#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 -3.92 -4.29 1.61 7.64 -1.26 -4.96 113.62 108.44 2dcr n SER 2 Ca 0.00 0.33 -0.23 0.00 1.01 0.00 0.00 58.87 59.97 2dcr n SER 2 Cb 0.00 -3.56 -0.09 0.00 -1.01 0.00 0.00 64.21 59.54 2dcr n SER 2 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2dcr s SER 3 N -2.20 2.54 0.00 6.43 0.01 -1.26 -4.93 113.70 114.29 2dcr s SER 3 Ca 0.00 -1.53 0.00 0.00 1.31 0.00 0.00 55.95 55.73 2dcr s SER 3 Cb 0.00 0.24 0.00 0.00 0.21 0.00 0.00 66.02 66.47 2dcr s SER 3 CO 0.00 -0.78 0.00 0.61 0.41 0.00 0.00 173.24 173.48 2dcr n GLY 4 N -0.80 1.26 3.75 3.44 0.00 -1.26 -5.11 105.19 106.47 2dcr n GLY 4 Ca -0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.56 2dcr n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dcr s SER 5 N -1.48 6.34 0.08 1.61 0.15 -1.26 -5.00 113.70 114.14 2dcr s SER 5 Ca 0.00 2.98 -0.06 0.00 0.70 0.00 0.00 55.95 59.56 2dcr s SER 5 Cb 0.00 -2.63 -0.01 0.00 -1.71 0.00 0.00 66.02 61.66 2dcr s SER 5 CO 0.00 -0.94 0.12 -0.44 1.20 0.00 0.00 173.24 173.18 2dcr s SER 6 N 0.55 0.23 0.51 5.45 0.01 -1.26 -5.15 113.70 114.04 2dcr s SER 6 Ca 0.64 -0.75 -0.21 0.00 1.31 0.00 0.00 55.95 56.94 2dcr s SER 6 Cb -0.49 0.30 -0.06 0.00 0.21 0.00 0.00 66.02 65.98 2dcr s SER 6 CO 0.47 -0.69 1.20 -0.83 0.41 0.00 0.00 173.24 173.80 2dcr s GLY 7 N -2.87 2.76 -0.04 3.44 0.00 -1.26 -4.97 107.32 104.38 2dcr s GLY 7 Ca 0.05 0.99 0.06 0.00 0.00 0.00 0.00 44.72 45.82 2dcr s GLY 7 CO -0.11 1.43 0.95 1.18 0.00 0.00 0.00 173.10 176.55 2dcr n GLU 8 N -0.91 0.88 -0.29 2.90 1.02 -1.26 -4.80 120.64 118.17 2dcr n GLU 8 Ca 0.10 -1.45 0.03 0.00 -0.02 0.00 0.00 57.16 55.81 2dcr n GLU 8 Cb 0.48 -0.88 0.16 0.00 -0.02 0.00 0.00 31.44 31.19 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 2.99 0.93 0.00 2.62 2.07 -1.93 -2.16 116.25 120.76 2dcr h VAL 9 Ca 0.00 -0.28 0.00 0.00 0.82 0.00 0.00 66.70 67.24 2dcr h VAL 9 Cb 1.05 0.04 0.00 0.00 -1.52 0.00 0.00 31.29 30.86 2dcr h VAL 9 CO 0.00 0.15 0.00 0.00 0.02 0.00 0.00 177.57 177.74 2dcr n GLN 10 N -4.72 0.01 -1.26 1.57 1.13 -1.26 -4.08 117.38 108.76 2dcr n GLN 10 Ca 0.13 0.01 -0.31 0.00 -1.94 0.00 0.00 57.00 54.90 2dcr n GLN 10 Cb 0.26 -1.50 0.11 0.00 0.11 0.00 0.00 30.24 29.22 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 -2.99 1.92 1.06 -1.09 1.02 -0.81 -5.04 119.74 113.80 2dcr s LYS 11 Ca 0.14 1.01 -0.12 0.00 0.02 0.00 0.00 55.97 57.02 2dcr s LYS 11 Cb 0.19 -1.87 0.22 0.00 -0.52 0.00 0.00 37.83 35.85 2dcr s LYS 11 CO 0.52 -1.83 1.07 -1.25 -0.92 0.00 0.00 175.35 172.93 2dcr s PRO 12 N -4.93 -0.08 0.41 -1.68 0.04 -1.26 -4.92 135.00 122.58 2dcr s PRO 12 Ca 0.62 0.96 0.08 0.00 0.04 0.00 0.00 61.00 62.70 2dcr s PRO 12 Cb -0.17 -1.64 0.88 0.00 0.04 0.00 0.00 34.50 33.61 2dcr s PRO 12 CO 0.56 -3.19 2.04 1.25 0.04 0.00 0.00 177.00 177.70 2dcr h LEU 13 N -2.25 0.46 0.00 -3.56 6.46 -1.95 -3.01 115.31 111.46 2dcr h LEU 13 Ca -0.55 -0.01 0.00 0.00 -0.12 0.00 0.00 57.88 57.20 2dcr h LEU 13 Cb 1.31 -0.11 0.00 0.00 -0.73 0.00 0.00 40.66 41.13 2dcr h LEU 13 CO 0.50 0.32 0.00 0.00 -0.62 0.00 0.00 178.44 178.64 2dcr n HIS 14 N -4.47 0.00 -0.06 1.25 1.44 -1.26 -1.92 115.22 110.20 2dcr n HIS 14 Ca 0.04 0.00 0.03 0.00 -2.01 0.00 0.00 57.72 55.79 2dcr n HIS 14 Cb 0.11 0.00 0.08 0.00 0.12 0.00 0.00 29.99 30.31 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 -0.94 2.56 -2.20 -1.40 1.02 -1.14 -4.63 120.64 113.91 2dcr n GLU 15 Ca 0.19 -1.72 -0.32 0.00 -0.02 0.00 0.00 57.16 55.28 2dcr n GLU 15 Cb 0.08 -1.16 -0.01 0.00 -0.02 0.00 0.00 31.44 30.34 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 -0.95 3.58 -0.20 3.49 -1.52 -0.81 -4.81 119.66 118.45 2dcr s GLN 16 Ca 0.13 1.11 -0.20 