#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 0.00 -4.68 1.61 7.64 -1.26 -5.14 113.62 111.79 2dcr n SER 2 Ca 0.00 -0.45 -0.29 0.00 1.01 0.00 0.00 58.87 59.14 2dcr n SER 2 Cb 0.00 0.00 0.17 0.00 -1.01 0.00 0.00 64.21 63.37 2dcr n SER 2 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2dcr s SER 3 N 0.00 2.74 0.00 6.43 0.15 -1.26 -5.03 113.70 116.73 2dcr s SER 3 Ca 0.00 1.22 0.00 0.00 0.70 0.00 0.00 55.95 57.87 2dcr s SER 3 Cb 0.00 -1.88 0.00 0.00 -1.71 0.00 0.00 66.02 62.43 2dcr s SER 3 CO 0.00 -3.07 0.00 0.61 1.20 0.00 0.00 173.24 171.98 2dcr n GLY 4 N -1.12 2.01 0.34 9.45 0.00 -1.26 -4.96 105.19 109.65 2dcr n GLY 4 Ca 0.05 0.14 0.20 0.00 0.00 0.00 0.00 46.02 46.41 2dcr n GLY 4 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2dcr h SER 5 N 0.00 0.00 -1.06 1.61 0.02 -2.10 -3.45 113.55 108.58 2dcr h SER 5 Ca 0.00 0.00 -0.42 0.00 -0.84 0.00 0.00 61.79 60.53 2dcr h SER 5 Cb 0.00 0.00 -0.16 0.00 0.14 0.00 0.00 62.40 62.38 2dcr h SER 5 CO 0.00 0.00 -0.39 -1.20 -1.14 0.00 0.00 176.83 174.10 2dcr n SER 6 N -3.01 -5.48 -4.55 3.07 7.64 -1.26 -4.89 113.62 105.14 2dcr n SER 6 Ca -0.03 0.50 -0.41 0.00 1.01 0.00 0.00 58.87 59.94 2dcr n SER 6 Cb 0.18 -4.83 -0.03 0.00 -1.01 0.00 0.00 64.21 58.52 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 -2.74 1.30 -0.08 0.23 0.00 -1.26 -4.75 107.32 100.01 2dcr s GLY 7 Ca 0.00 -2.25 0.13 0.00 0.00 0.00 0.00 44.72 42.60 2dcr s GLY 7 CO 0.00 2.62 1.32 1.18 0.00 0.00 0.00 173.10 178.22 2dcr n GLU 8 N 8.70 2.89 -0.21 2.90 1.02 -1.26 -4.70 120.64 129.98 2dcr n GLU 8 Ca 0.30 -2.38 0.02 0.00 -0.02 0.00 0.00 57.16 55.08 2dcr n GLU 8 Cb 0.51 -1.51 0.12 0.00 -0.02 0.00 0.00 31.44 30.54 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 1.87 0.53 0.00 2.62 2.07 -1.85 -2.17 116.25 119.31 2dcr h VAL 9 Ca 0.00 -0.06 0.00 0.00 0.82 0.00 0.00 66.70 67.46 2dcr h VAL 9 Cb 1.03 0.33 0.00 0.00 -1.52 0.00 0.00 31.29 31.13 2dcr h VAL 9 CO 0.10 0.03 -0.26 0.00 0.02 0.00 0.00 177.57 177.46 2dcr n GLN 10 N -5.22 0.05 -0.57 1.57 1.13 -1.26 -3.84 117.38 109.24 2dcr n GLN 10 Ca 0.10 0.03 -0.30 0.00 -1.94 0.00 0.00 57.00 54.89 2dcr n GLN 10 Cb 0.37 -1.55 0.22 0.00 0.11 0.00 0.00 30.24 29.39 2dcr n GLN 10 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 2dcr n LYS 11 N -1.63 -1.57 -0.90 -1.09 4.76 -0.82 -5.00 118.16 111.91 2dcr n LYS 11 Ca 0.06 -0.41 -0.31 0.00 -2.87 0.00 0.00 58.31 54.78 2dcr n LYS 11 Cb 0.36 -2.24 0.15 0.00 -1.84 0.00 0.00 35.03 31.45 2dcr n LYS 11 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 2dcr s PRO 12 N -4.47 1.28 0.36 1.97 0.04 -1.26 -4.92 135.00 128.00 2dcr s PRO 12 Ca 0.68 1.32 0.04 0.00 0.04 0.00 0.00 61.00 63.08 2dcr s PRO 12 Cb -0.24 -1.77 0.70 0.00 0.04 0.00 0.00 34.50 33.23 2dcr s PRO 12 CO 0.62 -2.38 2.00 1.25 0.04 0.00 0.00 177.00 178.53 2dcr h LEU 13 N -1.67 0.67 0.00 -3.56 6.46 -1.95 -3.04 115.31 112.21 2dcr h LEU 13 Ca -0.45 -0.01 0.00 0.00 -0.12 0.00 0.00 57.88 57.30 2dcr h LEU 13 Cb 1.26 -0.16 0.00 0.00 -0.73 0.00 0.00 40.66 41.03 2dcr h LEU 13 CO 0.46 0.47 0.00 0.00 -0.62 0.00 0.00 178.44 178.75 2dcr n HIS 14 N -4.46 0.00 -0.13 1.25 1.44 -1.26 -2.08 115.22 109.99 2dcr n HIS 14 Ca 0.07 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.79 2dcr n HIS 14 Cb 0.11 -0.18 0.01 0.00 0.12 0.00 0.00 29.99 30.04 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 -1.18 2.70 -1.40 -1.40 1.02 -1.15 -4.31 120.64 114.92 2dcr n GLU 15 Ca 0.10 -1.47 -0.30 0.00 -0.02 0.00 0.00 57.16 55.48 2dcr n GLU 15 Cb 0.11 -0.98 0.11 0.00 -0.02 0.00 0.00 31.44 30.66 2dcr n GLU 15 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 2dcr s GLN 16 N -1.00 1.70 -0.25 3.49 -1.52 -0.88 -4.73 119.66 116.47 2dcr