#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dcr n SER 2 N 0.00 0.41 -0.36 1.61 7.64 -1.26 -4.72 113.62 116.94 2dcr n SER 2 Ca 0.00 0.06 0.04 0.00 1.01 0.00 0.00 58.87 59.98 2dcr n SER 2 Cb 0.00 -0.22 0.20 0.00 -1.01 0.00 0.00 64.21 63.18 2dcr n SER 2 CO 0.00 0.00 0.00 -1.28 -3.01 0.00 0.00 175.04 170.75 2dcr h SER 3 N -0.07 0.95 -3.63 6.43 0.87 -2.12 -3.48 113.55 112.49 2dcr h SER 3 Ca 0.00 0.03 0.23 0.00 -1.23 0.00 0.00 61.79 60.82 2dcr h SER 3 Cb 0.07 -0.17 -0.07 0.00 -0.44 0.00 0.00 62.40 61.79 2dcr h SER 3 CO 0.00 0.56 -0.44 0.61 -0.53 0.00 0.00 176.83 177.03 2dcr n GLY 4 N -1.35 -2.05 3.22 5.77 0.00 -1.26 -5.05 105.19 104.47 2dcr n GLY 4 Ca 0.16 -1.28 -0.13 0.00 0.00 0.00 0.00 46.02 44.77 2dcr n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dcr s SER 5 N -5.78 0.39 0.27 1.61 0.01 -1.26 -5.02 113.70 103.91 2dcr s SER 5 Ca 0.00 -1.36 0.00 0.00 1.31 0.00 0.00 55.95 55.90 2dcr s SER 5 Cb 0.00 0.32 0.00 0.00 0.21 0.00 0.00 66.02 66.55 2dcr s SER 5 CO 0.00 -0.80 0.00 -1.54 0.41 0.00 0.00 173.24 171.31 2dcr n SER 6 N -0.28 -1.57 -4.54 2.44 3.41 -1.26 -5.01 113.62 106.81 2dcr n SER 6 Ca 0.00 0.49 -0.41 0.00 -0.26 0.00 0.00 58.87 58.69 2dcr n SER 6 Cb 0.66 1.61 -0.03 0.00 -0.26 0.00 0.00 64.21 66.19 2dcr n SER 6 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2dcr s GLY 7 N -3.48 1.14 -0.01 5.00 0.00 -1.26 -4.77 107.32 103.93 2dcr s GLY 7 Ca 0.00 -1.85 0.01 0.00 0.00 0.00 0.00 44.72 42.88 2dcr s GLY 7 CO 0.00 2.58 0.84 1.18 0.00 0.00 0.00 173.10 177.70 2dcr n GLU 8 N 8.88 1.72 -0.04 2.90 1.02 -1.26 -4.84 120.64 129.02 2dcr n GLU 8 Ca 0.16 -1.20 -0.10 0.00 -0.02 0.00 0.00 57.16 55.99 2dcr n GLU 8 Cb 0.50 -0.84 -0.04 0.00 -0.02 0.00 0.00 31.44 31.04 2dcr n GLU 8 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 2dcr h VAL 9 N 1.33 1.08 -0.00 2.62 2.07 -1.86 -2.87 116.25 118.63 2dcr h VAL 9 Ca 0.00 -0.21 0.00 0.00 0.82 0.00 0.00 66.70 67.31 2dcr h VAL 9 Cb 0.74 0.90 0.00 0.00 -1.52 0.00 0.00 31.29 31.41 2dcr h VAL 9 CO 0.00 0.08 -0.10 0.00 0.02 0.00 0.00 177.57 177.57 2dcr n GLN 10 N -4.93 0.34 -1.06 1.57 1.13 -1.26 -3.55 117.38 109.62 2dcr n GLN 10 Ca -0.04 -0.08 -0.30 0.00 -1.94 0.00 0.00 57.00 54.64 2dcr n GLN 10 Cb 0.06 -1.50 0.14 0.00 0.11 0.00 0.00 30.24 29.04 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 -2.72 1.42 0.97 -1.09 1.02 -1.09 -5.03 119.74 113.23 2dcr s LYS 11 Ca 0.22 1.13 -0.11 0.00 0.02 0.00 0.00 55.97 57.23 2dcr s LYS 11 Cb 0.19 -1.80 0.17 0.00 -0.52 0.00 0.00 37.83 35.88 2dcr s LYS 11 CO 0.52 -2.22 1.10 -1.25 -0.92 0.00 0.00 175.35 172.58 2dcr s PRO 12 N -4.82 0.61 0.39 -1.68 0.04 -1.26 -4.85 135.00 123.42 2dcr s PRO 12 Ca 0.64 1.23 0.08 0.00 0.04 0.00 0.00 61.00 62.98 2dcr s PRO 12 Cb -0.19 -1.70 0.82 0.00 0.04 0.00 0.00 34.50 33.46 2dcr s PRO 12 CO 0.57 -2.81 1.98 1.25 0.04 0.00 0.00 177.00 178.04 2dcr h LEU 13 N -1.98 0.57 0.00 -3.56 6.46 -1.95 -2.84 115.31 112.01 2dcr h LEU 13 Ca -0.49 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.27 2dcr h LEU 13 Cb 1.28 -0.12 0.00 0.00 -0.73 0.00 0.00 40.66 41.09 2dcr h LEU 13 CO 0.46 0.37 0.00 0.00 -0.62 0.00 0.00 178.44 178.66 2dcr n HIS 14 N -4.47 0.00 -0.37 1.25 1.44 -1.26 -2.52 115.22 109.29 2dcr n HIS 14 Ca 0.09 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.80 2dcr n HIS 14 Cb 0.22 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.33 2dcr n HIS 14 CO 0.00 0.00 0.00 0.39 -2.81 0.00 0.00 176.34 173.92 2dcr n GLU 15 N -0.73 1.75 0.00 -1.40 -0.58 -1.07 -4.73 120.64 113.87 2dcr n GLU 15 Ca 0.08 -1.08 0.00 0.00 -0.42 0.00 0.00 57.16 55.73 2dcr n GLU 15 Cb 0.04 -0.82 0.00 0.00 -0.57 0.00 0.00 31.44 30.09 2dcr n GLU 15 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 