0.00 -1.95 0.00 0.00 55.36 54.46 2dcr s GLN 16 Cb 0.07 -2.07 -0.17 0.00 -0.22 0.00 0.00 33.01 30.62 2dcr s GLN 16 CO 0.09 -0.59 0.14 1.47 -0.25 0.00 0.00 175.29 176.15 2dcr n LEU 17 N -1.82 1.86 0.03 2.90 -0.00 -1.26 -3.55 117.00 115.16 2dcr n LEU 17 Ca 0.08 0.45 0.05 0.00 -0.00 0.00 0.00 56.01 56.59 2dcr n LEU 17 Cb 0.53 -0.95 0.22 0.00 -0.00 0.00 0.00 43.42 43.23 2dcr n LEU 17 CO 0.47 0.18 0.65 -2.67 -0.00 0.00 0.00 177.39 176.02 2dcr n TRP 18 N -4.45 0.17 -2.48 1.47 4.27 -1.01 -0.60 117.44 114.81 2dcr n TRP 18 Ca -0.30 0.08 -0.41 0.00 -3.89 0.00 0.00 57.50 52.99 2dcr n TRP 18 Cb 0.63 -0.63 -0.03 0.00 -1.36 0.00 0.00 31.31 29.92 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 -3.10 2.24 -2.05 -2.67 5.04 -1.23 -0.57 117.35 115.00 2dcr s TYR 19 Ca 0.02 0.13 0.13 0.00 -2.44 0.00 0.00 57.07 54.91 2dcr s TYR 19 Cb 0.05 -4.54 0.41 0.00 0.35 0.00 0.00 41.96 38.22 2dcr s TYR 19 CO 0.15 -2.05 1.32 0.72 -1.34 0.00 0.00 175.55 174.35 2dcr n HIS 20 N 9.70 0.45 0.00 4.97 8.25 -0.54 -4.85 115.22 133.19 2dcr n HIS 20 Ca 0.06 -0.22 0.00 0.00 -0.26 0.00 0.00 57.72 57.30 2dcr n HIS 20 Cb 0.49 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.60 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 1.11 1.91 2.87 -1.41 0.00 -1.26 -4.56 105.19 103.86 2dcr n GLY 21 Ca 0.13 -0.20 -0.23 0.00 0.00 0.00 0.00 46.02 45.72 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 -1.02 0.89 -0.01 4.61 0.00 -1.26 -0.09 121.76 124.88 2dcr s ALA 22 Ca 0.00 -0.23 -0.08 0.00 0.00 0.00 0.00 51.96 51.65 2dcr s ALA 22 Cb 0.00 -0.66 0.01 0.00 0.00 0.00 0.00 23.12 22.47 2dcr s ALA 22 CO 0.00 -0.24 0.16 -1.50 0.00 0.00 0.00 175.76 174.18 2dcr s ILE 23 N 1.43 0.07 0.61 0.00 2.07 -1.26 -4.88 121.20 119.24 2dcr s ILE 23 Ca -0.02 -0.58 -0.15 0.00 -1.41 0.00 0.00 60.65 58.49 2dcr s ILE 23 Cb -0.13 -0.44 -0.03 0.00 0.13 0.00 0.00 42.46 41.99 2dcr s ILE 23 CO -0.03 -0.32 1.05 -2.16 -1.91 0.00 0.00 174.94 171.57 2dcr s PRO 24 N -1.20 3.27 0.56 3.50 0.04 -1.26 -4.79 135.00 135.12 2dcr s PRO 24 Ca -0.13 1.13 0.26 0.00 0.04 0.00 0.00 61.00 62.30 2dcr s PRO 24 Cb -0.07 -2.03 1.53 0.00 0.04 0.00 0.00 34.50 33.97 2dcr s PRO 24 CO 0.02 -0.85 2.07 0.07 0.04 0.00 0.00 177.00 178.35 2dcr h ARG 25 N 0.20 0.00 -0.02 4.56 0.11 -2.01 -2.39 114.38 114.83 2dcr h ARG 25 Ca -0.46 0.00 -0.19 0.00 0.10 0.00 0.00 59.98 59.43 2dcr h ARG 25 Cb 1.22 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 32.29 2dcr h ARG 25 CO 0.57 0.00 -0.82 0.00 0.10 0.00 0.00 179.97 179.82 2dcr h ALA 26 N 1.77 0.57 -0.09 0.08 0.00 -2.02 -3.12 119.26 116.46 2dcr h ALA 26 Ca 0.13 -0.68 -0.07 0.00 0.00 0.00 0.00 54.91 54.29 2dcr h ALA 26 Cb 0.60 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 2dcr h ALA 26 CO -0.00 0.86 -0.27 0.93 0.00 0.00 0.00 179.25 180.77 2dcr h GLU 27 N 0.15 0.15 -0.26 0.00 4.39 -1.81 -3.33 114.58 113.88 2dcr h GLU 27 Ca -0.04 -0.05 0.03 0.00 0.34 0.00 0.00 59.36 59.65 2dcr h GLU 27 Cb 1.43 -0.01 -0.06 0.00 -0.10 0.00 0.00 28.75 30.00 2dcr h GLU 27 CO 0.13 0.42 -0.45 0.28 -1.16 0.00 0.00 179.01 178.23 2dcr h VAL 28 N 0.14 0.00 0.00 3.13 2.07 -1.57 -2.10 116.25 117.91 2dcr h VAL 28 Ca 0.02 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.54 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 0.04 0.00 0.00 0.00 0.02 0.00 0.00 177.57 177.63 2dcr n ALA 29 N -2.98 1.57 0.07 1.67 0.00 -1.25 -0.48 120.51 119.10 2dcr n ALA 29 Ca -0.04 0.02 -0.15 0.00 0.00 0.00 0.00 53.44 53.28 2dcr n ALA 29 Cb 0.29 -1.28 -0.06 0.00 0.00 0.00 0.00 19.45 18.40 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 0.45 -0.05 0.00 4.81 -1.58 -3.34 114.58 114.87 2dcr h GLU 30 Ca 0.00 -0.49 -0.03 0.00 -0.13 0.00 