s GLN 16 Ca 0.01 0.71 -0.16 0.00 -1.95 0.00 0.00 55.36 53.97 2dcr s GLN 16 Cb 0.01 -1.87 -0.13 0.00 -0.22 0.00 0.00 33.01 30.80 2dcr s GLN 16 CO 0.00 -1.90 -0.20 1.47 -0.25 0.00 0.00 175.29 174.40 2dcr n LEU 17 N -3.63 1.93 0.00 2.90 -0.00 -1.26 -3.94 117.00 112.99 2dcr n LEU 17 Ca 0.07 0.37 0.03 0.00 -0.00 0.00 0.00 56.01 56.48 2dcr n LEU 17 Cb 0.56 -0.85 0.13 0.00 -0.00 0.00 0.00 43.42 43.25 2dcr n LEU 17 CO 0.56 0.42 0.59 -2.67 -0.00 0.00 0.00 177.39 176.30 2dcr n TRP 18 N -4.32 0.00 -2.50 1.47 4.27 -1.11 -0.74 117.44 114.51 2dcr n TRP 18 Ca -0.45 0.00 -0.41 0.00 -3.89 0.00 0.00 57.50 52.75 2dcr n TRP 18 Cb 0.80 -0.50 -0.03 0.00 -1.36 0.00 0.00 31.31 30.22 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 -3.00 2.31 -2.25 -2.67 5.04 -1.25 -0.63 117.35 114.90 2dcr s TYR 19 Ca 0.03 0.19 0.28 0.00 -2.44 0.00 0.00 57.07 55.12 2dcr s TYR 19 Cb 0.04 -4.54 1.07 0.00 0.35 0.00 0.00 41.96 38.89 2dcr s TYR 19 CO 0.11 -1.97 1.76 0.72 -1.34 0.00 0.00 175.55 174.83 2dcr n HIS 20 N 9.42 0.00 0.00 4.97 8.25 -0.46 -4.71 115.22 132.69 2dcr n HIS 20 Ca 0.07 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.53 2dcr n HIS 20 Cb 0.49 -0.04 0.00 0.00 1.12 0.00 0.00 29.99 31.56 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 1.20 1.30 3.15 -1.41 0.00 -1.26 -4.55 105.19 103.63 2dcr n GLY 21 Ca 0.18 -0.56 -0.27 0.00 0.00 0.00 0.00 46.02 45.36 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 -1.08 1.62 0.05 4.61 0.00 -1.26 -1.99 121.76 123.71 2dcr s ALA 22 Ca 0.00 -0.74 0.00 0.00 0.00 0.00 0.00 51.96 51.22 2dcr s ALA 22 Cb 0.00 -0.53 -0.03 0.00 0.00 0.00 0.00 23.12 22.56 2dcr s ALA 22 CO 0.00 0.30 -0.04 0.96 0.00 0.00 0.00 175.76 176.98 2dcr s ILE 23 N 0.01 0.30 1.16 0.00 -4.36 -1.26 -4.88 121.20 112.16 2dcr s ILE 23 Ca -0.04 -1.50 -0.16 0.00 -0.26 0.00 0.00 60.65 58.69 2dcr s ILE 23 Cb -0.12 -1.10 0.27 0.00 1.25 0.00 0.00 42.46 42.76 2dcr s ILE 23 CO 0.02 -0.78 1.05 -2.16 0.24 0.00 0.00 174.94 173.32 2dcr s PRO 24 N -2.98 -0.87 0.09 0.37 0.04 -1.26 -4.69 135.00 125.70 2dcr s PRO 24 Ca -0.00 0.40 -0.17 0.00 0.04 0.00 0.00 61.00 61.26 2dcr s PRO 24 Cb 0.01 -1.60 -0.08 0.00 0.04 0.00 0.00 34.50 32.87 2dcr s PRO 24 CO -0.06 -3.58 1.48 -0.09 0.04 0.00 0.00 177.00 174.80 2dcr h ARG 25 N -2.50 0.52 -0.97 4.56 2.43 -2.02 -3.34 114.38 113.07 2dcr h ARG 25 Ca -0.53 -0.20 0.13 0.00 -0.81 0.00 0.00 59.98 58.56 2dcr h ARG 25 Cb 1.33 -0.03 -0.08 0.00 -0.42 0.00 0.00 29.97 30.77 2dcr h ARG 25 CO 0.47 0.73 0.61 0.00 -1.51 0.00 0.00 179.97 180.27 2dcr h ALA 26 N 0.77 1.62 0.00 2.80 0.00 -2.03 -1.11 119.26 121.32 2dcr h ALA 26 Ca 0.07 0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.95 2dcr h ALA 26 Cb 0.55 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 2dcr h ALA 26 CO 0.03 0.14 -0.21 0.93 0.00 0.00 0.00 179.25 180.13 2dcr h GLU 27 N 0.90 0.00 0.22 0.00 4.39 -1.96 -3.33 114.58 114.79 2dcr h GLU 27 Ca 0.48 0.00 0.01 0.00 0.34 0.00 0.00 59.36 60.19 2dcr h GLU 27 Cb 0.56 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 29.17 2dcr h GLU 27 CO -0.25 0.21 -0.41 0.28 -1.16 0.00 0.00 179.01 177.69 2dcr h VAL 28 N 0.00 0.18 0.00 3.13 2.07 -1.35 -2.01 116.25 118.27 2dcr h VAL 28 Ca -0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 2dcr h VAL 28 Cb 0.63 0.18 0.00 0.00 -1.52 0.00 0.00 31.29 30.57 2dcr h VAL 28 CO 0.03 0.00 0.00 0.00 0.02 0.00 0.00 177.57 177.62 2dcr n ALA 29 N -2.78 1.63 0.04 1.67 0.00 -1.25 -0.18 120.51 119.63 2dcr n ALA 29 Ca -0.08 -0.05 -0.20 0.00 0.00 0.00 0.00 53.44 53.11 2dcr n ALA 29 Cb 0.38 -1.19 -0.11 0.00 0.00 0.00 0.00 19.45 18.54 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 0.67 -0.26 0.00 4.57 -1.59 -3.36 114.58 114.62 2dcr