#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dcr s SER 2 N 0.00 0.91 0.00 1.61 0.01 -1.26 -5.07 113.70 109.90 2dcr s SER 2 Ca 0.00 0.13 0.00 0.00 1.31 0.00 0.00 55.95 57.39 2dcr s SER 2 Cb 0.00 -0.05 0.00 0.00 0.21 0.00 0.00 66.02 66.18 2dcr s SER 2 CO 0.00 -0.23 0.00 -0.24 0.41 0.00 0.00 173.24 173.18 2dcr n SER 3 N 5.15 0.00 0.00 2.44 2.88 -1.26 -5.14 113.62 117.69 2dcr n SER 3 Ca -0.07 0.10 0.00 0.00 -1.33 0.00 0.00 58.87 57.57 2dcr n SER 3 Cb 0.50 -0.20 0.00 0.00 -0.75 0.00 0.00 64.21 63.76 2dcr n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dcr n GLY 4 N 2.19 2.13 3.56 0.46 0.00 -1.26 -5.11 105.19 107.16 2dcr n GLY 4 Ca 0.00 -1.93 -0.10 0.00 0.00 0.00 0.00 46.02 43.99 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 0.00 -0.80 -0.11 1.61 0.15 -1.26 -5.17 113.70 108.13 2dcr s SER 5 Ca 0.00 1.37 -0.09 0.00 0.70 0.00 0.00 55.95 57.93 2dcr s SER 5 Cb 0.00 1.29 0.03 0.00 -1.71 0.00 0.00 66.02 65.63 2dcr s SER 5 CO 0.00 -0.23 0.28 -0.44 1.20 0.00 0.00 173.24 174.05 2dcr s SER 6 N 1.17 -0.29 -0.02 5.45 0.01 -1.26 -5.01 113.70 113.75 2dcr s SER 6 Ca -0.07 0.56 -0.00 0.00 1.31 0.00 0.00 55.95 57.75 2dcr s SER 6 Cb -0.05 0.55 0.00 0.00 0.21 0.00 0.00 66.02 66.73 2dcr s SER 6 CO -0.12 -0.11 0.03 0.61 0.41 0.00 0.00 173.24 174.06 2dcr n GLY 7 N 3.18 -0.60 1.08 3.44 0.00 -1.26 -5.04 105.19 105.99 2dcr n GLY 7 Ca -0.15 -0.09 0.05 0.00 0.00 0.00 0.00 46.02 45.83 2dcr n GLY 7 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2dcr n GLU 8 N -0.65 0.79 0.20 1.61 4.71 -1.26 -4.89 120.64 121.14 2dcr n GLU 8 Ca 0.00 -2.64 -0.12 0.00 -0.01 0.00 0.00 57.16 54.39 2dcr n GLU 8 Cb 0.16 -0.79 -0.07 0.00 -1.01 0.00 0.00 31.44 29.73 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 4.11 0.42 0.00 2.62 2.07 -1.96 -3.24 116.25 120.26 2dcr h VAL 9 Ca -0.12 -0.60 0.00 0.00 0.82 0.00 0.00 66.70 66.80 2dcr h VAL 9 Cb 1.47 0.63 0.00 0.00 -1.52 0.00 0.00 31.29 31.87 2dcr h VAL 9 CO 0.06 0.08 0.00 1.56 0.02 0.00 0.00 177.57 179.29 2dcr h GLN 10 N -0.97 0.00 -7.14 1.57 1.08 -1.90 -3.34 115.11 104.42 2dcr h GLN 10 Ca -0.06 0.00 -0.49 0.00 -1.45 0.00 0.00 58.65 56.65 2dcr h GLN 10 Cb 0.55 0.00 0.21 0.00 -0.05 0.00 0.00 27.48 28.19 2dcr h GLN 10 CO 0.09 0.00 -0.01 1.63 -0.95 0.00 0.00 178.83 179.59 2dcr n LYS 11 N -2.67 -1.09 -1.33 1.46 4.76 -1.23 -5.02 118.16 113.04 2dcr n LYS 11 Ca 0.01 -0.27 -0.30 0.00 -2.87 0.00 0.00 58.31 54.89 2dcr n LYS 11 Cb 0.26 -2.22 0.12 0.00 -1.84 0.00 0.00 35.03 31.35 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 -4.39 