0.00 59.36 58.71 2dcr h GLU 30 Cb 0.26 0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.78 2dcr h GLU 30 CO 0.00 1.15 -0.09 -0.07 -0.73 0.00 0.00 179.01 179.27 2dcr h LEU 31 N 0.25 0.16 -9.63 1.64 3.38 -0.57 -3.44 115.31 107.10 2dcr h LEU 31 Ca -0.09 -0.56 -0.53 0.00 0.09 0.00 0.00 57.88 56.79 2dcr h LEU 31 Cb 1.61 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 42.29 2dcr h LEU 31 CO 0.17 0.69 0.20 -0.76 0.09 0.00 0.00 178.44 178.83 2dcr s LEU 32 N -9.02 4.53 0.00 1.67 1.43 -0.38 -4.95 118.68 111.95 2dcr s LEU 32 Ca -0.15 1.60 0.00 0.00 -1.03 0.00 0.00 54.13 54.54 2dcr s LEU 32 Cb 0.02 -3.32 0.00 0.00 0.03 0.00 0.00 46.19 42.93 2dcr s LEU 32 CO 0.71 0.10 0.00 0.52 0.23 0.00 0.00 176.35 177.91 2dcr n VAL 33 N 2.22 0.00 -4.27 -1.59 0.31 -1.26 -4.72 118.33 109.03 2dcr n VAL 33 Ca -0.03 0.00 -0.27 0.00 -0.01 0.00 0.00 64.34 64.03 2dcr n VAL 33 Cb 0.49 -0.77 -0.09 0.00 -0.91 0.00 0.00 33.84 32.56 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 -1.92 2.69 -0.00 3.52 3.76 -1.26 -5.06 115.29 117.01 2dcr s HIS 34 Ca 0.00 -0.20 -0.30 0.00 -0.15 0.00 0.00 55.06 54.41 2dcr s HIS 34 Cb 0.00 -1.32 -0.09 0.00 1.11 0.00 0.00 32.58 32.28 2dcr s HIS 34 CO 0.00 0.50 2.00 -1.13 -0.85 0.00 0.00 174.74 175.26 2dcr n SER 35 N 0.11 4.01 0.00 1.40 3.41 -1.26 -1.76 113.62 119.52 2dcr n SER 35 Ca -0.11 0.83 0.00 0.00 -0.26 0.00 0.00 58.87 59.33 2dcr n SER 35 Cb 0.55 -1.52 0.00 0.00 -0.26 0.00 0.00 64.21 62.98 2dcr n SER 35 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dcr n GLY 36 N 4.69 1.93 3.71 5.00 0.00 0.15 -4.88 105.19 115.79 2dcr n GLY 36 Ca 0.21 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.81 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 -1.73 6.42 0.10 1.61 1.11 -0.72 -0.98 116.67 122.48 2dcr s ASP 37 Ca 0.00 2.80 0.01 0.00 0.18 0.00 0.00 52.55 55.54 2dcr s ASP 37 Cb 0.00 -2.59 -0.04 0.00 1.07 0.00 0.00 42.92 41.36 2dcr s ASP 37 CO 0.00 -0.96 -0.03 0.72 1.18 0.00 0.00 175.17 176.08 2dcr s PHE 38 N 1.62 0.82 0.21 4.23 -0.12 -0.08 -0.78 117.98 123.88 2dcr s PHE 38 Ca 0.76 -1.02 -0.04 0.00 -0.05 0.00 0.00 56.93 56.58 2dcr s PHE 38 Cb -0.48 -0.50 -0.03 0.00 -0.63 0.00 0.00 43.02 41.38 2dcr s PHE 38 CO 0.33 -0.28 0.22 -0.48 -0.05 0.00 0.00 175.22 174.96 2dcr s LEU 39 N -3.02 0.98 -0.06 -1.99 0.05 -0.53 -2.53 118.68 111.58 2dcr s LEU 39 Ca 0.14 -1.25 0.05 0.00 0.05 0.00 0.00 54.13 53.11 2dcr s LEU 39 Cb 0.06 0.74 -0.02 0.00 -2.05 0.00 0.00 46.19 44.93 2dcr s LEU 39 CO -0.04 -0.91 -0.19 -0.69 -0.55 0.00 0.00 176.35 173.97 2dcr s VAL 40 N -4.11 2.58 0.14 1.48 1.01 0.26 -2.76 120.40 119.01 2dcr s VAL 40 Ca 0.33 -0.88 -0.00 0.00 0.00 0.00 0.00 61.98 61.43 2dcr s VAL 40 Cb 0.05 -1.99 -0.04 0.00 0.00 0.00 0.00 36.38 34.40 2dcr s VAL 40 CO 0.10 0.57 0.04 0.00 0.00 0.00 0.00 175.10 175.81 2dcr s ARG 41 N -0.38 0.98 0.67 2.72 1.70 -0.65 -1.47 118.95 122.52 2dcr s ARG 41 Ca 0.03 -1.47 -0.05 0.00 -0.47 0.00 0.00 55.73 53.78 2dcr s ARG 41 Cb -0.12 0.08 0.06 0.00 -0.57 0.00 0.00 34.95 34.39 2dcr s ARG 41 CO 0.02 -0.22 0.96 -2.00 -1.08 0.00 0.00 175.30 172.99 2dcr s GLU 42 N -4.00 2.23 0.00 3.89 -6.30 0.87 -0.12 118.70 115.27 2dcr s GLU 42 Ca 0.24 -0.41 0.00 0.00 -2.50 0.00 0.00 54.97 52.29 2dcr s GLU 42 Cb 0.07 -2.25 0.00 0.00 0.00 0.00 0.00 34.13 31.96 2dcr s GLU 42 CO 0.02 -1.14 0.00 0.45 0.02 0.00 0.00 175.26 174.61 2dcr n SER 43 N -2.80 -1.57 -1.01 -1.70 2.88 -0.18 -4.42 113.62 104.82 2dcr n SER 43 Ca 0.08 0.00 0.01 0.00 -1.33 0.00 0.00 58.87 57.63 2dcr n SER 43 Cb 0.60 0.00 0.12 0.00 -0.75 0.00 0.00 64.21 64.18 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 -1.57 2.14 0.00 -1.46 0.00 -1.26 -4.70 117.38 110.52 2dcr n