h GLU 30 Ca 0.00 -0.73 -0.20 0.00 -1.18 0.00 0.00 59.36 57.25 2dcr h GLU 30 Cb 0.15 0.21 0.00 0.00 -0.16 0.00 0.00 28.75 28.96 2dcr h GLU 30 CO 0.00 1.31 -0.60 -0.07 -1.18 0.00 0.00 179.01 178.47 2dcr h LEU 31 N 0.34 0.98 -8.77 1.64 3.38 -0.35 -3.42 115.31 109.11 2dcr h LEU 31 Ca -0.13 -0.55 -0.65 0.00 0.09 0.00 0.00 57.88 56.64 2dcr h LEU 31 Cb 1.67 -0.28 -0.20 0.00 0.09 0.00 0.00 40.66 41.95 2dcr h LEU 31 CO 0.20 1.35 -0.56 -0.76 0.09 0.00 0.00 178.44 178.76 2dcr s LEU 32 N -8.63 3.81 -0.09 1.67 1.43 -0.30 -4.90 118.68 111.68 2dcr s LEU 32 Ca -0.11 -0.14 0.04 0.00 -1.03 0.00 0.00 54.13 52.90 2dcr s LEU 32 Cb 0.10 -2.03 -0.08 0.00 0.03 0.00 0.00 46.19 44.20 2dcr s LEU 32 CO 0.90 -0.06 -0.02 0.52 0.23 0.00 0.00 176.35 177.91 2dcr n VAL 33 N 5.00 0.55 -3.94 -1.59 0.31 -1.26 -4.57 118.33 112.82 2dcr n VAL 33 Ca -0.15 -0.28 -0.35 0.00 -0.01 0.00 0.00 64.34 63.55 2dcr n VAL 33 Cb 0.51 -0.82 -0.06 0.00 -0.91 0.00 0.00 33.84 32.57 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 -2.19 3.52 -1.02 3.52 3.76 -1.26 -5.00 115.29 116.62 2dcr s HIS 34 Ca -0.08 0.40 -0.24 0.00 -0.15 0.00 0.00 55.06 54.99 2dcr s HIS 34 Cb 0.03 -1.86 -0.08 0.00 1.11 0.00 0.00 32.58 31.78 2dcr s HIS 34 CO 0.28 0.66 1.98 -1.54 -0.85 0.00 0.00 174.74 175.28 2dcr s SER 35 N -1.50 4.90 0.00 1.40 1.04 -1.26 -1.51 113.70 116.77 2dcr s SER 35 Ca 0.21 -1.04 0.00 0.00 0.48 0.00 0.00 55.95 55.60 2dcr s SER 35 Cb -0.12 -2.57 0.00 0.00 0.10 0.00 0.00 66.02 63.42 2dcr s SER 35 CO 0.11 -3.09 0.00 0.61 0.98 0.00 0.00 173.24 171.86 2dcr n GLY 36 N 6.39 0.74 3.72 7.32 0.00 -1.00 -4.93 105.19 117.43 2dcr n GLY 36 Ca 0.43 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 46.03 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 6.62 0.07 1.61 1.01 -0.57 -0.92 116.67 124.48 2dcr s ASP 37 Ca 0.00 2.59 0.02 0.00 0.71 0.00 0.00 52.55 55.88 2dcr s ASP 37 Cb 0.00 -2.60 -0.03 0.00 1.01 0.00 0.00 42.92 41.30 2dcr s ASP 37 CO 0.00 -0.79 -0.08 0.72 0.21 0.00 0.00 175.17 175.24 2dcr s PHE 38 N 0.95 0.79 0.11 4.23 -0.12 0.21 -1.72 117.98 122.44 2dcr s PHE 38 Ca 0.68 -0.66 -0.05 0.00 -0.05 0.00 0.00 56.93 56.85 2dcr s PHE 38 Cb -0.43 -0.46 -0.02 0.00 -0.63 0.00 0.00 43.02 41.48 2dcr s PHE 38 CO 0.33 -0.10 0.13 -0.48 -0.05 0.00 0.00 175.22 175.05 2dcr s LEU 39 N -2.18 1.64 -0.16 -1.99 0.05 0.08 -2.98 118.68 113.13 2dcr s LEU 39 Ca -0.01 -0.95 -0.04 0.00 0.05 0.00 0.00 54.13 53.18 2dcr s LEU 39 Cb -0.04 0.67 -0.03 0.00 -2.05 0.00 0.00 46.19 44.75 2dcr s LEU 39 CO -0.02 -0.74 -0.03 -0.69 -0.55 0.00 0.00 176.35 174.32 2dcr s VAL 40 N -3.96 3.94 0.28 1.48 1.01 0.20 -1.43 120.40 121.92 2dcr s VAL 40 Ca 0.14 -0.34 0.03 0.00 0.00 0.00 0.00 61.98 61.82 2dcr s VAL 40 Cb 0.06 -2.74 -0.06 0.00 0.00 0.00 0.00 36.38 33.65 2dcr s VAL 40 CO -0.04 0.48 0.05 0.00 0.00 0.00 0.00 175.10 175.60 2dcr s ARG 41 N 0.45 1.50 0.02 2.72 1.70 0.06 -1.36 118.95 124.05 2dcr s ARG 41 Ca -0.03 -1.81 0.01 0.00 -0.47 0.00 0.00 55.73 53.44 2dcr s ARG 41 Cb -0.14 -0.61 -0.04 0.00 -0.57 0.00 0.00 34.95 33.59 2dcr s ARG 41 CO 0.03 -0.20 0.06 -2.00 -1.08 0.00 0.00 175.30 172.11 2dcr s GLU 42 N -3.93 2.94 0.98 3.89 2.12 -0.84 0.27 118.70 124.13 2dcr s GLU 42 Ca 0.35 -0.58 -0.11 0.00 0.36 0.00 0.00 54.97 54.99 2dcr s GLU 42 Cb 0.08 -2.77 0.18 0.00 0.26 0.00 0.00 34.13 31.88 2dcr s GLU 42 CO 0.13 0.62 1.11 0.45 -0.54 0.00 0.00 175.26 177.03 2dcr s SER 43 N -1.90 2.39 -0.65 -1.70 0.15 -0.26 -4.40 113.70 107.31 2dcr s SER 43 Ca 0.24 1.97 -0.27 0.00 0.70 0.00 0.00 55.95 58.59 2dcr s SER 43 Cb -0.12 -2.48 -0.00 0.00 -1.71 0.00 0.00 66.02 61.70 2dcr s SER 43 CO 0.16 -3.40 1.67 0.00 1.20 0.00 0.00 173.24 172.87 2dcr s GLN 44 N -4.61 2.81 0.00 5.44 -2.07 -1.26 -3.96 119.66 116.01 2dcr s GLN 44 Ca 0.67 0.33 0.00 0.00 -1.82 0.00 0.00 55.36 54.54 2dcr s GLN 44 Cb -0.23 -4.32 0.00 0.00 -1.09 0.00 0.00 33.01 27.37 2dcr s GLN 44 CO 0.60 -2.55 0.00 0.41 -1.32 0.00 0.00 175.29 172.43 2dcr n GLY 45 N 5.60 0.80 3.97 2.60 0.00 -1.26 -5.00 105.19 111.89 2dcr n GLY 45 Ca 0.15 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.91 2dcr n GLY 45 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dcr s LYS 46 N -0.23 1.51 -0.71 1.61 -0.14 -1.25 -5.03 119.74 115.49 2dcr s LYS 46 Ca 0.00 -0.79 0.04 0.00 -1.36 0.00 0.00 55.97 53.86 2dcr s LYS 46 Cb 0.00 -2.19 0.29 0.00 -1.68 0.00 0.00 37.83 34.26 2dcr s LYS 46 CO 0.00 -1.64 1.00 1.04 -0.76 0.00 0.00 175.35 174.99 2dcr n GLN 47 N -3.07 3.27 -3.77 1.68 6.02 -1.26 -4.67 117.38 115.58 2dcr n GLN 47 Ca 0.14 -4.73 -0.15 0.00 -0.01 0.00 0.00 57.00 52.25 2dcr n GLN 47 Cb 0.60 -2.30 -0.16 0.00 1.02 0.00 0.00 30.24 29.40 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 -3.02 -0.02 0.47 -1.09 2.12 -1.26 -5.07 118.70 110.84 2dcr s GLU 48 Ca 0.42 0.22 -0.07 0.00 0.36 0.00 0.00 54.97 55.90 2dcr s GLU 48 Cb 0.18 -0.24 -0.04 0.00 0.26 0.00 0.00 34.13 34.29 2dcr s GLU 48 CO -0.05 -0.17 0.80 0.71 -0.54 0.00 0.00 175.26 176.01 2dcr s TYR 49 N 1.11 3.55 -0.03 5.30 2.02 -1.26 -1.10 117.35 126.93 2dcr s TYR 49 Ca -0.09 0.90 0.01 0.00 -0.37 0.00 0.00 57.07 57.53 2dcr s TYR 49 Cb -0.13 -2.36 0.01 0.00 -0.40 0.00 0.00 41.96 39.08 2dcr s TYR 49 CO -0.04 -0.27 -0.05 0.08 -1.57 0.00 0.00 175.55 173.70 2dcr s VAL 50 N -2.69 0.53 0.36 0.71 1.01 0.14 -1.07 120.40 119.39 2dcr s VAL 50 Ca 0.49 -0.17 -0.25 0.00 0.00 0.00 0.00 61.98 62.04 2dcr s VAL 50 Cb -0.10 -0.53 -0.09 0.00 0.00 0.00 0.00 36.38 35.66 2dcr s VAL 50 CO 0.43 0.20 1.00 -0.22 0.00 0.00 0.00 175.10 176.51 2dcr s LEU 51 N 0.57 4.25 -0.11 3.92 2.96 0.71 -0.76 118.68 130.22 2dcr s LEU 51 Ca -0.08 1.95 -0.02 0.00 -0.22 0.00 0.00 54.13 55.77 2dcr s LEU 51 Cb -0.11 -4.08 0.04 0.00 0.50 0.00 0.00 46.19 42.54 2dcr s LEU 51 CO 0.00 -0.27 0.01 -0.55 -1.32 0.00 0.00 176.35 174.22 2dcr s SER 52 N -1.56 2.05 -0.00 3.68 0.15 -0.51 -3.49 113.70 114.01 2dcr s SER 52 Ca 0.54 -0.34 0.06 0.00 0.70 0.00 0.00 55.95 56.90 2dcr s SER 52 Cb -0.21 -0.49 -0.02 0.00 -1.71 0.00 0.00 66.02 63.59 2dcr s SER 52 CO 0.26 -0.23 -0.19 0.54 1.20 0.00 0.00 173.24 174.83 2dcr s VAL 53 N 1.93 1.47 -0.32 4.45 0.11 -1.17 -0.74 120.40 126.13 2dcr s VAL 53 Ca 0.03 -0.87 -0.22 0.00 -2.93 0.00 0.00 61.98 57.99 2dcr s VAL 53 Cb -0.14 -1.24 0.00 0.00 -1.53 0.00 0.00 36.38 33.47 2dcr s VAL 53 CO -0.06 0.35 0.72 -0.22 -3.33 0.00 0.00 175.10 172.56 2dcr s LEU 54 N -0.61 4.13 0.00 2.54 2.96 -0.70 -1.11 118.68 125.90 2dcr s LEU 54 Ca 0.07 0.46 0.01 0.00 -0.22 0.00 0.00 54.13 54.45 2dcr s LEU 54 Cb -0.07 -2.96 -0.00 0.00 0.50 0.00 0.00 46.19 43.66 2dcr s LEU 54 CO -0.00 -0.60 -0.02 0.86 -1.32 0.00 0.00 176.35 175.26 2dcr s TRP 55 N 2.86 0.22 -1.41 5.38 -0.11 -0.70 -2.39 118.94 122.79 2dcr s TRP 55 Ca 0.29 -0.12 0.00 0.00 1.22 0.00 0.00 56.10 57.49 2dcr s TRP 55 Cb -0.14 -0.14 0.00 0.00 -1.50 0.00 0.00 33.47 31.69 2dcr s TRP 55 CO 0.14 -0.03 0.00 -0.25 -4.62 0.00 0.00 176.95 172.19 2dcr n ASP 56 N 2.77 -4.08 -0.09 5.86 8.00 -1.26 -0.56 116.55 127.20 2dcr n ASP 56 Ca -0.14 0.26 -0.01 0.00 0.71 0.00 0.00 54.79 55.61 2dcr n ASP 56 Cb 0.59 -3.62 -0.00 0.00 -0.02 0.00 0.00 41.12 38.07 2dcr n ASP 56 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2dcr n GLY 57 N -0.53 0.49 3.04 0.44 0.00 -1.26 -5.03 105.19 102.35 2dcr n GLY 57 Ca -0.16 -0.30 -0.30 0.00 0.00 0.00 0.00 46.02 45.26 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 -0.26 1.76 -0.87 0.99 2.96 0.28 -5.06 118.68 118.47 2dcr