.59 0.31 116.42 122.32 2dcr h ASP 86 Ca 0.47 -0.18 0.00 0.00 0.42 0.00 0.00 57.03 57.74 2dcr h ASP 86 Cb 0.37 -0.19 0.00 0.00 1.72 0.00 0.00 39.33 41.24 2dcr h ASP 86 CO -0.23 0.70 0.00 1.41 -2.88 0.00 0.00 179.24 178.24 2dcr n HIS 87 N -4.53 0.00 -0.12 0.28 8.25 -0.52 -0.14 115.22 118.45 2dcr n HIS 87 Ca 0.02 0.00 -0.18 0.00 -0.26 0.00 0.00 57.72 57.30 2dcr n HIS 87 Cb 0.17 -0.09 -0.10 0.00 1.12 0.00 0.00 29.99 31.08 2dcr n HIS 87 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 2dcr n LEU 88 N -1.09 2.76 0.15 2.41 4.77 -0.77 -4.38 117.00 120.85 2dcr n LEU 88 Ca 0.14 -0.05 0.04 0.00 -0.03 0.00 0.00 56.01 56.11 2dcr n LEU 88 Cb 0.10 -0.78 0.08 0.00 -2.33 0.00 0.00 43.42 40.49 2dcr n LEU 88 CO 0.13 0.82 0.53 0.25 -1.33 0.00 0.00 177.39 177.80 2dcr h LEU 89 N -0.15 0.00 -0.05 2.23 5.85 0.35 0.14 115.31 123.67 2dcr h LEU 89 Ca -0.53 0.00 -0.23 0.00 0.84 0.00 0.00 57.88 57.97 2dcr h LEU 89 Cb 1.74 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.76 2dcr h LEU 89 CO -0.13 0.43 -1.04 -1.28 -0.34 0.00 0.00 178.44 176.09 2dcr h SER 90 N 0.00 0.21 0.00 1.25 0.87 -0.76 -3.39 113.55 111.73 2dcr h SER 90 Ca -0.00 -0.21 -0.34 0.00 -1.23 0.00 0.00 61.79 60.01 2dcr h SER 90 Cb 1.29 -0.07 -0.06 0.00 -0.44 0.00 0.00 62.40 63.12 2dcr h SER 90 CO 0.06 1.11 -2.27 0.35 -0.53 0.00 0.00 176.83 175.55 2dcr n THR 91 N -3.51 1.27 -2.87 2.23 -2.24 -1.11 -5.00 114.28 103.05 2dcr n THR 91 Ca -0.04 -0.77 -0.10 0.00 -2.27 0.00 0.00 64.05 60.87 2dcr n THR 91 Cb 0.92 -0.54 0.03 0.00 -2.10 0.00 0.00 70.33 68.64 2dcr n THR 91 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2dcr n GLN 92 N -2.70 -3.13 -2.17 -0.78 1.13 0.46 -5.03 117.38 105.16 2dcr n GLN 92 Ca -0.31 0.37 -0.34 0.00 -1.94 0.00 0.00 57.00 54.79 2dcr n GLN 92 Cb 1.10 -4.05 0.01 0.00 0.11 0.00 0.00 30.24 27.41 2dcr n GLN 92 CO 0.00 0.00 0.00 -0.65 -1.44 0.00 0.00 177.06 174.97 2dcr s GLN 93 N -5.43 3.32 0.21 -1.09 -0.21 -1.20 -4.83 119.66 110.43 2dcr s GLN 93 Ca 0.22 1.43 -0.30 0.00 0.02 0.00 0.00 55.36 56.73 2dcr s GLN 93 Cb -0.10 -2.02 -0.08 0.00 1.00 0.00 0.00 33.01 31.81 2dcr s GLN 93 CO 0.28 -0.84 1.12 -1.25 -2.12 0.00 0.00 175.29 172.47 2dcr s PRO 94 N -3.61 4.59 0.03 2.91 0.04 -1.26 -4.15 135.00 133.56 2dcr s PRO 94 Ca 0.68 1.77 -0.18 0.00 0.04 0.00 0.00 61.00 63.31 2dcr s PRO 94 Cb -0.20 -3.24 -0.20 0.00 0.04 0.00 0.00 34.50 30.90 2dcr s PRO 94 CO 0.31 0.09 1.19 -0.07 0.04 0.00 0.00 177.00 178.56 2dcr h LEU 95 N 4.73 0.59 -7.36 -3.56 3.38 -1.08 -3.42 115.31 108.59 2dcr h LEU 95 Ca -0.45 -0.68 -0.10 0.00 0.09 0.00 0.00 57.88 56.74 2dcr h LEU 95 Cb 1.21 -0.18 -0.20 0.00 0.09 0.00 0.00 40.66 41.58 2dcr h LEU 95 CO 0.71 1.18 -0.15 0.28 0.09 0.00 0.00 178.44 180.55 2dcr s THR 96 N -3.54 0.04 -0.86 0.22 -1.32 -1.26 -4.53 115.64 104.39 2dcr s THR 96 Ca -0.13 -0.32 0.08 0.00 -1.21 0.00 0.00 61.69 60.12 2dcr s THR 96 Cb 0.05 -0.71 0.07 0.00 -1.51 0.00 0.00 72.50 70.40 2dcr s THR 96 CO 0.83 -0.17 1.25 1.17 -2.21 0.00 0.00 174.62 175.48 2dcr n LYS 97 N 1.32 0.03 0.12 7.08 3.00 -1.26 -0.26 118.16 128.18 2dcr n LYS 97 Ca -0.20 0.45 0.12 0.00 -0.00 0.00 0.00 58.31 58.68 2dcr n LYS 97 Cb 0.56 -1.58 0.20 0.00 0.00 0.00 0.00 35.03 34.21 2dcr n LYS 97 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.40 178.27 2dcr h LYS 98 N 0.00 0.00 0.00 1.64 1.79 -2.02 -3.41 116.57 114.57 2dcr h LYS 98 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2dcr h LYS 98 Cb 0.09 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.74 2dcr h LYS 98 CO 0.00 0.00 0.00 0.45 -1.08 0.00 0.00 179.45 178.82 2dcr n SER 99 N -2.49 0.00 -2.11 0.86 2.88 -0.97 -5.04 113.62 106.76 2dcr n SER 99 Ca 0.03 0.00 -0.15 0.00 -1.33 0.00 0.00 58.87 57.42 2dcr n SER 99 Cb 0.48 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.91 2dcr n SER 99 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dcr n GLY 100 N 0.00 0.11 3.63 0.46 0.00 0.64 -4.92 105.19 105.11 2dcr n GLY 100 Ca 0.00 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.56 2dcr n GLY 100 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2dcr n VAL 101 N -3.08 1.32 -4.75 1.61 0.31 -1.26 -4.71 118.33 107.77 2dcr n VAL 101 Ca -0.17 -0.33 -0.26 0.00 -0.01 0.00 0.00 64.34 63.57 2dcr n VAL 101 Cb 0.59 -1.20 -0.15 0.00 -0.91 0.00 0.00 33.84 32.18 2dcr n VAL 101 CO 0.00 0.00 0.00 0.68 -1.32 0.00 0.00 176.83 176.19 2dcr s VAL 102 N -0.47 1.65 0.38 2.52 -7.23 -1.26 -0.51 120.40 115.49 2dcr s VAL 102 Ca 0.66 -1.10 -0.28 0.00 -1.81 0.00 0.00 61.98 59.45 2dcr s VAL 102 Cb -0.71 -1.41 -0.11 0.00 0.56 0.00 0.00 36.38 34.71 2dcr s VAL 102 CO 0.54 0.28 1.45 0.18 -0.31 0.00 0.00 175.10 177.24 2dcr n LEU 103 N 2.07 4.65 0.00 1.32 4.77 -1.26 -4.50 117.00 124.05 2dcr n LEU 103 Ca -0.17 1.21 0.00 0.00 -0.03 0.00 0.00 56.01 57.02 2dcr n LEU 103 Cb 0.53 -1.60 0.00 0.00 -2.33 0.00 0.00 43.42 40.02 2dcr n LEU 103 CO 0.23 0.01 0.00 1.41 -1.33 0.00 0.00 177.39 177.71 2dcr n HIS 104 N 0.31 0.00 -3.72 -1.77 8.25 -1.10 -4.59 115.22 112.59 2dcr n HIS 104 Ca 0.02 0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.37 2dcr n HIS 104 Cb 0.39 