GLN 44 Ca 0.00 -1.00 0.00 0.00 0.00 0.00 0.00 57.00 56.00 2dcr n GLN 44 Cb 0.00 -1.70 0.00 0.00 0.00 0.00 0.00 30.24 28.54 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 0.17 0.40 3.36 2.61 0.00 -1.26 -5.18 105.19 105.29 2dcr n GLY 45 Ca 0.10 -0.19 -0.22 0.00 0.00 0.00 0.00 46.02 45.71 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 0.00 1.84 -0.25 1.61 -0.14 -1.26 -5.04 119.74 116.50 2dcr s LYS 46 Ca 0.00 -2.09 0.03 0.00 -1.36 0.00 0.00 55.97 52.55 2dcr s LYS 46 Cb 0.00 0.07 0.40 0.00 -1.68 0.00 0.00 37.83 36.62 2dcr s LYS 46 CO 0.00 -0.62 1.49 1.04 -0.76 0.00 0.00 175.35 176.50 2dcr n GLN 47 N -0.73 1.95 -4.78 1.68 6.02 -1.26 -4.62 117.38 115.64 2dcr n GLN 47 Ca 0.04 -1.77 -0.33 0.00 -0.01 0.00 0.00 57.00 54.93 2dcr n GLN 47 Cb 0.63 -1.72 -0.13 0.00 1.02 0.00 0.00 30.24 30.03 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 -1.94 2.94 0.20 -1.09 2.12 -1.26 -5.06 118.70 114.61 2dcr s GLU 48 Ca 0.33 -0.66 0.05 0.00 0.36 0.00 0.00 54.97 55.05 2dcr s GLU 48 Cb 0.27 -2.54 -0.03 0.00 0.26 0.00 0.00 34.13 32.09 2dcr s GLU 48 CO 0.07 0.46 0.24 0.71 -0.54 0.00 0.00 175.26 176.20 2dcr s TYR 49 N -0.28 3.30 -0.04 5.30 2.02 -1.26 -1.01 117.35 125.38 2dcr s TYR 49 Ca 0.02 -0.00 0.05 0.00 -0.37 0.00 0.00 57.07 56.77 2dcr s TYR 49 Cb -0.13 -1.54 -0.01 0.00 -0.40 0.00 0.00 41.96 39.88 2dcr s TYR 49 CO 0.03 0.50 -0.18 0.08 -1.57 0.00 0.00 175.55 174.41 2dcr s VAL 50 N -1.89 1.47 0.26 0.71 1.01 0.83 -1.12 120.40 121.67 2dcr s VAL 50 Ca 0.33 -0.75 -0.18 0.00 0.00 0.00 0.00 61.98 61.37 2dcr s VAL 50 Cb -0.10 -1.26 -0.09 0.00 0.00 0.00 0.00 36.38 34.94 2dcr s VAL 50 CO 0.26 0.42 0.74 -0.22 0.00 0.00 0.00 175.10 176.31 2dcr s LEU 51 N -0.08 4.25 -0.09 3.92 2.96 0.44 -1.64 118.68 128.45 2dcr s LEU 51 Ca -0.01 1.40 -0.03 0.00 -0.22 0.00 0.00 54.13 55.26 2dcr s LEU 51 Cb -0.11 -3.77 0.05 0.00 0.50 0.00 0.00 46.19 42.86 2dcr s LEU 51 CO 0.02 -0.05 0.11 -0.44 -1.32 0.00 0.00 176.35 174.66 2dcr s SER 52 N -1.85 1.27 -0.03 3.68 0.01 -1.11 -2.96 113.70 112.71 2dcr s SER 52 Ca 0.47 0.00 0.03 0.00 1.31 0.00 0.00 55.95 57.76 2dcr s SER 52 Cb -0.15 0.01 0.00 0.00 0.21 0.00 0.00 66.02 66.10 2dcr s SER 52 CO 0.20 -0.27 -0.10 0.54 0.41 0.00 0.00 173.24 174.01 2dcr s VAL 53 N 2.21 0.88 -0.30 3.43 0.11 -1.19 -1.45 120.40 124.09 2dcr s VAL 53 Ca 0.04 -0.41 -0.27 0.00 -2.93 0.00 0.00 61.98 58.40 2dcr s VAL 53 Cb -0.13 -0.78 0.01 0.00 -1.53 0.00 0.00 36.38 33.95 2dcr s VAL 53 CO -0.06 0.27 0.99 -0.22 -3.33 0.00 0.00 175.10 172.76 2dcr s LEU 54 N 0.20 4.00 -0.02 2.54 2.96 0.04 -0.57 118.68 127.83 2dcr s LEU 54 Ca -0.04 0.98 0.02 0.00 -0.22 0.00 0.00 54.13 54.87 2dcr s LEU 54 Cb -0.09 -3.41 0.01 0.00 0.50 0.00 0.00 46.19 43.19 2dcr s LEU 54 CO 0.01 -0.78 -0.05 0.86 -1.32 0.00 0.00 176.35 175.06 2dcr s TRP 55 N 3.40 0.60 -0.82 5.38 -0.11 -0.49 -0.67 118.94 126.23 2dcr s TRP 55 Ca 0.42 -0.13 0.00 0.00 1.22 0.00 0.00 56.10 57.61 2dcr s TRP 55 Cb -0.13 -0.46 0.00 0.00 -1.50 0.00 0.00 33.47 31.38 2dcr s TRP 55 CO 0.13 -0.08 0.00 -3.47 -4.62 0.00 0.00 176.95 168.92 2dcr n ASP 56 N 3.38 -5.52 -0.13 5.86 2.03 -1.26 -0.40 116.55 120.51 2dcr n ASP 56 Ca -0.18 0.19 -0.01 0.00 0.52 0.00 0.00 54.79 55.31 2dcr n ASP 56 Cb 0.55 -3.71 -0.00 0.00 -0.72 0.00 0.00 41.12 37.24 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 0.08 0.34 2.70 0.27 0.00 -1.26 -5.06 105.19 102.27 2dcr n GLY 57 Ca -0.08 -0.87 -0.25 0.00 0.00 0.00 0.00 46.02 44.83 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 -0.33 0.61 -0.73 0.99 0.20 0.46 -5.08 118.68 114.81 2dcr s LEU 58 Ca 0.00 -0.40 -0.26 0.00 0.69 0.00 0.00 54.13 54.17 2dcr s LEU 58 Cb 0.00 -0.38 -0.06 0.00 -0.43 0.00 0.00 46.19 45.32 