s LEU 58 Ca 0.00 -0.51 -0.25 0.00 -0.22 0.00 0.00 54.13 53.15 2dcr s LEU 58 Cb 0.00 -1.22 -0.08 0.00 0.50 0.00 0.00 46.19 45.38 2dcr s LEU 58 CO 0.00 -0.04 2.11 -2.16 -1.32 0.00 0.00 176.35 174.94 2dcr s PRO 59 N 1.41 2.20 0.82 0.98 0.04 -1.26 -1.72 135.00 137.46 2dcr s PRO 59 Ca 0.04 -0.05 -0.13 0.00 0.04 0.00 0.00 61.00 60.90 2dcr s PRO 59 Cb -0.13 -4.97 0.09 0.00 0.04 0.00 0.00 34.50 29.53 2dcr s PRO 59 CO -0.10 -3.81 1.20 1.03 0.04 0.00 0.00 177.00 175.36 2dcr s ARG 60 N 7.67 1.57 -0.39 4.56 1.81 -0.27 -4.86 118.95 129.05 2dcr s ARG 60 Ca 0.78 1.73 0.09 0.00 -1.72 0.00 0.00 55.73 56.61 2dcr s ARG 60 Cb -0.09 -1.77 0.28 0.00 -0.45 0.00 0.00 34.95 32.93 2dcr s ARG 60 CO 0.03 -2.26 0.63 -2.39 -0.68 0.00 0.00 175.30 170.63 2dcr n HIS 61 N -3.40 -0.46 -2.44 -0.53 1.44 -1.26 -3.03 115.22 105.55 2dcr n HIS 61 Ca 0.13 -3.49 -0.42 0.00 -2.01 0.00 0.00 57.72 51.94 2dcr n HIS 61 Cb 0.51 -0.19 -0.03 0.00 0.12 0.00 0.00 29.99 30.39 2dcr n HIS 61 CO 0.00 0.00 0.00 -0.06 -2.81 0.00 0.00 176.34 173.47 2dcr s PHE 62 N -1.42 3.46 0.36 -1.40 0.08 -1.23 -4.88 117.98 112.96 2dcr s PHE 62 Ca 0.36 1.36 -0.28 0.00 0.12 0.00 0.00 56.93 58.49 2dcr s PHE 62 Cb 0.23 -3.39 -0.10 0.00 -0.57 0.00 0.00 43.02 39.19 2dcr s PHE 62 CO -0.11 -1.14 1.37 0.42 -0.10 0.00 0.00 175.22 175.66 2dcr s ILE 63 N 0.80 2.46 0.39 0.64 -1.09 -1.26 -0.21 121.20 122.93 2dcr s ILE 63 Ca 0.57 0.46 -0.27 0.00 -2.23 0.00 0.00 60.65 59.18 2dcr s ILE 63 Cb -0.29 -3.29 -0.09 0.00 -1.58 0.00 0.00 42.46 37.21 2dcr s ILE 63 CO 0.30 0.10 1.31 -0.63 -1.23 0.00 0.00 174.94 174.80 2dcr s ILE 64 N -1.15 2.61 0.98 2.92 -1.09 -0.23 -4.70 121.20 120.55 2dcr s ILE 64 Ca 0.51 0.57 -0.14 0.00 -2.23 0.00 0.00 60.65 59.36 2dcr s ILE 64 Cb -0.42 -3.34 0.06 0.00 -1.58 0.00 0.00 42.46 37.18 2dcr s ILE 64 CO 0.56 0.10 0.41 0.00 -1.23 0.00 0.00 174.94 174.77 2dcr n GLN 65 N 0.26 -0.59 -3.65 2.79 3.00 -1.26 -4.80 117.38 113.13 2dcr n GLN 65 Ca 0.03 -0.13 -0.01 0.00 -0.01 0.00 0.00 57.00 56.87 2dcr n GLN 65 Cb 0.43 -1.88 -0.07 0.00 0.00 0.00 0.00 30.24 28.73 2dcr n GLN 65 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.06 177.51 2dcr s SER 66 N -2.04 -0.09 0.00 1.08 0.15 -1.26 -4.80 113.70 106.74 2dcr s SER 66 Ca 0.58 0.17 0.00 0.00 0.70 0.00 0.00 55.95 57.39 2dcr s SER 66 Cb -0.20 0.48 0.00 0.00 -1.71 0.00 0.00 66.02 64.60 2dcr s SER 66 CO 0.66 -0.03 0.00 0.00 1.20 0.00 0.00 173.24 175.08 2dcr n LEU 67 N 2.18 0.00 0.08 3.45 -0.00 -0.72 -4.96 117.00 117.03 2dcr n LEU 67 Ca -0.13 0.00 -0.04 0.00 -0.00 0.00 0.00 56.01 55.84 2dcr n LEU 67 Cb 0.57 0.00 -0.02 0.00 -0.00 0.00 0.00 43.42 43.97 2dcr n LEU 67 CO 0.03 0.00 0.12 0.44 -0.00 0.00 0.00 177.39 177.98 2dcr h ASP 68 N 0.00 -0.24 0.00 1.45 3.32 -2.02 -3.43 116.42 115.50 2dcr h ASP 68 Ca 0.00 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.06 2dcr h ASP 68 Cb 0.00 0.06 0.00 0.00 0.22 0.00 0.00 39.33 39.61 2dcr h ASP 68 CO 0.00 0.20 0.00 -3.20 -1.72 0.00 0.00 179.24 174.52 2dcr n ASN 69 N -4.84 0.00 -4.71 6.45 5.15 -1.26 -5.12 115.26 110.93 2dcr n ASN 69 Ca -0.04 -1.00 -0.31 0.00 -0.60 0.00 0.00 54.58 52.63 2dcr n ASN 69 Cb 0.11 0.00 -0.09 0.00 -0.53 0.00 0.00 39.78 39.28 2dcr n ASN 69 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 2dcr s LEU 70 N 0.00 2.45 -0.04 1.20 1.43 -1.26 -4.53 118.68 117.94 2dcr s LEU 70 Ca 0.00 -1.57 0.01 0.00 -1.03 0.00 0.00 54.13 51.53 2dcr s LEU 70 Cb 0.00 -0.77 0.02 0.00 0.03 0.00 0.00 46.19 45.47 2dcr s LEU 70 CO 0.00 -0.74 -0.03 -0.31 0.23 0.00 0.00 176.35 175.50 2dcr s TYR 71 N -2.84 0.62 -0.08 0.29 2.02 -0.64 -1.75 117.35 114.97 2dcr s TYR 71 Ca 0.14 -0.14 -0.04 0.00 -0.37 0.00 0.00 57.07 56.66 2dcr s TYR 71 Cb 0.04 -0.58 0.04 