2dcr n GLN 16 N -0.30 -0.56 -0.02 3.49 1.13 -1.05 -4.81 117.38 115.26 2dcr n GLN 16 Ca 0.00 0.00 -0.03 0.00 -1.94 0.00 0.00 57.00 55.03 2dcr n GLN 16 Cb 0.33 0.00 -0.02 0.00 0.11 0.00 0.00 30.24 30.65 2dcr n GLN 16 CO 0.00 0.00 0.00 1.47 -1.44 0.00 0.00 177.06 177.09 2dcr n LEU 17 N 0.00 2.91 -0.34 1.08 -0.00 -1.26 -4.10 117.00 115.29 2dcr n LEU 17 Ca 0.00 -0.03 0.10 0.00 -0.00 0.00 0.00 56.01 56.09 2dcr n LEU 17 Cb 0.00 -0.17 0.45 0.00 -0.00 0.00 0.00 43.42 43.70 2dcr n LEU 17 CO 0.00 0.57 0.81 -2.67 -0.00 0.00 0.00 177.39 176.10 2dcr n TRP 18 N -2.63 0.13 -3.04 1.47 4.27 -1.23 -0.57 117.44 115.83 2dcr n TRP 18 Ca -0.09 -0.06 -0.44 0.00 -3.89 0.00 0.00 57.50 53.02 2dcr n TRP 18 Cb 0.59 0.00 -0.04 0.00 -1.36 0.00 0.00 31.31 30.50 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 -1.87 2.91 -0.55 -2.67 5.04 -1.26 -1.32 117.35 117.63 2dcr s TYR 19 Ca 0.31 -0.87 0.24 0.00 -2.44 0.00 0.00 57.07 54.31 2dcr s TYR 19 Cb 0.16 -4.10 0.43 0.00 0.35 0.00 0.00 41.96 38.80 2dcr s TYR 19 CO 0.25 -1.40 1.50 0.45 -1.34 0.00 0.00 175.55 175.01 2dcr h HIS 20 N 9.27 0.00 0.00 4.97 3.86 -1.84 -3.40 115.15 128.02 2dcr h HIS 20 Ca -0.28 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.93 2dcr h HIS 20 Cb 1.08 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.55 2dcr h HIS 20 CO 0.88 0.00 0.00 0.41 0.86 0.00 0.00 177.93 180.08 2dcr n GLY 21 N 1.24 0.30 3.49 2.45 0.00 -1.26 -3.77 105.19 107.64 2dcr n GLY 21 Ca 0.04 -1.58 -0.43 0.00 0.00 0.00 0.00 46.02 44.05 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 -1.86 3.17 0.09 4.61 0.00 -1.26 -1.73 121.76 124.78 2dcr s ALA 22 Ca 0.00 -2.63 0.08 0.00 0.00 0.00 0.00 51.96 49.41 2dcr s ALA 22 Cb 0.00 -4.24 -0.04 0.00 0.00 0.00 0.00 23.12 18.84 2dcr s ALA 22 CO 0.00 -3.21 -0.16 -1.50 0.00 0.00 0.00 175.76 170.89 2dcr s ILE 23 N 3.48 2.97 0.81 0.00 2.07 -1.26 -4.84 121.20 124.44 2dcr s ILE 23 Ca 0.39 -1.34 -0.12 0.00 -1.41 0.00 0.00 60.65 58.17 2dcr s ILE 23 Cb -0.03 -2.34 0.08 0.00 0.13 0.00 0.00 42.46 40.31 2dcr s ILE 23 CO -0.09 0.18 1.11 -2.16 -1.91 0.00 0.00 174.94 172.07 2dcr s PRO 24 N -1.93 1.95 0.48 3.50 0.04 -1.26 -4.56 135.00 133.22 2dcr s PRO 24 Ca 0.18 0.54 0.18 0.00 0.04 0.00 0.00 61.00 61.93 2dcr s PRO 24 Cb -0.11 -1.91 1.18 0.00 0.04 0.00 0.00 34.50 33.70 2dcr s PRO 24 CO 0.09 -1.69 2.05 0.07 0.04 0.00 0.00 177.00 177.56 2dcr h ARG 25 N -1.14 0.00 -0.39 4.56 0.11 -2.00 -3.12 114.38 112.40 2dcr h ARG 25 Ca -0.48 0.00 -0.11 0.00 0.10 0.00 0.00 59.98 59.50 2dcr h ARG 25 Cb 1.28 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 32.35 2dcr h ARG 25 CO 0.60 0.13 -0.20 0.00 0.10 0.00 0.00 179.97 180.61 2dcr h ALA 26 N 1.87 0.91 -0.50 0.08 0.00 -2.03 -2.99 119.26 116.61 2dcr h ALA 26 Ca -0.00 -0.36 -0.09 0.00 0.00 0.00 0.00 54.91 54.46 2dcr h ALA 26 Cb 0.25 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 2dcr h ALA 26 CO 0.02 0.62 -0.06 0.93 0.00 0.00 0.00 179.25 180.76 2dcr h GLU 27 N 0.67 0.88 -0.44 0.00 4.39 -1.94 -3.37 114.58 114.77 2dcr h GLU 27 Ca 0.10 -0.28 0.05 0.00 0.34 0.00 0.00 59.36 59.56 2dcr h GLU 27 Cb 0.70 -0.08 -0.07 0.00 -0.10 0.00 0.00 28.75 29.20 2dcr h GLU 27 CO 0.05 0.92 -0.44 0.28 -1.16 0.00 0.00 179.01 178.66 2dcr h VAL 28 N 0.80 0.00 0.00 3.13 2.07 -1.62 -2.15 116.25 118.49 2dcr h VAL 28 Ca 0.14 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.66 2dcr h VAL 28 Cb 0.56 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.33 2dcr h VAL 28 CO 0.03 0.00 0.00 0.00 0.02 0.00 0.00 177.57 177.62 2dcr h ALA 29 N -0.19 1.00 0.00 1.67 0.00 -1.75 0.22 119.26 120.20 2dcr h ALA 29 Ca 0.07 0.00 -0.14 0.00 0.00 0.00 0.00 54.91 54.85 2dcr h ALA 29 Cb 0.43 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 