2dcr s LEU 58 CO 0.00 -0.28 2.10 -2.16 -0.29 0.00 0.00 176.35 175.73 2dcr s PRO 59 N 2.02 2.29 1.00 0.98 0.04 -1.26 -1.40 135.00 138.67 2dcr s PRO 59 Ca 0.03 0.41 -0.11 0.00 0.04 0.00 0.00 61.00 61.36 2dcr s PRO 59 Cb -0.15 -4.74 0.18 0.00 0.04 0.00 0.00 34.50 29.83 2dcr s PRO 59 CO -0.07 -3.42 1.00 0.54 0.04 0.00 0.00 177.00 175.09 2dcr n ARG 60 N 8.97 -1.05 -3.53 4.56 5.12 0.27 -4.82 116.66 126.18 2dcr n ARG 60 Ca 0.36 -0.25 -0.28 0.00 -1.93 0.00 0.00 57.85 55.74 2dcr n ARG 60 Cb 0.49 -2.25 -0.14 0.00 -1.16 0.00 0.00 32.46 29.39 2dcr n ARG 60 CO 0.00 0.00 0.00 -3.38 -1.93 0.00 0.00 177.63 172.32 2dcr s HIS 61 N -2.54 0.31 -0.10 -1.55 -3.43 -1.26 -3.17 115.29 103.56 2dcr s HIS 61 Ca 0.66 -0.91 -0.01 0.00 -0.80 0.00 0.00 55.06 54.00 2dcr s HIS 61 Cb -0.23 -0.88 -0.03 0.00 -1.43 0.00 0.00 32.58 30.01 2dcr s HIS 61 CO 0.61 -0.84 -0.07 -0.06 -2.00 0.00 0.00 174.74 172.39 2dcr s PHE 62 N 2.02 2.95 0.47 0.38 0.08 -1.16 -5.00 117.98 117.72 2dcr s PHE 62 Ca 0.10 -0.14 -0.24 0.00 0.12 0.00 0.00 56.93 56.77 2dcr s PHE 62 Cb -0.17 -1.79 -0.07 0.00 -0.57 0.00 0.00 43.02 40.42 2dcr s PHE 62 CO -0.33 0.17 1.33 0.42 -0.10 0.00 0.00 175.22 176.71 2dcr s ILE 63 N -0.36 2.38 0.39 0.64 -1.09 -1.26 -0.42 121.20 121.49 2dcr s ILE 63 Ca 0.05 0.31 -0.27 0.00 -2.23 0.00 0.00 60.65 58.52 2dcr s ILE 63 Cb -0.12 -3.17 -0.09 0.00 -1.58 0.00 0.00 42.46 37.49 2dcr s ILE 63 CO 0.02 0.02 1.36 -0.63 -1.23 0.00 0.00 174.94 174.49 2dcr s ILE 64 N -1.30 2.42 1.00 2.92 -1.09 -0.28 -4.62 121.20 120.26 2dcr s ILE 64 Ca 0.63 0.39 -0.16 0.00 -2.23 0.00 0.00 60.65 59.28 2dcr s ILE 64 Cb -0.39 -3.24 -0.02 0.00 -1.58 0.00 0.00 42.46 37.24 2dcr s ILE 64 CO 0.48 0.07 -0.15 0.00 -1.23 0.00 0.00 174.94 174.12 2dcr n GLN 65 N 0.27 -0.46 0.00 2.79 3.00 -1.26 -4.80 117.38 116.91 2dcr n GLN 65 Ca 0.03 -0.11 0.00 0.00 -0.01 0.00 0.00 57.00 56.90 2dcr n GLN 65 Cb 0.42 -1.54 0.00 0.00 0.00 0.00 0.00 30.24 29.12 2dcr n GLN 65 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.06 177.51 2dcr n SER 66 N 0.20 0.00 0.08 1.08 2.88 -1.26 -4.79 113.62 111.83 2dcr n SER 66 Ca 0.03 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.57 2dcr n SER 66 Cb 0.58 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.04 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 0.23 0.12 2.46 -0.00 -0.90 -4.91 117.00 114.01 2dcr n LEU 67 Ca 0.00 0.28 0.00 0.00 -0.00 0.00 0.00 56.01 56.29 2dcr n LEU 67 Cb 0.00 0.10 0.00 0.00 -0.00 0.00 0.00 43.42 43.52 2dcr n LEU 67 CO 0.00 -0.71 -0.00 -0.67 -0.00 0.00 0.00 177.39 176.00 2dcr n ASP 68 N -3.25 0.10 -0.46 1.45 -0.08 -1.26 -4.94 116.55 108.11 2dcr n ASP 68 Ca 0.00 0.41 0.00 0.00 -1.51 0.00 0.00 54.79 53.69 2dcr n ASP 68 Cb 0.00 0.25 0.00 0.00 2.34 0.00 0.00 41.12 43.71 2dcr n ASP 68 CO 0.00 0.00 0.00 -3.20 0.12 0.00 0.00 177.20 174.12 2dcr n ASN 69 N -3.47 0.00 -4.15 1.67 5.15 -1.26 -5.11 115.26 108.09 2dcr n ASN 69 Ca 0.00 -1.89 -0.11 0.00 -0.60 0.00 0.00 54.58 51.98 2dcr n ASN 69 Cb 0.00 -0.18 -0.09 0.00 -0.53 0.00 0.00 39.78 38.99 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 0.96 -0.11 1.20 1.43 -1.26 -4.66 118.68 116.24 2dcr s LEU 70 Ca 0.00 -1.28 -0.00 0.00 -1.03 0.00 0.00 54.13 51.82 2dcr s LEU 70 Cb 0.00 0.71 0.02 0.00 0.03 0.00 0.00 46.19 46.95 2dcr s LEU 70 CO 0.00 -0.91 -0.08 -0.31 0.23 0.00 0.00 176.35 175.28 2dcr s TYR 71 N -4.13 1.49 0.01 0.29 2.02 -0.59 -2.11 117.35 114.35 2dcr s TYR 71 Ca 0.35 -0.72 0.03 0.00 -0.37 0.00 0.00 57.07 56.36 2dcr s TYR 71 Cb 0.05 -1.22 -0.01 0.00 -0.40 0.00 0.00 41.96 40.38 2dcr s TYR 71 CO 0.11 -0.49 -0.09 -0.98 -1.57 0.00 0.00 175.55 172.53 2dcr s ARG 72 N 1.56 0.69 0.00 -0.62 1.04 -1.26 -1.43 118.95 118.92 