0.00 -0.40 0.00 0.00 41.96 41.06 2dcr s TYR 71 CO 0.07 -0.17 0.19 -0.98 -1.57 0.00 0.00 175.55 173.10 2dcr s ARG 72 N 0.92 0.14 0.00 -0.62 1.04 -1.26 -1.60 118.95 117.56 2dcr s ARG 72 Ca -0.11 0.46 0.00 0.00 -1.04 0.00 0.00 55.73 55.03 2dcr s ARG 72 Cb -0.14 -0.16 0.00 0.00 -2.04 0.00 0.00 34.95 32.61 2dcr s ARG 72 CO -0.00 -0.17 0.00 -0.11 -0.04 0.00 0.00 175.30 174.97 2dcr n LEU 73 N 4.30 0.00 -0.08 -1.89 7.94 -1.26 -4.79 117.00 121.22 2dcr n LEU 73 Ca -0.25 0.00 -0.10 0.00 -1.11 0.00 0.00 56.01 54.55 2dcr n LEU 73 Cb 0.52 -0.13 -0.06 0.00 0.53 0.00 0.00 43.42 44.29 2dcr n LEU 73 CO 0.15 -0.49 -0.26 -0.08 -1.11 0.00 0.00 177.39 175.60 2dcr h GLU 74 N 0.00 0.00 0.00 1.96 4.81 -1.83 -3.48 114.58 116.04 2dcr h GLU 74 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2dcr h GLU 74 Cb 0.00 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.38 2dcr h GLU 74 CO 0.00 0.42 0.00 0.41 -0.73 0.00 0.00 179.01 179.11 2dcr n GLY 75 N 1.59 3.71 3.47 1.92 0.00 -1.26 -5.13 105.19 109.48 2dcr n GLY 75 Ca -0.14 -1.20 -0.29 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 4.74 -1.38 0.32 1.61 -1.05 -1.26 -4.83 118.70 116.84 2dcr s GLU 76 Ca 0.00 0.53 0.07 0.00 -0.15 0.00 0.00 54.97 55.42 2dcr s GLU 76 Cb 0.00 -1.52 -0.02 0.00 -0.44 0.00 0.00 34.13 32.14 2dcr s GLU 76 CO 0.00 -3.95 0.32 0.20 0.95 0.00 0.00 175.26 172.78 2dcr s GLY 77 N -2.89 1.66 0.13 -3.83 0.00 -1.26 -4.31 107.32 96.82 2dcr s GLY 77 Ca 0.68 -1.56 0.06 0.00 0.00 0.00 0.00 44.72 43.91 2dcr s GLY 77 CO 0.62 -1.50 -0.14 -1.36 0.00 0.00 0.00 173.10 170.71 2dcr s PHE 78 N -2.24 1.44 -0.58 1.90 0.40 -0.63 -4.88 117.98 113.39 2dcr s PHE 78 Ca 0.40 -0.55 0.21 0.00 -0.60 0.00 0.00 56.93 56.40 2dcr s PHE 78 Cb -0.07 -0.75 0.90 0.00 0.51 0.00 0.00 43.02 43.61 2dcr s PHE 78 CO 0.27 0.16 1.65 -0.35 0.70 0.00 0.00 175.22 177.65 2dcr n PRO 79 N 0.52 0.15 -4.07 0.24 -0.04 -1.26 -1.61 135.00 128.92 2dcr n PRO 79 Ca -0.15 0.40 -0.13 0.00 -0.04 0.00 0.00 63.50 63.57 2dcr n PRO 79 Cb 0.57 -1.79 -0.12 0.00 -0.04 0.00 0.00 33.50 32.12 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 -3.96 0.86 0.09 3.54 0.01 -1.26 -4.73 113.70 108.24 2dcr s SER 80 Ca 0.04 -0.53 -0.21 0.00 1.31 0.00 0.00 55.95 56.57 2dcr s SER 80 Cb 0.09 0.03 -0.10 0.00 0.21 0.00 0.00 66.02 66.25 2dcr s SER 80 CO 0.35 -0.19 1.63 0.40 0.41 0.00 0.00 173.24 175.84 2dcr h ILE 81 N 4.52 1.15 0.00 1.44 2.04 -1.95 -3.18 117.51 121.53 2dcr h ILE 81 Ca -0.35 -0.46 -0.02 0.00 1.00 0.00 0.00 64.86 65.03 2dcr h ILE 81 Cb 1.20 1.16 -0.00 0.00 -0.74 0.00 0.00 36.82 38.44 2dcr h ILE 81 CO 0.41 0.14 -0.09 1.55 0.00 0.00 0.00 178.15 180.16 2dcr h PRO 82 N 0.11 0.00 -0.03 2.37 0.13 -1.91 -0.15 132.00 132.51 2dcr h PRO 82 Ca 0.05 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.18 2dcr h PRO 82 Cb 0.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.30 2dcr h PRO 82 CO -0.00 0.09 0.00 1.28 -0.23 0.00 0.00 178.00 179.14 2dcr n LEU 83 N -4.36 0.24 -0.03 1.56 4.32 -1.20 -2.87 117.00 114.67 2dcr n LEU 83 Ca -0.03 -0.11 0.00 0.00 -0.02 0.00 0.00 56.01 55.86 2dcr n LEU 83 Cb 0.17 -0.02 -0.08 0.00 -1.62 0.00 0.00 43.42 41.87 2dcr n LEU 83 CO 0.35 0.05 -0.72 -0.11 -1.22 0.00 0.00 177.39 175.74 2dcr n LEU 84 N -0.54 0.00 -0.09 2.23 7.94 -0.09 -4.68 117.00 121.77 2dcr n LEU 84 Ca 0.10 0.00 -0.06 0.00 -1.11 0.00 0.00 56.01 54.94 2dcr n LEU 84 Cb 0.08 0.12 0.01 0.00 0.53 0.00 0.00 43.42 44.16 2dcr n LEU 84 CO 0.07 0.12 0.89 0.40 -1.11 0.00 0.00 177.39 177.77 2dcr h ILE 85 N 0.00 0.83 -0.52 1.96 1.08 -1.35 -2.41 117.51 117.10 2dcr h ILE 85 Ca -0.13 -0.06 -0.07 0.00 -0.39 0.00 0.00 64.86 64.21 2dcr h ILE 85 Cb 1.04 0.64 -0.02 0.00 -3.07 0.00 0.00 36.82 35.41 2dcr h ILE 85 