2dcr h ALA 29 CO -0.54 0.00 -0.65 1.49 0.00 0.00 0.00 179.25 179.56 2dcr h GLU 30 N 0.00 0.00 0.17 0.00 4.81 -1.63 -3.33 114.58 114.59 2dcr h GLU 30 Ca 0.00 0.00 -0.30 0.00 -0.13 0.00 0.00 59.36 58.93 2dcr h GLU 30 Cb 0.22 0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.61 2dcr h GLU 30 CO 0.00 0.65 -1.44 -0.07 -0.73 0.00 0.00 179.01 177.41 2dcr h LEU 31 N 0.00 0.55 -8.73 1.64 3.38 -0.62 -3.44 115.31 108.10 2dcr h LEU 31 Ca -0.01 -0.91 -0.66 0.00 0.09 0.00 0.00 57.88 56.40 2dcr h LEU 31 Cb 1.18 -0.18 -0.16 0.00 0.09 0.00 0.00 40.66 41.59 2dcr h LEU 31 CO 0.08 1.66 -0.12 -0.76 0.09 0.00 0.00 178.44 179.39 2dcr s LEU 32 N -7.53 4.43 0.00 1.67 1.43 -0.26 -4.88 118.68 113.55 2dcr s LEU 32 Ca -0.16 -0.16 0.00 0.00 -1.03 0.00 0.00 54.13 52.78 2dcr s LEU 32 Cb 0.04 -2.50 0.00 0.00 0.03 0.00 0.00 46.19 43.76 2dcr s LEU 32 CO 0.84 -0.46 0.00 0.52 0.23 0.00 0.00 176.35 177.47 2dcr n VAL 33 N 5.39 0.00 -3.16 -1.59 0.31 -1.26 -4.66 118.33 113.36 2dcr n VAL 33 Ca -0.06 0.00 -0.39 0.00 -0.01 0.00 0.00 64.34 63.88 2dcr n VAL 33 Cb 0.49 -0.89 -0.06 0.00 -0.91 0.00 0.00 33.84 32.48 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 -1.95 3.76 -1.10 3.52 3.76 -1.26 -4.97 115.29 117.04 2dcr s HIS 34 Ca 0.00 1.33 -0.24 0.00 -0.15 0.00 0.00 55.06 56.00 2dcr s HIS 34 Cb 0.00 -2.64 -0.10 0.00 1.11 0.00 0.00 32.58 30.96 2dcr s HIS 34 CO 0.00 0.43 1.98 -1.54 -0.85 0.00 0.00 174.74 174.76 2dcr s SER 35 N -0.55 4.79 0.00 1.40 1.04 -1.26 -0.90 113.70 118.22 2dcr s SER 35 Ca 0.32 -1.30 0.00 0.00 0.48 0.00 0.00 55.95 55.45 2dcr s SER 35 Cb -0.20 -2.58 0.00 0.00 0.10 0.00 0.00 66.02 63.34 2dcr s SER 35 CO 0.20 -3.27 0.00 0.61 0.98 0.00 0.00 173.24 171.76 2dcr n GLY 36 N 6.11 0.53 3.74 7.32 0.00 0.26 -4.83 105.19 118.32 2dcr n GLY 36 Ca 0.43 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 46.04 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 0.00 6.39 0.06 1.61 1.01 -0.08 -0.90 116.67 124.77 2dcr s ASP 37 Ca 0.00 2.91 0.01 0.00 0.71 0.00 0.00 52.55 56.18 2dcr s ASP 37 Cb 0.00 -2.63 -0.04 0.00 1.01 0.00 0.00 42.92 41.27 2dcr s ASP 37 CO 0.00 -0.92 -0.05 0.72 0.21 0.00 0.00 175.17 175.13 2dcr s PHE 38 N 0.29 0.65 0.18 4.23 -0.12 -0.32 -1.26 117.98 121.63 2dcr s PHE 38 Ca 0.66 -0.83 -0.11 0.00 -0.05 0.00 0.00 56.93 56.59 2dcr s PHE 38 Cb -0.48 -0.41 0.00 0.00 -0.63 0.00 0.00 43.02 41.50 2dcr s PHE 38 CO 0.44 -0.21 0.36 -0.48 -0.05 0.00 0.00 175.22 175.27 2dcr s LEU 39 N -2.52 0.70 -0.60 -1.99 0.05 0.04 -1.84 118.68 112.52 2dcr s LEU 39 Ca 0.03 -0.77 0.04 0.00 0.05 0.00 0.00 54.13 53.48 2dcr s LEU 39 Cb 0.01 1.47 0.16 0.00 -2.05 0.00 0.00 46.19 45.78 2dcr s LEU 39 CO -0.05 -0.94 0.39 -0.69 -0.55 0.00 0.00 176.35 174.51 2dcr s VAL 40 N -3.94 2.31 0.49 1.48 1.01 -0.44 -1.83 120.40 119.48 2dcr s VAL 40 Ca 0.15 -3.66 -0.08 0.00 0.00 0.00 0.00 61.98 58.40 2dcr s VAL 40 Cb 0.02 -2.55 -0.04 0.00 0.00 0.00 0.00 36.38 33.81 2dcr s VAL 40 CO -0.00 -0.98 0.84 0.00 0.00 0.00 0.00 175.10 174.95 2dcr s ARG 41 N -0.80 3.62 0.67 2.72 1.70 -0.59 -4.33 118.95 121.95 2dcr s ARG 41 Ca 0.23 0.39 -0.10 0.00 -0.47 0.00 0.00 55.73 55.78 2dcr s ARG 41 Cb -0.10 -2.31 0.01 0.00 -0.57 0.00 0.00 34.95 31.97 2dcr s ARG 41 CO -0.12 -0.24 1.05 -2.00 -1.08 0.00 0.00 175.30 172.91 2dcr s GLU 42 N -4.61 2.93 1.20 3.89 -6.30 -0.70 -0.09 118.70 115.02 2dcr s GLU 42 Ca 0.50 0.38 -0.20 0.00 -2.50 0.00 0.00 54.97 53.15 2dcr s GLU 42 Cb -0.10 -2.08 0.31 0.00 0.00 0.00 0.00 34.13 32.26 2dcr s GLU 42 CO 0.43 -0.93 0.77 0.45 0.02 0.00 0.00 175.26 176.01 2dcr n SER 43 N -2.90 -3.45 -3.32 -1.70 2.88 -0.12 -4.21 113.62 100.80 2dcr n SER 43 Ca 0.06 -0.81 -0.33 0.00 -1.33 0.00 0.00 58.87 56.47 2dcr n SER 43 Cb 0.57 -0.84 -0.02 0.00 -0.75 0.00 0.00 64.21 63.17 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 -5.04 2.81 -2.08 -1.46 0.00 -1.26 -4.47 117.38 105.88 2dcr n GLN 44 Ca 0.12 -1.91 -0.05 0.00 0.00 0.00 0.00 57.00 55.16 2dcr n GLN 44 Cb 0.50 -2.71 0.02 0.00 0.00 0.00 0.00 30.24 28.05 2dcr n GLN 44 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2dcr n GLY 45 N 3.78 0.16 0.00 2.61 0.00 -1.26 -5.09 105.19 105.38 2dcr n GLY 45 Ca 0.60 0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.63 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 -2.01 2.45 -2.44 1.61 4.76 -1.26 -5.08 118.16 116.19 2dcr n LYS 46 Ca -0.02 0.00 -0.15 0.00 -2.87 0.00 0.00 58.31 55.27 2dcr n LYS 46 Cb 0.54 0.00 0.03 0.00 -1.84 0.00 0.00 35.03 33.76 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 0.00 2.65 -3.77 1.97 6.02 -1.26 -4.89 117.38 118.10 2dcr n GLN 47 Ca 0.00 -3.88 -0.13 0.00 -0.01 0.00 0.00 57.00 52.98 2dcr n GLN 47 Cb 0.00 -1.92 -0.13 0.00 1.02 0.00 0.00 30.24 29.21 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 -3.60 0.21 0.37 -1.09 2.56 -1.26 -5.08 118.70 110.81 2dcr s GLU 48 Ca 0.40 0.39 0.04 0.00 0.00 0.00 0.00 54.97 55.79 2dcr s GLU 48 Cb 0.38 -0.00 -0.01 0.00 2.00 0.00 0.00 34.13 36.50 2dcr s GLU 48 CO -0.02 -0.09 0.54 0.71 -0.56 0.00 0.00 175.26 175.83 2dcr s TYR 49 N 0.65 3.20 -0.08 5.30 2.02 -1.26 -0.95 117.35 126.23 2dcr s TYR 49 Ca -0.04 -0.01 0.00 0.00 -0.37 0.00 0.00 57.07 56.65 2dcr s TYR 49 Cb -0.06 -2.07 0.02 0.00 -0.40 0.00 0.00 41.96 39.46 2dcr s TYR 49 CO -0.04 -0.09 -0.06 0.08 -1.57 0.00 0.00 175.55 173.87 2dcr s VAL 50 N -2.30 0.79 0.01 0.71 1.01 0.88 -1.00 120.40 120.49 2dcr s VAL 50 Ca 0.45 -0.19 -0.30 0.00 0.00 0.00 0.00 61.98 61.93 2dcr s VAL 50 Cb -0.10 -0.82 -0.05 0.00 0.00 0.00 0.00 36.38 35.41 2dcr s VAL 50 CO 0.34 0.31 1.30 -0.22 0.00 0.00 0.00 175.10 176.82 2dcr s LEU 51 N 1.38 4.32 -0.25 3.92 2.96 0.52 -1.54 118.68 130.00 2dcr s LEU 51 Ca -0.02 2.03 0.01 0.00 -0.22 0.00 0.00 54.13 55.93 2dcr s LEU 51 Cb -0.13 -3.57 0.07 0.00 0.50 0.00 0.00 46.19 43.05 2dcr s LEU 51 CO -0.03 -0.62 -0.04 -0.44 -1.32 0.00 0.00 176.35 173.90 2dcr s SER 52 N 1.49 4.01 0.03 3.68 0.01 -0.76 -1.24 113.70 120.92 2dcr s SER 52 Ca 0.61 -1.31 0.05 0.00 1.31 0.00 0.00 55.95 56.61 2dcr s SER 52 Cb -0.30 -1.25 -0.02 0.00 0.21 0.00 0.00 66.02 64.67 2dcr s SER 52 CO 0.26 -0.25 -0.14 0.54 0.41 0.00 0.00 173.24 174.06 2dcr s VAL 53 N 1.33 1.14 -0.22 3.43 0.11 -1.14 -0.78 120.40 124.26 2dcr s VAL 53 Ca -0.04 -0.94 -0.16 0.00 -2.93 0.00 0.00 61.98 57.91 2dcr s VAL 53 Cb -0.19 -1.02 -0.04 0.00 -1.53 0.00 0.00 36.38 33.61 2dcr s VAL 53 CO -0.07 0.07 0.42 -0.22 -3.33 0.00 0.00 175.10 171.97 2dcr s LEU 54 N -0.99 4.12 -0.16 2.54 2.96 -0.39 -1.29 118.68 125.47 2dcr s LEU 54 Ca 0.03 0.49 -0.01 0.00 -0.22 0.00 0.00 54.13 54.41 2dcr s LEU 54 Cb -0.07 -2.54 0.05 0.00 0.50 0.00 0.00 46.19 44.13 2dcr s LEU 54 CO 0.01 -0.14 -0.01 0.86 -1.32 0.00 0.00 176.35 175.75 2dcr s TRP 55 N 1.63 1.31 -1.34 5.38 -0.11 0.11 -0.57 118.94 125.35 2dcr s TRP 55 Ca 0.19 -0.86 -0.05 0.00 1.22 0.00 0.00 56.10 56.60 2dcr s TRP 55 Cb -0.15 -1.13 -0.00 0.00 -1.50 0.00 0.00 33.47 30.69 2dcr s TRP 55 CO 0.09 -0.57 0.52 -3.47 -4.62 0.00 0.00 176.95 168.90 2dcr n ASP 56 N 4.98 -1.48 -1.58 5.86 2.03 -1.26 -2.16 116.55 122.93 2dcr n ASP 56 Ca -0.10 -1.00 -0.16 0.00 0.52 0.00 0.00 54.79 54.05 2dcr n ASP 56 Cb 0.48 -3.17 -0.03 0.00 -0.72 0.00 0.00 41.12 37.67 2dcr n ASP 56 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2dcr n GLY 57 N -1.89 0.54 2.89 0.27 0.00 -1.26 -4.98 105.19 100.76 2dcr n GLY 57 Ca -0.26 -0.23 -0.30 0.00 0.00 0.00 0.00 46.02 45.23 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 -4.23 2.43 -1.12 0.99 2.96 -0.92 -5.06 118.68 113.74 2dcr s LEU 58 Ca 0.00 -1.22 -0.23 0.00 -0.22 0.00 0.00 54.13 52.47 2dcr s LEU 58 Cb 0.00 -1.08 -0.07 0.00 0.50 0.00 0.00 46.19 45.54 2dcr s LEU 58 CO 0.00 -0.27 1.92 -2.16 -1.32 0.00 0.00 176.35 174.52 2dcr s PRO 59 N 1.46 2.60 0.82 0.98 0.04 -1.26 -0.71 135.00 138.92 2dcr s PRO 59 Ca -0.03 -1.00 -0.13 0.00 0.04 0.00 0.00 61.00 59.89 2dcr s PRO 59 Cb -0.18 -5.22 0.09 0.00 0.04 0.00 0.00 34.50 29.23 2dcr s PRO 59 CO -0.08 -3.73 1.19 1.03 0.04 0.00 0.00 177.00 175.45 2dcr s ARG 60 N 6.47 1.60 -0.20 4.56 1.81 -0.41 -4.86 118.95 127.92 2dcr s ARG 60 Ca 0.68 1.70 -0.02 0.00 -1.72 0.00 0.00 55.73 56.37 2dcr s ARG 60 Cb -0.02 -1.78 0.06 0.00 -0.45 0.00 0.00 34.95 32.76 2dcr s ARG 60 CO 0.09 -2.23 0.01 -3.38 -0.68 0.00 0.00 175.30 169.12 2dcr s HIS 61 N -2.24 1.35 -0.22 -0.53 -3.43 -1.26 -2.89 115.29 106.07 2dcr s HIS 61 Ca 0.72 -1.07 0.02 0.00 -0.80 0.00 0.00 55.06 53.93 2dcr s HIS 61 Cb -0.27 -1.16 0.04 0.00 -1.43 0.00 0.00 32.58 29.76 2dcr s HIS 61 CO 0.51 -0.65 -0.14 -0.06 -2.00 0.00 0.00 174.74 172.40 2dcr s PHE 62 N 1.75 3.02 0.20 0.38 0.08 -0.37 -4.98 117.98 118.06 2dcr s PHE 62 Ca -0.02 -2.01 -0.31 0.00 0.12 0.00 0.00 56.93 54.71 2dcr s PHE 62 Cb -0.17 -1.90 -0.16 0.00 -0.57 0.00 0.00 43.02 40.22 2dcr s PHE 62 CO -0.07 -0.84 1.03 -0.89 -0.10 0.00 0.00 175.22 174.34 2dcr n ILE 63 N 4.52 1.33 -1.80 0.64 2.08 -1.26 -0.35 119.36 124.52 2dcr n ILE 63 Ca -0.17 -0.33 -0.39 0.00 0.56 0.00 0.00 62.75 62.42 2dcr n ILE 63 Cb 0.45 -0.75 0.03 0.00 -0.75 0.00 0.00 39.64 38.63 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 -0.55 2.10 1.09 1.39 -1.09 -0.17 -4.68 121.20 119.29 2dcr s ILE 64 Ca 0.68 0.08 -0.12 0.00 -2.23 0.00 0.00 60.65 59.06 2dcr s ILE 64 Cb -0.83 -3.04 0.24 0.00 -1.58 0.00 0.00 42.46 37.25 2dcr s ILE 64 CO 0.55 0.00 1.06 -1.10 -1.23 0.00 0.00 174.94 174.23 2dcr s GLN 65 N -2.73 -0.35 0.12 2.79 1.11 -1.26 -4.89 119.66 114.45 2dcr s GLN 65 Ca 0.67 1.09 -0.25 0.00 0.01 0.00 0.00 55.36 56.88 2dcr s GLN 65 Cb -0.41 -1.60 0.07 0.00 -1.01 0.00 0.00 33.01 30.06 2dcr s GLN 65 CO 0.51 -3.42 0.86 0.45 0.01 0.00 0.00 175.29 173.69 2dcr s SER 66 N -2.53 -0.30 0.00 5.90 0.15 -1.26 -4.77 113.70 110.89 2dcr s SER 66 Ca 0.68 -0.26 0.00 0.00 0.70 0.00 0.00 55.95 57.07 2dcr s SER 66 Cb -0.24 0.51 0.00 0.00 -1.71 0.00 0.00 66.02 64.57 2dcr s SER 66 CO 0.63 -0.89 0.00 0.00 1.20 0.00 0.00 173.24 174.18 2dcr n LEU 67 N -0.39 0.00 0.01 3.45 -0.00 -1.13 -4.78 117.00 114.17 2dcr n LEU 67 Ca -0.08 0.00 -0.01 0.00 -0.00 0.00 0.00 56.01 55.92 2dcr n LEU 67 Cb 0.61 0.00 -0.01 0.00 -0.00 0.00 0.00 43.42 44.03 2dcr n LEU 67 CO 0.13 0.00 0.07 0.44 -0.00 0.00 0.00 177.39 178.03 2dcr h ASP 68 N 0.00 -0.07 0.00 1.45 5.19 -2.03 -3.45 116.42 117.50 2dcr h ASP 68 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2dcr h ASP 68 Cb 0.00 0.02 0.00 0.00 0.18 0.00 0.00 39.33 39.53 2dcr h ASP 68 CO 0.00 0.15 0.00 -3.20 -3.12 0.00 0.00 179.24 173.07 2dcr n ASN 69 N -3.38 0.00 -3.78 6.45 2.85 -1.26 -5.10 115.26 111.04 2dcr n ASN 69 Ca -0.01 -1.00 -0.24 0.00 -0.11 0.00 0.00 54.58 53.22 2dcr n ASN 69 Cb 0.03 0.00 -0.07 0.00 1.24 0.00 0.00 39.78 40.99 2dcr n ASN 69 CO 0.00 0.00 0.00 0.18 -2.11 0.00 0.00 177.26 175.33 2dcr n LEU 70 N 0.00 0.00 -3.82 1.20 4.77 -1.26 -4.70 117.00 113.19 2dcr n LEU 70 Ca 0.00 -3.03 -0.21 0.00 -0.03 0.00 0.00 56.01 52.74 2dcr n LEU 70 Cb 0.40 1.02 -0.17 0.00 -2.33 0.00 0.00 43.42 42.33 2dcr n LEU 70 CO 0.00 -0.47 -0.39 -0.31 -1.33 0.00 0.00 177.39 174.89 2dcr s TYR 71 N -3.04 0.66 -0.01 -1.77 2.02 -0.71 -2.82 117.35 111.68 2dcr s TYR 71 Ca 0.20 -0.17 0.01 0.00 -0.37 0.00 0.00 57.07 56.74 2dcr s TYR 71 Cb 0.01 -0.71 0.01 0.00 -0.40 0.00 0.00 41.96 40.87 2dcr