2dcr s ARG 72 Ca 0.02 -0.48 0.00 0.00 -1.04 0.00 0.00 55.73 54.23 2dcr s ARG 72 Cb -0.13 -0.63 0.00 0.00 -2.04 0.00 0.00 34.95 32.15 2dcr s ARG 72 CO -0.07 0.16 0.00 -0.11 -0.04 0.00 0.00 175.30 175.24 2dcr n LEU 73 N 2.39 1.54 0.00 -1.89 7.94 -1.26 -4.66 117.00 121.06 2dcr n LEU 73 Ca -0.16 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.74 2dcr n LEU 73 Cb 0.56 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.51 2dcr n LEU 73 CO 0.24 0.26 0.00 1.21 -1.11 0.00 0.00 177.39 177.98 2dcr n GLU 74 N -2.05 0.00 -0.00 1.96 4.07 -1.26 -4.90 120.64 118.46 2dcr n GLU 74 Ca 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.10 2dcr n GLU 74 Cb 0.37 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.75 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 2.96 -0.40 3.69 8.31 0.00 -1.26 -5.07 105.19 113.42 2dcr n GLY 75 Ca 0.00 -1.69 -0.30 0.00 0.00 0.00 0.00 46.02 44.03 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 0.29 1.15 0.56 1.61 -1.05 -1.26 -4.83 118.70 115.16 2dcr s GLU 76 Ca 0.00 1.08 -0.07 0.00 -0.15 0.00 0.00 54.97 55.84 2dcr s GLU 76 Cb 0.00 -1.78 -0.01 0.00 -0.44 0.00 0.00 34.13 31.90 2dcr s GLU 76 CO 0.00 -2.39 0.89 0.20 0.95 0.00 0.00 175.26 174.91 2dcr s GLY 77 N -3.11 1.58 0.16 -3.83 0.00 -1.26 -4.72 107.32 96.13 2dcr s GLY 77 Ca 0.64 -0.54 0.05 0.00 0.00 0.00 0.00 44.72 44.88 2dcr s GLY 77 CO 0.58 -0.29 -0.11 -1.36 0.00 0.00 0.00 173.10 171.92 2dcr s PHE 78 N -2.95 1.35 -0.72 1.90 0.40 -0.51 -4.86 117.98 112.59 2dcr s PHE 78 Ca 0.52 -0.72 0.24 0.00 -0.60 0.00 0.00 56.93 56.37 2dcr s PHE 78 Cb -0.11 -0.67 0.91 0.00 0.51 0.00 0.00 43.02 43.66 2dcr s PHE 78 CO 0.46 0.14 1.73 -0.35 0.70 0.00 0.00 175.22 177.91 2dcr n PRO 79 N -0.21 0.16 -4.09 0.24 -0.04 -1.26 -1.54 135.00 128.26 2dcr n PRO 79 Ca -0.10 0.26 -0.13 0.00 -0.04 0.00 0.00 63.50 63.49 2dcr n PRO 79 Cb 0.60 -1.74 -0.11 0.00 -0.04 0.00 0.00 33.50 32.21 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 -3.97 0.97 0.05 3.54 0.01 -1.26 -4.86 113.70 108.17 2dcr s SER 80 Ca 0.08 -0.62 -0.24 0.00 1.31 0.00 0.00 55.95 56.49 2dcr s SER 80 Cb 0.12 0.04 -0.16 0.00 0.21 0.00 0.00 66.02 66.22 2dcr s SER 80 CO 0.47 -0.23 1.56 0.40 0.41 0.00 0.00 173.24 175.85 2dcr h ILE 81 N 4.27 1.16 -0.56 1.44 2.04 -1.94 -3.06 117.51 120.87 2dcr h ILE 81 Ca -0.36 -0.46 0.04 0.00 1.00 0.00 0.00 64.86 65.07 2dcr h ILE 81 Cb 1.20 1.42 -0.03 0.00 -0.74 0.00 0.00 36.82 38.67 2dcr h ILE 81 CO 0.44 0.12 0.37 1.55 0.00 0.00 0.00 178.15 180.63 2dcr h PRO 82 N -0.15 0.59 -0.68 2.37 0.13 -1.92 0.11 132.00 132.46 2dcr h PRO 82 Ca 0.01 -0.04 -0.04 0.00 -0.87 0.00 0.00 66.00 65.06 2dcr h PRO 82 Cb 0.19 -0.13 -0.03 0.00 0.13 0.00 0.00 31.00 31.16 2dcr h PRO 82 CO -0.00 0.39 0.25 -0.07 -0.23 0.00 0.00 178.00 178.35 2dcr h LEU 83 N 0.61 0.93 -0.42 1.56 3.38 -1.70 -2.73 115.31 116.94 2dcr h LEU 83 Ca 0.23 -0.14 -0.15 0.00 0.09 0.00 0.00 57.88 57.91 2dcr h LEU 83 Cb 0.14 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 2dcr h LEU 83 CO -0.06 0.84 -0.70 0.25 0.09 0.00 0.00 178.44 178.86 2dcr h LEU 84 N 0.99 0.00 -0.16 1.67 7.12 -0.92 -3.05 115.31 120.96 2dcr h LEU 84 Ca 0.23 0.00 0.04 0.00 0.13 0.00 0.00 57.88 58.28 2dcr h LEU 84 Cb 0.22 0.00 -0.04 0.00 -0.53 0.00 0.00 40.66 40.30 2dcr h LEU 84 CO -0.02 0.70 -0.10 0.40 -0.13 0.00 0.00 178.44 179.29 2dcr h ILE 85 N 0.00 0.69 -0.60 4.05 1.08 -0.93 -1.87 117.51 119.93 2dcr h ILE 85 Ca -0.01 0.00 -0.09 0.00 -0.39 0.00 0.00 64.86 64.37 2dcr h ILE 85 Cb 1.34 0.69 -0.02 0.00 -3.07 0.00 0.00 36.82 35.75 2dcr h ILE 85 CO 0.09 0.00 -0.00 -0.78 -0.69 0.00 0.00 178.15 176.77 2dcr h ASP 86 N -0.10 1.02 0.41 1.72 3.58 -1.41 0.23 116.42 121.87 2dcr h ASP 