CO 0.01 0.03 0.07 -0.78 -0.69 0.00 0.00 178.15 176.78 2dcr h ASP 86 N 0.17 0.84 0.55 1.72 3.58 -1.85 0.30 116.42 121.73 2dcr h ASP 86 Ca 0.16 -0.27 0.00 0.00 0.42 0.00 0.00 57.03 57.33 2dcr h ASP 86 Cb 0.18 -0.23 0.00 0.00 1.72 0.00 0.00 39.33 41.00 2dcr h ASP 86 CO -0.21 0.90 0.00 1.41 -2.88 0.00 0.00 179.24 178.46 2dcr n HIS 87 N -4.37 0.11 -0.11 0.28 8.25 -1.09 -0.95 115.22 117.35 2dcr n HIS 87 Ca 0.02 0.04 -0.12 0.00 -0.26 0.00 0.00 57.72 57.40 2dcr n HIS 87 Cb 0.27 -0.57 -0.15 0.00 1.12 0.00 0.00 29.99 30.67 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 -1.60 0.79 0.00 2.41 4.77 -0.65 -4.32 117.00 118.40 2dcr n LEU 88 Ca 0.03 -0.03 -0.18 0.00 -0.03 0.00 0.00 56.01 55.80 2dcr n LEU 88 Cb 0.18 0.13 -0.09 0.00 -2.33 0.00 0.00 43.42 41.31 2dcr n LEU 88 CO 0.15 0.61 0.22 0.25 -1.33 0.00 0.00 177.39 177.29 2dcr h LEU 89 N 0.00 0.81 -0.59 2.23 6.46 0.01 0.46 115.31 124.69 2dcr h LEU 89 Ca -0.56 -0.69 -0.08 0.00 -0.12 0.00 0.00 57.88 56.44 2dcr h LEU 89 Cb 2.16 -0.24 -0.01 0.00 -0.73 0.00 0.00 40.66 41.83 2dcr h LEU 89 CO -0.00 1.38 -0.37 -1.28 -0.62 0.00 0.00 178.44 177.55 2dcr h SER 90 N 0.31 0.00 0.00 1.25 0.87 -1.29 -3.30 113.55 111.40 2dcr h SER 90 Ca -0.08 0.00 -0.05 0.00 -1.23 0.00 0.00 61.79 60.43 2dcr h SER 90 Cb 1.44 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.39 2dcr h SER 90 CO 0.16 0.37 -1.91 0.35 -0.53 0.00 0.00 176.83 175.26 2dcr n THR 91 N -3.35 0.20 -2.75 2.23 -2.24 -1.20 -4.99 114.28 102.18 2dcr n THR 91 Ca 0.01 -0.48 -0.15 0.00 -2.27 0.00 0.00 64.05 61.16 2dcr n THR 91 Cb 0.57 -0.03 0.02 0.00 -2.10 0.00 0.00 70.33 68.80 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 -2.23 -3.24 -2.12 -0.78 1.13 0.13 -4.98 117.38 105.28 2dcr n GLN 92 Ca -0.08 0.62 -0.39 0.00 -1.94 0.00 0.00 57.00 55.22 2dcr n GLN 92 Cb 0.58 -4.88 -0.01 0.00 0.11 0.00 0.00 30.24 26.05 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 -5.29 3.98 0.06 -1.09 -0.21 -1.05 -4.81 119.66 111.25 2dcr s GLN 93 Ca 0.20 2.06 -0.31 0.00 0.02 0.00 0.00 55.36 57.33 2dcr s GLN 93 Cb -0.09 -2.73 -0.06 0.00 1.00 0.00 0.00 33.01 31.14 2dcr s GLN 93 CO 0.24 -0.45 1.21 -1.25 -2.12 0.00 0.00 175.29 172.92 2dcr s PRO 94 N -2.26 4.42 0.23 2.91 0.04 -1.26 -4.32 135.00 134.76 2dcr s PRO 94 Ca 0.57 1.79 0.08 0.00 0.04 0.00 0.00 61.00 63.48 2dcr s PRO 94 Cb -0.36 -3.34 0.19 0.00 0.04 0.00 0.00 34.50 31.03 2dcr s PRO 94 CO 0.46 -0.27 1.51 -0.07 0.04 0.00 0.00 177.00 178.67 2dcr h LEU 95 N 6.82 0.05 -7.21 -3.56 3.38 -1.02 -3.42 115.31 110.35 2dcr h LEU 95 Ca -0.42 -0.04 -0.07 0.00 0.09 0.00 0.00 57.88 57.45 2dcr h LEU 95 Cb 1.21 -0.02 -0.17 0.00 0.09 0.00 0.00 40.66 41.78 2dcr h LEU 95 CO 0.82 0.76 0.02 0.28 0.09 0.00 0.00 178.44 180.41 2dcr s THR 96 N -3.39 0.03 -0.48 0.22 -1.32 -1.26 -4.66 115.64 104.78 2dcr s THR 96 Ca -0.01 -0.24 0.24 0.00 -1.21 0.00 0.00 61.69 60.46 2dcr s THR 96 Cb 0.12 -0.94 0.25 0.00 -1.51 0.00 0.00 72.50 70.42 2dcr s THR 96 CO 0.79 -0.13 1.72 0.29 -2.21 0.00 0.00 174.62 175.07 2dcr n LYS 97 N 0.60 0.20 0.25 7.08 4.01 -1.26 -0.99 118.16 128.04 2dcr n LYS 97 Ca -0.19 0.42 0.14 0.00 -0.51 0.00 0.00 58.31 58.17 2dcr n LYS 97 Cb 0.59 -1.88 0.51 0.00 -0.51 0.00 0.00 35.03 33.75 2dcr n LYS 97 CO 0.00 0.00 0.00 0.87 -1.11 0.00 0.00 177.40 177.16 2dcr h LYS 98 N 0.00 0.00 0.00 1.97 1.79 -2.00 -3.40 116.57 114.92 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 0.38 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.03 2dcr h LYS 98 CO 0.00 0.09 0.00 0.43 -1.08 0.00 0.00 179.45 178.89 2dcr n SER 99 N -3.20 0.00 -2.75 0.86 7.64 -1.15 -5.03 113.62 110.00 2dcr n SER 99 Ca 0.01 0.00 -0.18 0.00 1.01 0.00 0.00 58.87 59.71 2dcr n SER 99 Cb 0.40 