1.56 0.27 1.97 0.04 -1.26 -4.86 135.00 128.34 2dcr s PRO 12 Ca 0.66 0.75 -0.04 0.00 0.04 0.00 0.00 61.00 62.41 2dcr s PRO 12 Cb -0.23 -1.85 0.35 0.00 0.04 0.00 0.00 34.50 32.81 2dcr s PRO 12 CO 0.62 -2.01 1.94 1.25 0.04 0.00 0.00 177.00 178.84 2dcr h LEU 13 N -1.38 1.06 -0.08 -3.56 6.46 -1.95 -3.15 115.31 112.71 2dcr h LEU 13 Ca -0.49 -0.02 0.00 0.00 -0.12 0.00 0.00 57.88 57.25 2dcr h LEU 13 Cb 1.28 -0.26 0.00 0.00 -0.73 0.00 0.00 40.66 40.95 2dcr h LEU 13 CO 0.56 0.76 0.00 0.00 -0.62 0.00 0.00 178.44 179.14 2dcr n HIS 14 N -4.40 0.00 -0.50 1.25 1.44 -1.26 -1.75 115.22 109.99 2dcr n HIS 14 Ca 0.11 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.82 2dcr n HIS 14 Cb 0.03 -0.01 0.00 0.00 0.12 0.00 0.00 29.99 30.14 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 -0.45 0.66 -1.38 -1.40 1.02 -1.19 -4.82 120.64 113.07 2dcr n GLU 15 Ca 0.00 -0.68 -0.30 0.00 -0.02 0.00 0.00 57.16 56.16 2dcr n GLU 15 Cb 0.01 -0.75 0.11 0.00 -0.02 0.00 0.00 31.44 30.79 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 -0.29 1.81 -0.13 3.49 -1.52 -0.72 -4.77 119.66 117.54 2dcr s GLN 16 Ca 0.00 0.78 -0.08 0.00 -1.95 0.00 0.00 55.36 54.11 2dcr s GLN 16 Cb 0.00 -1.88 -0.05 0.00 -0.22 0.00 0.00 33.01 30.87 2dcr s GLN 16 CO 0.00 -1.85 -0.00 1.37 -0.25 0.00 0.00 175.29 174.56 2dcr h LEU 17 N -1.26 0.00 0.00 2.90 -0.00 -1.86 -3.32 115.31 111.77 2dcr h LEU 17 Ca -0.47 -0.12 0.00 0.00 -0.00 0.00 0.00 57.88 57.29 2dcr h LEU 17 Cb 1.27 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.93 2dcr h LEU 17 CO 0.56 0.74 0.00 -2.67 -0.00 0.00 0.00 178.44 177.07 2dcr n TRP 18 N -4.66 0.00 -2.60 0.17 4.27 -0.97 -0.98 117.44 112.67 2dcr n TRP 18 Ca -0.07 0.00 -0.43 0.00 -3.89 0.00 0.00 57.50 53.11 2dcr n TRP 18 Cb 0.21 -0.45 -0.02 0.00 -1.36 0.00 0.00 31.31 29.70 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 -2.89 2.76 -0.22 -2.67 5.04 -1.25 -2.48 117.35 115.64 2dcr s TYR 19 Ca 0.07 0.64 -0.05 0.00 -2.44 0.00 0.00 57.07 55.29 2dcr s TYR 19 Cb 0.07 -4.46 -0.19 0.00 0.35 0.00 0.00 41.96 37.73 2dcr s TYR 19 CO 0.19 -1.35 -0.06 0.72 -1.34 0.00 0.00 175.55 173.72 2dcr n HIS 20 N 7.99 0.42 0.00 4.97 8.25 -1.26 -4.71 115.22 130.89 2dcr n HIS 20 Ca 0.11 0.11 0.00 0.00 -0.26 0.00 0.00 57.72 57.68 2dcr n HIS 20 Cb 0.49 -1.05 0.00 0.00 1.12 0.00 0.00 29.99 30.55 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 1.95 0.24 1.48 -1.41 0.00 -1.26 -4.79 105.19 101.39 2dcr n GLY 21 Ca -0.43 -1.77 -0.06 0.00 0.00 0.00 0.00 46.02 43.77 2dcr n GLY 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dcr