86 Ca 0.10 -0.29 0.00 0.00 0.42 0.00 0.00 57.03 57.26 2dcr h ASP 86 Cb 0.25 -0.27 0.00 0.00 1.72 0.00 0.00 39.33 41.02 2dcr h ASP 86 CO -0.23 1.07 0.00 1.41 -2.88 0.00 0.00 179.24 178.61 2dcr n HIS 87 N -4.18 0.00 -0.11 0.28 8.25 -1.10 -0.43 115.22 117.93 2dcr n HIS 87 Ca 0.03 0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.37 2dcr n HIS 87 Cb 0.34 -0.30 -0.15 0.00 1.12 0.00 0.00 29.99 31.01 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 -1.30 0.76 0.06 2.41 4.77 -0.66 -4.35 117.00 118.70 2dcr n LEU 88 Ca 0.10 -0.04 -0.21 0.00 -0.03 0.00 0.00 56.01 55.83 2dcr n LEU 88 Cb 0.17 0.14 -0.13 0.00 -2.33 0.00 0.00 43.42 41.27 2dcr n LEU 88 CO 0.16 0.61 0.03 0.25 -1.33 0.00 0.00 177.39 177.11 2dcr h LEU 89 N 0.00 0.75 -0.11 2.23 6.46 0.05 0.57 115.31 125.26 2dcr h LEU 89 Ca -0.56 -0.83 0.00 0.00 -0.12 0.00 0.00 57.88 56.38 2dcr h LEU 89 Cb 2.16 -0.23 0.00 0.00 -0.73 0.00 0.00 40.66 41.86 2dcr h LEU 89 CO -0.00 1.49 -0.18 -0.24 -0.62 0.00 0.00 178.44 178.89 2dcr n SER 90 N -3.94 0.35 -0.07 1.25 2.88 0.42 -3.61 113.62 110.90 2dcr n SER 90 Ca -0.13 -0.19 -0.08 0.00 -1.33 0.00 0.00 58.87 57.14 2dcr n SER 90 Cb 0.89 -0.11 -0.10 0.00 -0.75 0.00 0.00 64.21 64.13 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 -1.24 0.97 -2.24 2.46 -2.24 -1.22 -5.06 114.28 105.72 2dcr n THR 91 Ca 0.10 -0.54 -0.01 0.00 -2.27 0.00 0.00 64.05 61.32 2dcr n THR 91 Cb 0.31 -0.75 0.01 0.00 -2.10 0.00 0.00 70.33 67.80 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 -2.64 -0.70 -4.38 -0.78 1.13 0.15 -5.08 117.38 105.08 2dcr n GLN 92 Ca -0.25 0.84 -0.28 0.00 -1.94 0.00 0.00 57.00 55.38 2dcr n GLN 92 Cb 0.92 -3.48 -0.12 0.00 0.11 0.00 0.00 30.24 27.68 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 -3.14 1.60 0.31 -1.09 -0.21 -0.95 -4.97 119.66 111.21 2dcr s GLN 93 Ca 0.05 -1.41 -0.29 0.00 0.02 0.00 0.00 55.36 53.73 2dcr s GLN 93 Cb -0.01 -1.94 -0.10 0.00 1.00 0.00 0.00 33.01 31.97 2dcr s GLN 93 CO 0.35 0.43 1.21 -1.25 -2.12 0.00 0.00 175.29 173.90 2dcr s PRO 94 N -2.50 4.48 0.21 2.91 0.04 -1.26 -4.10 135.00 134.79 2dcr s PRO 94 Ca 0.20 2.03 0.21 0.00 0.04 0.00 0.00 61.00 63.47 2dcr s PRO 94 Cb -0.09 -3.12 0.02 0.00 0.04 0.00 0.00 34.50 31.36 2dcr s PRO 94 CO 0.10 -0.01 1.10 -0.07 0.04 0.00 0.00 177.00 178.16 2dcr h LEU 95 N 3.56 0.00 -7.01 -3.56 3.38 -1.08 -3.43 115.31 107.16 2dcr h LEU 95 Ca -0.48 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.44 2dcr h LEU 95 Cb 1.22 0.00 -0.20 0.00 0.09 0.00 0.00 40.66 41.77 2dcr h LEU 95 CO 0.66 0.15 0.14 0.28 0.09 0.00 0.00 178.44 179.76 2dcr s THR 96 N -3.23 0.00 0.63 0.22 -1.32 -1.26 -4.92 115.64 105.76 2dcr s THR 96 Ca 0.00 -0.00 0.34 0.00 -1.21 0.00 0.00 61.69 60.82 2dcr s THR 96 Cb 0.09 -0.99 0.37 0.00 -1.51 0.00 0.00 72.50 70.46 2dcr s THR 96 CO 0.78 -0.00 2.17 0.11 -2.21 0.00 0.00 174.62 175.47 2dcr h LYS 97 N 4.39 0.00 0.00 7.08 1.79 -1.96 -0.13 116.57 127.74 2dcr h LYS 97 Ca -0.28 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.19 2dcr h LYS 97 Cb 1.15 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.80 2dcr h LYS 97 CO 0.16 0.00 0.00 1.63 -1.08 0.00 0.00 179.45 180.16 2dcr n LYS 98 N -3.45 0.19 0.00 3.15 4.76 -1.26 -4.47 118.16 117.08 2dcr n LYS 98 Ca -0.01 0.23 0.00 0.00 -2.87 0.00 0.00 58.31 55.66 2dcr n LYS 98 Cb 0.23 -1.75 0.00 0.00 -1.84 0.00 0.00 35.03 31.67 2dcr n LYS 98 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 2dcr n SER 99 N -2.08 0.00 -1.66 4.39 2.88 -1.00 -5.05 113.62 111.10 2dcr n SER 99 Ca 0.05 0.00 -0.17 0.00 -1.33 0.00 0.00 58.87 57.42 2dcr n SER 99 Cb 0.36 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.78 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 