0.00 -0.07 0.00 1.12 0.00 0.00 29.99 31.43 2dcr n HIS 104 CO 0.00 0.00 0.00 0.50 0.64 0.00 0.00 176.34 177.48 2dcr s ARG 105 N -1.00 0.86 0.27 -0.41 3.52 -0.41 -4.93 118.95 116.85 2dcr s ARG 105 Ca 0.00 -0.47 0.12 0.00 -0.13 0.00 0.00 55.73 55.24 2dcr s ARG 105 Cb 0.00 0.38 -0.05 0.00 -1.56 0.00 0.00 34.95 33.72 2dcr s ARG 105 CO 0.00 -0.29 -0.20 0.00 -0.81 0.00 0.00 175.30 174.00 2dcr s ALA 106 N -2.62 2.72 -0.25 6.12 0.00 -1.26 -1.62 121.76 124.85 2dcr s ALA 106 Ca -0.04 -1.86 -0.10 0.00 0.00 0.00 0.00 51.96 49.96 2dcr s ALA 106 Cb -0.01 -0.26 -0.05 0.00 0.00 0.00 0.00 23.12 22.80 2dcr s ALA 106 CO -0.04 0.29 0.16 0.08 0.00 0.00 0.00 175.76 176.25 2dcr s VAL 107 N -2.45 5.28 -0.42 0.00 1.01 -0.78 -4.80 120.40 118.24 2dcr s VAL 107 Ca 0.29 0.15 -0.26 0.00 0.00 0.00 0.00 61.98 62.17 2dcr s VAL 107 Cb -0.05 -3.47 0.02 0.00 0.00 0.00 0.00 36.38 32.88 2dcr s VAL 107 CO 0.14 0.33 0.92 -2.16 0.00 0.00 0.00 175.10 174.33 2dcr s PRO 108 N 1.23 3.67 0.00 2.72 0.04 -1.26 -2.70 135.00 138.71 2dcr s PRO 108 Ca 0.07 0.35 0.29 0.00 0.04 0.00 0.00 61.00 61.74 2dcr s PRO 108 Cb -0.14 -3.87 1.16 0.00 0.04 0.00 0.00 34.50 31.68 2dcr s PRO 108 CO 0.06 -1.10 1.86 0.45 0.04 0.00 0.00 177.00 178.32 2dcr n SER 109 N 6.98 0.08 -0.35 6.66 2.88 0.38 -4.98 113.62 125.27 2dcr n SER 109 Ca 0.06 0.32 0.05 0.00 -1.33 0.00 0.00 58.87 57.97 2dcr n SER 109 Cb 0.48 -0.37 -0.02 0.00 -0.75 0.00 0.00 64.21 63.56 2dcr n SER 109 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dcr n GLY 110 N 1.48 -2.02 0.00 0.46 0.00 -1.26 -4.44 105.19 99.40 2dcr n GLY 110 Ca 0.08 -1.41 0.08 0.00 0.00 0.00 0.00 46.02 44.76 2dcr n GLY 110 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2dcr n PRO 111 N -2.79 0.73 -1.42 1.61 -0.04 -1.26 -4.63 135.00 127.20 2dcr n PRO 111 Ca -0.01 0.00 -0.30 0.00 -0.04 0.00 0.00 63.50 63.15 2dcr n PRO 111 Cb 0.16 -1.33 0.10 0.00 -0.04 0.00 0.00 33.50 32.39 2dcr n PRO 111 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2dcr s SER 112 N -1.76 4.21 0.03 3.54 0.15 -1.26 -4.60 113.70 114.02 2dcr s SER 112 Ca 0.23 1.43 -0.01 0.00 0.70 0.00 0.00 55.95 58.30 2dcr s SER 112 Cb 0.11 -2.15 -0.02 0.00 -1.71 0.00 0.00 66.02 62.24 2dcr s SER 112 CO 0.18 -2.16 -0.01 -0.55 1.20 0.00 0.00 173.24 171.90 2dcr s SER 113 N -3.70 0.30 0.00 5.45 0.15 -1.26 -4.92 113.70 109.72 2dcr s SER 113 Ca 0.61 -0.65 0.00 0.00 0.70 0.00 0.00 55.95 56.61 2dcr s SER 113 Cb -0.16 0.15 0.00 0.00 -1.71 0.00 0.00 66.02 64.31 2dcr s SER 113 CO 0.55 -0.43 0.00 0.61 1.20 0.00 0.00 173.24 175.17