n ALA 22 N -1.00 3.86 -1.77 4.61 0.00 -1.26 -0.95 120.51 124.00 2dcr n ALA 22 Ca 0.00 -0.63 -0.37 0.00 0.00 0.00 0.00 53.44 52.44 2dcr n ALA 22 Cb 0.00 -1.12 -0.00 0.00 0.00 0.00 0.00 19.45 18.32 2dcr n ALA 22 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 2dcr s ILE 23 N -0.81 2.95 0.73 0.00 2.07 -1.26 -4.70 121.20 120.19 2dcr s ILE 23 Ca 0.12 0.71 -0.11 0.00 -1.41 0.00 0.00 60.65 59.96 2dcr s ILE 23 Cb 0.10 -3.36 0.03 0.00 0.13 0.00 0.00 42.46 39.36 2dcr s ILE 23 CO 0.01 -0.02 1.08 -2.16 -1.91 0.00 0.00 174.94 171.95 2dcr s PRO 24 N -2.76 2.64 0.52 3.50 0.04 -1.26 -4.69 135.00 133.00 2dcr s PRO 24 Ca 0.65 0.64 0.23 0.00 0.04 0.00 0.00 61.00 62.57 2dcr s PRO 24 Cb -0.30 -1.98 1.43 0.00 0.04 0.00 0.00 34.50 33.68 2dcr s PRO 24 CO 0.36 -1.23 2.12 0.07 0.04 0.00 0.00 177.00 178.36 2dcr h ARG 25 N -0.80 0.00 -0.27 4.56 0.11 -1.98 -2.44 114.38 113.55 2dcr h ARG 25 Ca -0.45 0.00 -0.17 0.00 0.10 0.00 0.00 59.98 59.46 2dcr h ARG 25 Cb 1.25 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.33 2dcr h ARG 25 CO 0.61 0.08 -0.49 0.00 0.10 0.00 0.00 179.97 180.27 2dcr h ALA 26 N 1.92 0.42 -0.17 0.08 0.00 -2.02 -3.24 119.26 116.25 2dcr h ALA 26 Ca -0.00 -0.49 -0.09 0.00 0.00 0.00 0.00 54.91 54.33 2dcr h ALA 26 Cb 0.18 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 2dcr h ALA 26 CO 0.01 0.60 -0.27 0.93 0.00 0.00 0.00 179.25 180.52 2dcr h GLU 27 N 0.57 0.33 -0.57 0.00 4.39 -1.82 -2.78 114.58 114.70 2dcr h GLU 27 Ca 0.01 -0.12 0.05 0.00 0.34 0.00 0.00 59.36 59.65 2dcr h GLU 27 Cb 1.10 -0.02 -0.08 0.00 -0.10 0.00 0.00 28.75 29.65 2dcr h GLU 27 CO 0.11 0.58 -0.42 0.28 -1.16 0.00 0.00 179.01 178.40 2dcr h VAL 28 N 0.29 0.00 0.00 3.13 2.07 -1.56 -1.20 116.25 118.98 2dcr h VAL 28 Ca 0.04 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.56 2dcr h VAL 28 Cb 0.64 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.41 2dcr h VAL 28 CO 0.05 0.00 0.00 0.00 0.02 0.00 0.00 177.57 177.64 2dcr n ALA 29 N -3.11 1.76 0.09 1.67 0.00 -1.05 -0.72 120.51 119.15 2dcr n ALA 29 Ca -0.00 0.05 -0.05 0.00 0.00 0.00 0.00 53.44 53.44 2dcr n ALA 29 Cb 0.21 -1.38 0.11 0.00 0.00 0.00 0.00 19.45 18.39 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 0.23 0.04 0.00 4.57 -1.22 -3.38 114.58 114.82 2dcr h GLU 30 Ca 0.00 -0.16 -0.29 0.00 -1.18 0.00 0.00 59.36 57.73 2dcr h GLU 30 Cb 0.40 0.03 -0.03 0.00 -0.16 0.00 0.00 28.75 28.98 2dcr h GLU 30 CO 0.00 0.78 -1.58 1.28 -1.18 0.00 0.00 179.01 178.31 2dcr n LEU 31 N -3.86 2.13 -4.73 1.64 4.77 0.11 -4.88 117.00 