s TYR 71 CO 0.14 -0.26 -0.01 -0.98 -1.57 0.00 0.00 175.55 172.88 2dcr s ARG 72 N 1.49 0.21 0.03 -0.62 1.04 -1.26 -2.09 118.95 117.74 2dcr s ARG 72 Ca -0.02 0.01 0.00 0.00 -1.04 0.00 0.00 55.73 54.67 2dcr s ARG 72 Cb -0.13 -0.30 0.00 0.00 -2.04 0.00 0.00 34.95 32.48 2dcr s ARG 72 CO -0.03 -0.04 0.00 -0.11 -0.04 0.00 0.00 175.30 175.08 2dcr n LEU 73 N 3.57 0.08 -0.01 -1.89 7.94 -1.26 -4.74 117.00 120.69 2dcr n LEU 73 Ca -0.20 0.05 -0.01 0.00 -1.11 0.00 0.00 56.01 54.75 2dcr n LEU 73 Cb 0.55 0.00 -0.00 0.00 0.53 0.00 0.00 43.42 44.50 2dcr n LEU 73 CO 0.24 -0.32 -0.05 1.21 -1.11 0.00 0.00 177.39 177.36 2dcr n GLU 74 N -2.88 0.04 0.00 1.96 4.07 -1.26 -4.94 120.64 117.64 2dcr n GLU 74 Ca 0.00 0.07 0.00 0.00 -0.06 0.00 0.00 57.16 57.17 2dcr n GLU 74 Cb 0.22 -0.62 0.00 0.00 -0.06 0.00 0.00 31.44 30.98 2dcr n GLU 74 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2dcr n GLY 75 N 1.55 1.61 3.47 8.31 0.00 -1.26 -5.10 105.19 113.77 2dcr n GLY 75 Ca -0.01 -1.72 -0.29 0.00 0.00 0.00 0.00 46.02 44.00 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 3.10 -1.40 0.60 1.61 -1.05 -1.26 -4.84 118.70 115.46 2dcr s GLU 76 Ca 0.00 0.50 -0.12 0.00 -0.15 0.00 0.00 54.97 55.19 2dcr s GLU 76 Cb 0.00 -1.53 -0.05 0.00 -0.44 0.00 0.00 34.13 32.12 2dcr s GLU 76 CO 0.00 -3.95 1.02 0.20 0.95 0.00 0.00 175.26 173.48 2dcr s GLY 77 N -2.93 1.77 0.17 -3.83 0.00 -1.26 -4.50 107.32 96.73 2dcr s GLY 77 Ca 0.68 -0.00 0.07 0.00 0.00 0.00 0.00 44.72 45.47 2dcr s GLY 77 CO 0.61 0.27 -0.14 -1.36 0.00 0.00 0.00 173.10 172.48 2dcr s PHE 78 N -3.02 1.58 -0.99 1.90 0.40 -0.89 -4.86 117.98 112.11 2dcr s PHE 78 Ca 0.56 -0.58 0.27 0.00 -0.60 0.00 0.00 56.93 56.58 2dcr s PHE 78 Cb -0.11 -0.78 1.12 0.00 0.51 0.00 0.00 43.02 43.77 2dcr s PHE 78 CO 0.48 0.25 1.85 -0.35 0.70 0.00 0.00 175.22 178.15 2dcr n PRO 79 N 0.02 0.01 -4.20 0.24 -0.04 -1.26 -1.74 135.00 128.03 2dcr n PRO 79 Ca -0.11 0.05 -0.20 0.00 -0.04 0.00 0.00 63.50 63.20 2dcr n PRO 79 Cb 0.59 -1.51 -0.12 0.00 -0.04 0.00 0.00 33.50 32.41 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 -3.07 1.85 0.08 3.54 0.01 -1.26 -4.91 113.70 109.95 2dcr s SER 80 Ca 0.13 -0.63 -0.21 0.00 1.31 0.00 0.00 55.95 56.55 2dcr s SER 80 Cb 0.17 -0.07 -0.10 0.00 0.21 0.00 0.00 66.02 66.23 2dcr s SER 80 CO 0.49 -0.05 1.61 0.40 0.41 0.00 0.00 173.24 176.11 2dcr h ILE 81 N 4.25 1.16 0.00 1.44 2.04 -1.96 -2.85 117.51 121.60 2dcr h ILE 81 Ca -0.42 -0.50 -0.03 0.00 1.00 0.00 0.00 64.86 64.92 2dcr h ILE 81 Cb 1.19 1.19 -0.00 0.00 -0.74 0.00 0.00 36.82 38.46 2dcr h ILE 81 CO 0.40 0.16 -0.13 1.55 0.00 0.00 0.00 178.15 180.13 2dcr h PRO 82 N 0.10 0.00 -0.53 2.37 0.13 -1.89 -0.36 132.00 131.83 2dcr h PRO 82 Ca 0.05 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.14 2dcr h PRO 82 Cb 0.19 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.29 2dcr h PRO 82 CO -0.00 0.13 0.17 -0.07 -0.23 0.00 0.00 178.00 178.00 2dcr h LEU 83 N 0.00 0.76 -0.39 1.56 3.38 -1.60 -2.69 115.31 116.33 2dcr h LEU 83 Ca -0.00 -0.20 -0.15 0.00 0.09 0.00 0.00 57.88 57.62 2dcr h LEU 83 Cb 0.23 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 2dcr h LEU 83 CO 0.02 0.75 -0.32 0.25 0.09 0.00 0.00 178.44 179.23 2dcr h LEU 84 N 0.72 0.96 -0.65 1.67 7.12 -0.92 -2.91 115.31 121.31 2dcr h LEU 84 Ca 0.17 -0.45 0.13 0.00 0.13 0.00 0.00 57.88 57.86 2dcr h LEU 84 Cb 0.26 -0.27 -0.10 0.00 -0.53 0.00 0.00 40.66 40.03 2dcr h LEU 84 CO -0.01 1.21 0.12 0.40 -0.13 0.00 0.00 178.44 180.03 2dcr h ILE 85 N 0.72 0.58 -0.69 4.05 1.08 -1.06 -1.92 117.51 120.28 2dcr h ILE 85 Ca 0.07 -0.08 -0.08 0.00 -0.39 0.00 0.00 64.86 64.38 2dcr h ILE 85 Cb 0.91 0.32 -0.03 0.00 -3.07 0.00 0.00 36.82 34.95 2dcr h ILE 85 CO 0.08 0.04 0.12 -0.78 -0.69 