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.60 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 0.00 -0.50 3.64 0.23 0.00 -0.16 -4.92 105.19 103.47 2dcr n GLY 100 Ca 0.00 0.04 -0.45 0.00 0.00 0.00 0.00 46.02 45.62 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 -3.81 1.43 -4.46 1.61 0.31 -1.26 -4.73 118.33 107.43 2dcr n VAL 101 Ca -0.13 -0.36 -0.22 0.00 -0.01 0.00 0.00 64.34 63.62 2dcr n VAL 101 Cb 0.61 -1.27 -0.10 0.00 -0.91 0.00 0.00 33.84 32.16 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 -0.56 1.77 -0.08 2.52 -7.23 -1.26 -0.40 120.40 115.16 2dcr s VAL 102 Ca 0.64 -2.13 -0.16 0.00 -1.81 0.00 0.00 61.98 58.51 2dcr s VAL 102 Cb -0.68 -2.52 -0.05 0.00 0.56 0.00 0.00 36.38 33.69 2dcr s VAL 102 CO 0.55 -0.26 0.43 -0.76 -0.31 0.00 0.00 175.10 174.75 2dcr s LEU 103 N -3.49 4.35 0.00 1.32 1.43 -1.26 -4.81 118.68 116.22 2dcr s LEU 103 Ca 0.31 0.84 0.00 0.00 -1.03 0.00 0.00 54.13 54.24 2dcr s LEU 103 Cb 0.04 -2.61 0.00 0.00 0.03 0.00 0.00 46.19 43.65 2dcr s LEU 103 CO 0.13 0.14 0.00 1.41 0.23 0.00 0.00 176.35 178.27 2dcr n HIS 104 N 2.92 0.00 -3.97 0.29 8.25 -1.17 -4.56 115.22 116.98 2dcr n HIS 104 Ca -0.10 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.24 2dcr n HIS 104 Cb 0.52 0.23 -0.13 0.00 1.12 0.00 0.00 29.99 31.73 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 -1.87 0.23 -0.22 -0.41 6.06 -0.10 -4.97 118.95 117.67 2dcr s ARG 105 Ca 0.00 -0.34 0.01 0.00 -2.50 0.00 0.00 55.73 52.91 2dcr s ARG 105 Cb 0.00 -0.04 0.05 0.00 0.06 0.00 0.00 34.95 35.02 2dcr s ARG 105 CO 0.00 -0.00 -0.12 0.00 -2.50 0.00 0.00 175.30 172.68 2dcr s ALA 106 N -0.72 2.20 0.02 6.12 0.00 -1.26 -0.62 121.76 127.51 2dcr s ALA 106 Ca -0.07 -1.37 -0.30 0.00 0.00 0.00 0.00 51.96 50.21 2dcr s ALA 106 Cb -0.05 -1.36 -0.07 0.00 0.00 0.00 0.00 23.12 21.63 2dcr s ALA 106 CO -0.00 -0.88 1.64 0.08 0.00 0.00 0.00 175.76 176.60 2dcr s VAL 107 N 1.30 3.27 -0.43 0.00 1.01 -1.16 -4.79 120.40 119.60 2dcr s VAL 107 Ca -0.03 0.59 -0.29 0.00 0.00 0.00 0.00 61.98 62.25 2dcr s VAL 107 Cb -0.17 -3.38 0.01 0.00 0.00 0.00 0.00 36.38 32.85 2dcr s VAL 107 CO -0.08 -0.02 1.34 -2.16 0.00 0.00 0.00 175.10 174.18 2dcr s PRO 108 N 3.13 3.62 0.04 2.72 0.04 -1.26 -2.77 135.00 140.53 2dcr s PRO 108 Ca 0.74 0.85 -0.25 0.00 0.04 0.00 0.00 61.00 62.38 2dcr s PRO 108 Cb -0.37 -3.99 -0.17 0.00 0.04 0.00 0.00 34.50 30.01 2dcr s PRO 108 CO 0.31 -1.51 1.53 1.03 0.04 0.00 0.00 177.00 178.41 2dcr h SER 109 N 10.29 -0.07 -4.35 6.66 0.87 -1.24 -3.49 113.55 122.22 2dcr h SER 109 Ca -0.26 -0.17 0.00 0.00 -1.23 0.00 0.00 61.79 60.12 2dcr h SER 109 Cb 1.09 0.02 0.00 0.00 -0.44 0.00 0.00 62.40 63.07 2dcr h SER 109 CO 1.10 0.13 0.00 0.61 -0.53 0.00 0.00 176.83 178.14 2dcr n GLY 110 N -0.61 1.91 0.00 5.77 0.00 -1.26 -4.91 105.19 106.10 2dcr n GLY 110 Ca -0.08 -1.99 0.06 0.00 0.00 0.00 0.00 46.02 44.01 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 -1.65 0.69 -3.73 1.61 -0.04 -1.26 -4.45 135.00 126.17 2dcr n PRO 111 Ca 0.00 0.00 -0.29 0.00 -0.04 0.00 0.00 63.50 63.17 2dcr n PRO 111 Cb 0.00 -1.27 -0.12 0.00 -0.04 0.00 0.00 33.50 32.06 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 -1.69 3.63 -0.68 3.54 0.15 -1.26 -4.71 113.70 112.69 2dcr s SER 112 Ca 0.18 -2.98 -0.27 0.00 0.70 0.00 0.00 55.95 53.58 2dcr s SER 112 Cb 0.08 -1.13 0.02 0.00 -1.71 0.00 0.00 66.02 63.28 2dcr s SER 112 CO 0.14 -0.21 1.41 -0.55 1.20 0.00 0.00 173.24 175.22 2dcr s SER 113 N -0.12 6.00 0.00 5.45 0.15 -1.26 -5.10 113.70 118.82 2dcr s SER 113 Ca 0.21 -0.16 0.00 0.00 0.70 0.00 0.00 55.95 56.71 2dcr s SER 113 Cb -0.16 -2.55 0.00 0.00 -1.71 0.00 0.00 66.02 61.59 2dcr s SER 113 CO -0.06 -1.91 0.00 0.61 1.20 0.00 0.00 173.24 173.08