0.04 0.56 3.63 0.46 0.00 -0.09 -4.98 105.19 104.80 2dcr n GLY 100 Ca 0.00 -0.19 -0.42 0.00 0.00 0.00 0.00 46.02 45.41 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 -3.35 2.31 -4.36 1.61 0.31 -1.26 -4.74 118.33 108.84 2dcr n VAL 101 Ca -0.19 -0.50 -0.21 0.00 -0.01 0.00 0.00 64.34 63.43 2dcr n VAL 101 Cb 0.61 -1.25 -0.13 0.00 -0.91 0.00 0.00 33.84 32.16 2dcr n VAL 101 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 2dcr s VAL 102 N -1.20 1.24 0.25 2.52 1.01 -1.26 -0.50 120.40 122.47 2dcr s VAL 102 Ca 0.61 -1.12 -0.30 0.00 0.00 0.00 0.00 61.98 61.17 2dcr s VAL 102 Cb -0.58 -1.13 -0.09 0.00 0.00 0.00 0.00 36.38 34.58 2dcr s VAL 102 CO 0.58 -0.01 1.20 -0.76 0.00 0.00 0.00 175.10 176.12 2dcr s LEU 103 N -1.30 4.48 0.00 3.92 1.43 -1.26 -4.71 118.68 121.23 2dcr s LEU 103 Ca 0.02 2.37 0.00 0.00 -1.03 0.00 0.00 54.13 55.50 2dcr s LEU 103 Cb -0.08 -3.62 0.00 0.00 0.03 0.00 0.00 46.19 42.51 2dcr s LEU 103 CO 0.02 -0.35 0.00 1.41 0.23 0.00 0.00 176.35 177.66 2dcr n HIS 104 N 1.66 -0.07 -3.83 0.29 8.25 -1.15 -4.74 115.22 115.63 2dcr n HIS 104 Ca 0.02 0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.35 2dcr n HIS 104 Cb 0.44 0.08 -0.12 0.00 1.12 0.00 0.00 29.99 31.51 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 -1.16 0.22 -0.21 -0.41 6.06 -0.15 -4.94 118.95 118.35 2dcr s ARG 105 Ca 0.00 0.13 -0.05 0.00 -2.50 0.00 0.00 55.73 53.30 2dcr s ARG 105 Cb 0.00 0.10 -0.02 0.00 0.06 0.00 0.00 34.95 35.09 2dcr s ARG 105 CO 0.00 -0.03 0.01 0.00 -2.50 0.00 0.00 175.30 172.78 2dcr s ALA 106 N -0.12 3.02 0.02 6.12 0.00 -1.26 -0.90 121.76 128.65 2dcr s ALA 106 Ca -0.02 -1.05 -0.30 0.00 0.00 0.00 0.00 51.96 50.59 2dcr s ALA 106 Cb -0.02 -1.83 -0.08 0.00 0.00 0.00 0.00 23.12 21.19 2dcr s ALA 106 CO 0.00 -0.27 1.85 0.08 0.00 0.00 0.00 175.76 177.43 2dcr s VAL 107 N 1.21 3.12 -0.26 0.00 1.01 -1.05 -4.89 120.40 119.52 2dcr s VAL 107 Ca 0.03 0.23 -0.29 0.00 0.00 0.00 0.00 61.98 61.95 2dcr s VAL 107 Cb -0.15 -3.15 0.00 0.00 0.00 0.00 0.00 36.38 33.09 2dcr s VAL 107 CO 0.01 -0.02 1.23 -2.16 0.00 0.00 0.00 175.10 174.17 2dcr s PRO 108 N 4.07 4.05 -0.06 2.72 0.04 -1.26 -2.39 135.00 142.15 2dcr s PRO 108 Ca 0.83 1.33 -0.27 0.00 0.04 0.00 0.00 61.00 62.93 2dcr s PRO 108 Cb -0.40 -3.81 -0.22 0.00 0.04 0.00 0.00 34.50 30.11 2dcr s PRO 108 CO 0.37 -0.94 1.09 1.03 0.04 0.00 0.00 177.00 178.59 2dcr h SER 109 N 8.68 -0.01 -3.66 6.66 0.87 -1.18 -3.48 113.55 121.43 2dcr h SER 109 Ca -0.25 -0.64 0.00 0.00 -1.23 0.00 0.00 61.79 59.67 2dcr h SER 109 Cb 1.09 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.05 2dcr h SER 109 CO 1.01 0.65 0.00 0.61 -0.53 0.00 0.00 176.83 178.57 2dcr n GLY 110 N 0.68 1.90 0.19 5.77 0.00 -1.26 -4.99 105.19 107.48 2dcr n GLY 110 Ca -0.09 -1.80 0.13 0.00 0.00 0.00 0.00 46.02 44.26 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 -1.91 1.25 -3.73 1.61 -0.04 -1.26 -4.30 135.00 126.61 2dcr n PRO 111 Ca 0.00 -0.37 -0.11 0.00 -0.04 0.00 0.00 63.50 62.98 2dcr n PRO 111 Cb 0.00 -1.41 -0.06 0.00 -0.04 0.00 0.00 33.50 31.98 2dcr n PRO 111 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2dcr s SER 112 N -1.80 -0.12 0.32 3.54 1.04 -1.26 -4.50 113.70 110.93 2dcr s SER 112 Ca 0.37 -0.32 0.06 0.00 0.48 0.00 0.00 55.95 56.54 2dcr s SER 112 Cb 0.18 0.40 -0.03 0.00 0.10 0.00 0.00 66.02 66.67 2dcr s SER 112 CO 0.30 -0.72 0.23 -0.94 0.98 0.00 0.00 173.24 173.09 2dcr s SER 113 N -2.47 1.62 0.00 7.02 1.04 -1.26 -5.05 113.70 114.60 2dcr s SER 113 Ca -0.00 -1.69 0.00 0.00 0.48 0.00 0.00 55.95 54.74 2dcr s SER 113 Cb 0.01 0.52 0.00 0.00 0.10 0.00 0.00 66.02 66.65 2dcr s SER 113 CO -0.08 -1.01 0.00 0.61 0.98 0.00 0.00 173.24 173.75