0.00 0.00 178.15 176.93 2dcr h ASP 86 N 0.24 1.08 0.66 1.72 3.58 -1.28 0.28 116.42 122.70 2dcr h ASP 86 Ca 0.35 -0.26 0.00 0.00 0.42 0.00 0.00 57.03 57.54 2dcr h ASP 86 Cb 0.55 -0.29 0.00 0.00 1.72 0.00 0.00 39.33 41.31 2dcr h ASP 86 CO -0.46 1.06 0.00 1.57 -2.88 0.00 0.00 179.24 178.54 2dcr n HIS 87 N -4.21 0.00 -0.01 0.28 -0.00 -0.89 -0.24 115.22 110.14 2dcr n HIS 87 Ca 0.05 0.00 -0.17 0.00 0.46 0.00 0.00 57.72 58.05 2dcr n HIS 87 Cb 0.29 -0.38 -0.14 0.00 -0.12 0.00 0.00 29.99 29.64 2dcr n HIS 87 CO 0.00 0.00 0.00 1.28 0.46 0.00 0.00 176.34 178.08 2dcr n LEU 88 N -1.38 2.08 -0.02 0.27 4.77 -0.77 -4.20 117.00 117.75 2dcr n LEU 88 Ca 0.10 0.24 -0.16 0.00 -0.03 0.00 0.00 56.01 56.16 2dcr n LEU 88 Cb 0.25 -0.69 -0.10 0.00 -2.33 0.00 0.00 43.42 40.55 2dcr n LEU 88 CO 0.22 0.72 0.36 0.25 -1.33 0.00 0.00 177.39 177.60 2dcr h LEU 89 N 0.05 0.48 -0.01 2.23 6.46 -0.01 0.14 115.31 124.63 2dcr h LEU 89 Ca -0.40 -0.70 0.00 0.00 -0.12 0.00 0.00 57.88 56.67 2dcr h LEU 89 Cb 2.03 -0.14 0.00 0.00 -0.73 0.00 0.00 40.66 41.82 2dcr h LEU 89 CO 0.07 1.10 -0.01 -0.24 -0.62 0.00 0.00 178.44 178.74 2dcr n SER 90 N -4.32 0.03 -0.03 1.25 2.88 0.67 -3.01 113.62 111.08 2dcr n SER 90 Ca -0.09 -0.16 -0.02 0.00 -1.33 0.00 0.00 58.87 57.28 2dcr n SER 90 Cb 0.58 -0.27 -0.07 0.00 -0.75 0.00 0.00 64.21 63.70 2dcr n SER 90 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 2dcr n THR 91 N -1.27 0.41 -2.91 2.46 -2.24 -1.21 -5.03 114.28 104.48 2dcr n THR 91 Ca 0.14 -0.31 -0.13 0.00 -2.27 0.00 0.00 64.05 61.47 2dcr n THR 91 Cb 0.24 -0.46 0.03 0.00 -2.10 0.00 0.00 70.33 68.05 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 -2.17 -3.71 -2.62 -0.78 1.13 0.41 -5.03 117.38 104.61 2dcr n GLN 92 Ca -0.10 0.50 -0.31 0.00 -1.94 0.00 0.00 57.00 55.15 2dcr n GLN 92 Cb 0.62 -4.51 -0.03 0.00 0.11 0.00 0.00 30.24 26.43 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 -5.48 3.81 0.57 -1.09 -0.21 -0.80 -4.81 119.66 111.65 2dcr s GLN 93 Ca 0.26 0.63 -0.10 0.00 0.02 0.00 0.00 55.36 56.16 2dcr s GLN 93 Cb -0.11 -2.28 -0.04 0.00 1.00 0.00 0.00 33.01 31.57 2dcr s GLN 93 CO 0.32 -0.16 0.96 -1.25 -2.12 0.00 0.00 175.29 173.04 2dcr s PRO 94 N -4.08 3.64 -0.05 2.91 0.04 -1.26 -4.13 135.00 132.06 2dcr s PRO 94 Ca 0.54 0.65 0.14 0.00 0.04 0.00 0.00 61.00 62.37 2dcr s PRO 94 Cb -0.10 -2.16 -0.22 0.00 0.04 0.00 0.00 34.50 32.05 2dcr s PRO 94 CO 0.34 -0.44 0.59 1.28 0.04 0.00 0.00 177.00 178.82 2dcr n LEU 95 N -2.45 0.74 -3.72 -3.56 4.77 -0.31 -4.50 117.00 107.98 2dcr n LEU 95 Ca 0.05 0.35 -0.14 0.00 -0.03 0.00 0.00 56.01 56.24 2dcr n LEU 95 Cb 0.54 0.21 -0.08 0.00 -2.33 0.00 0.00 43.42 41.75 2dcr n LEU 95 CO 0.55 0.37 0.10 0.28 -1.33 0.00 0.00 177.39 177.37 2dcr s THR 96 N -2.63 0.04 -0.33 -5.08 -1.32 -1.26 -4.87 115.64 100.19 2dcr s THR 96 Ca -0.05 -0.33 0.23 0.00 -1.21 0.00 0.00 61.69 60.33 2dcr s THR 96 Cb 0.08 -0.68 0.24 0.00 -1.51 0.00 0.00 72.50 70.63 2dcr s THR 96 CO 0.82 -0.18 1.71 0.29 -2.21 0.00 0.00 174.62 175.05 2dcr n LYS 97 N 1.42 0.18 0.00 7.08 4.76 -1.26 -1.89 118.16 128.45 2dcr n LYS 97 Ca -0.20 0.53 0.00 0.00 -2.87 0.00 0.00 58.31 55.76 2dcr n LYS 97 Cb 0.56 -1.93 0.00 0.00 -1.84 0.00 0.00 35.03 31.82 2dcr n LYS 97 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 2dcr n LYS 98 N -2.29 0.00 0.00 1.97 4.76 -1.26 -4.71 118.16 116.63 2dcr n LYS 98 Ca 0.00 0.00 0.14 0.00 -2.87 0.00 0.00 58.31 55.59 2dcr n LYS 98 Cb 0.15 -0.14 0.65 0.00 -1.84 0.00 0.00 35.03 33.84 2dcr n LYS 98 CO 0.00 0.00 0.00 0.43 -1.37 0.00 0.00 177.40 176.46 2dcr n SER 99 N -0.08 0.82 -0.66 4.39 7.64 -1.25 -4.90 113.62 119.57 2dcr n SER 99 Ca 0.00 -1.10 -0.08 0.00 1.01 0.00 0.00 58.87 58.70 2dcr n SER 99 Cb 0.00 -0.01 -0.03 0.00 -1.01 0.00 0.00 64.21 63.16 2dcr n SER 99 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dcr n GLY 100 N 1.17 0.77 3.67 0.23 0.00 -0.79 -4.86 105.19 105.38 2dcr n GLY 100 Ca 0.19 0.00 -0.56 0.00 0.00 0.00 0.00 46.02 45.64 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 -1.99 0.19 -4.13 1.61 0.31 -1.26 -4.49 118.33 108.57 2dcr n VAL 101 Ca -0.08 -0.03 -0.25 0.00 -0.01 0.00 0.00 64.34 63.97 2dcr n VAL 101 Cb 0.52 -1.03 -0.06 0.00 -0.91 0.00 0.00 33.84 32.36 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 2.50 4.28 0.14 2.52 -7.23 -1.26 -1.16 120.40 120.19 2dcr s VAL 102 Ca 0.94 -1.30 -0.29 0.00 -1.81 0.00 0.00 61.98 59.53 2dcr s VAL 102 Cb -1.06 -3.23 -0.07 0.00 0.56 0.00 0.00 36.38 32.58 2dcr s VAL 102 CO 0.61 -0.20 0.92 -0.76 -0.31 0.00 0.00 175.10 175.35 2dcr s LEU 103 N -3.35 4.54 0.00 1.32 1.43 -1.26 -4.79 118.68 116.57 2dcr s LEU 103 Ca 0.31 1.79 0.00 0.00 -1.03 0.00 0.00 54.13 55.20 2dcr s LEU 103 Cb -0.09 -3.53 0.00 0.00 0.03 0.00 0.00 46.19 42.60 2dcr s LEU 103 CO 0.23 0.02 0.00 1.41 0.23 0.00 0.00 176.35 178.24 2dcr n HIS 104 N 2.37 0.00 -3.81 0.29 8.25 -1.14 -4.77 115.22 116.41 2dcr n HIS 104 Ca 0.00 0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.34 2dcr n HIS 104 Cb 0.49 0.00 -0.11 0.00 1.12 0.00 0.00 29.99 31.49 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 0.36 -0.13 -0.41 6.06 -0.08 -4.93 118.95 118.83 2dcr s ARG 105 Ca 0.00 0.11 -0.02 0.00 -2.50 0.00 0.00 55.73 53.32 2dcr s ARG 105 Cb 0.00 0.16 -0.03 0.00 0.06 0.00 0.00 34.95 35.15 2dcr s ARG 105 CO 0.00 -0.07 -0.06 0.00 -2.50 0.00 0.00 175.30 172.68 2dcr s ALA 106 N -0.36 2.95 -0.43 6.12 0.00 -1.26 -1.17 121.76 127.61 2dcr s ALA 106 Ca -0.05 -0.85 -0.29 0.00 0.00 0.00 0.00 51.96 50.78 2dcr s ALA 106 Cb -0.03 -1.42 0.02 0.00 0.00 0.00 0.00 23.12 21.69 2dcr s ALA 106 CO 0.01 0.33 1.15 0.08 0.00 0.00 0.00 175.76 177.33 2dcr s VAL 107 N 0.01 4.24 -0.55 0.00 1.01 -0.77 -4.87 120.40 119.48 2dcr s VAL 107 Ca -0.00 1.32 -0.21 0.00 0.00 0.00 0.00 61.98 63.08 2dcr s VAL 107 Cb -0.14 -4.52 0.06 0.00 0.00 0.00 0.00 36.38 31.78 2dcr s VAL 107 CO 0.03 -0.86 0.79 -2.16 0.00 0.00 0.00 175.10 172.90 2dcr s PRO 108 N 4.31 3.18 0.03 2.72 0.04 -1.26 -3.57 135.00 140.46 2dcr s PRO 108 Ca 0.49 -0.71 0.23 0.00 0.04 0.00 0.00 61.00 61.05 2dcr s PRO 108 Cb -0.09 -4.12 0.08 0.00 0.04 0.00 0.00 34.50 30.41 2dcr s PRO 108 CO 0.28 -1.43 1.07 0.45 0.04 0.00 0.00 177.00 177.40 2dcr n SER 109 N 6.87 0.65 0.00 6.66 2.88 0.27 -5.01 113.62 125.93 2dcr n SER 109 Ca -0.04 -0.36 0.00 0.00 -1.33 0.00 0.00 58.87 57.14 2dcr n SER 109 Cb 0.46 0.75 0.00 0.00 -0.75 0.00 0.00 64.21 64.67 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 1.42 1.17 0.17 0.46 0.00 -1.26 -4.86 105.19 102.30 2dcr n GLY 110 Ca 0.03 -2.23 -0.06 0.00 0.00 0.00 0.00 46.02 43.76 2dcr n GLY 110 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dcr h PRO 111 N 0.00 0.29 -3.66 1.61 0.13 -1.88 -3.38 132.00 125.11 2dcr h PRO 111 Ca 0.00 -0.20 -0.62 0.00 -0.87 0.00 0.00 66.00 64.31 2dcr h PRO 111 Cb 0.00 0.03 -0.40 0.00 0.13 0.00 0.00 31.00 30.76 2dcr h PRO 111 CO 0.00 0.82 -0.72 -1.12 -0.23 0.00 0.00 178.00 176.74 2dcr s SER 112 N -6.91 4.15 -0.20 1.44 0.01 -1.26 -4.19 113.70 106.74 2dcr s SER 112 Ca -0.04 -2.23 -0.42 0.00 1.31 0.00 0.00 55.95 54.56 2dcr s SER 112 Cb 0.12 -1.21 -0.19 0.00 0.21 0.00 0.00 66.02 64.95 2dcr s SER 112 CO 0.81 -0.34 1.42 -0.24 0.41 0.00 0.00 173.24 175.30 2dcr n SER 113 N 4.09 1.14 0.00 2.44 2.88 -1.26 -5.10 113.62 117.81 2dcr n SER 113 Ca 0.03 1.15 0.00 0.00 -1.33 0.00 0.00 58.87 58.72 2dcr n SER 113 Cb 0.39 -1.00 0.00 0.00 -0.75 0.00 0.00 64.21 62.85 2dcr n SER 113 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42