112.18 2dcr n LEU 31 Ca -0.02 0.34 -0.41 0.00 -0.03 0.00 0.00 56.01 55.89 2dcr n LEU 31 Cb 0.63 -1.01 -0.04 0.00 -2.33 0.00 0.00 43.42 40.67 2dcr n LEU 31 CO 0.45 0.48 0.71 -0.76 -1.33 0.00 0.00 177.39 176.94 2dcr s LEU 32 N -7.58 4.48 0.00 2.23 1.43 -0.17 -4.95 118.68 114.12 2dcr s LEU 32 Ca -0.27 1.87 0.00 0.00 -1.03 0.00 0.00 54.13 54.69 2dcr s LEU 32 Cb 0.07 -3.59 0.00 0.00 0.03 0.00 0.00 46.19 42.70 2dcr s LEU 32 CO 0.64 -0.15 0.00 0.52 0.23 0.00 0.00 176.35 177.60 2dcr n VAL 33 N 2.85 0.00 -4.43 -1.59 0.31 -1.26 -4.74 118.33 109.46 2dcr n VAL 33 Ca 0.03 0.00 -0.21 0.00 -0.01 0.00 0.00 64.34 64.15 2dcr n VAL 33 Cb 0.48 0.05 -0.10 0.00 -0.91 0.00 0.00 33.84 33.36 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 -0.97 1.93 0.03 3.52 3.76 -1.26 -5.09 115.29 117.21 2dcr s HIS 34 Ca 0.00 -0.85 -0.34 0.00 -0.15 0.00 0.00 55.06 53.71 2dcr s HIS 34 Cb 0.00 -1.20 -0.13 0.00 1.11 0.00 0.00 32.58 32.36 2dcr s HIS 34 CO 0.00 0.11 1.69 -1.13 -0.85 0.00 0.00 174.74 174.56 2dcr n SER 35 N -0.63 3.10 0.00 1.40 3.41 -1.26 -2.52 113.62 117.12 2dcr n SER 35 Ca -0.04 1.04 0.00 0.00 -0.26 0.00 0.00 58.87 59.61 2dcr n SER 35 Cb 0.65 -1.37 0.00 0.00 -0.26 0.00 0.00 64.21 63.23 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 3.79 0.34 3.68 5.00 0.00 -0.26 -4.68 105.19 113.05 2dcr n GLY 36 Ca 0.20 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.76 2dcr n GLY 36 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2dcr n ASP 37 N 0.00 3.68 -4.30 1.61 8.00 -1.05 -0.68 116.55 123.82 2dcr n ASP 37 Ca 0.00 0.97 -0.17 0.00 0.71 0.00 0.00 54.79 56.30 2dcr n ASP 37 Cb 0.00 -1.45 -0.10 0.00 -0.02 0.00 0.00 41.12 39.55 2dcr n ASP 37 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 2dcr s PHE 38 N 3.51 1.51 0.07 1.24 -0.12 -0.19 -2.06 117.98 121.95 2dcr s PHE 38 Ca 0.88 -0.64 -0.11 0.00 -0.05 0.00 0.00 56.93 57.02 2dcr s PHE 38 Cb -0.59 -0.73 0.01 0.00 -0.63 0.00 0.00 43.02 41.07 2dcr s PHE 38 CO 0.45 0.23 0.24 -0.48 -0.05 0.00 0.00 175.22 175.61 2dcr s LEU 39 N -3.14 1.16 -0.40 -1.99 0.05 -0.33 -3.13 118.68 110.90 2dcr s LEU 39 Ca 0.18 -0.43 0.00 0.00 0.05 0.00 0.00 54.13 53.93 2dcr s LEU 39 Cb -0.00 1.19 0.11 0.00 -2.05 0.00 0.00 46.19 45.43 2dcr s LEU 39 CO 0.04 -0.67 0.16 -0.69 -0.55 0.00 0.00 176.35 174.64 2dcr s VAL 40 N -3.23 2.89 0.11 1.48 1.01 -1.04 -1.02 120.40 120.60 2dcr s VAL 40 Ca -0.00 -2.29 0.01 0.00 0.00 0.00 0.00 61.98 59.70 2dcr s VAL 40 Cb 0.02 -3.03 -0.04 0.00 0.00 0.00 0.00 36.38 33.33 2dcr s VAL 40 CO -0.08 -0.67 0.26 0.00 0.00 0.00 0.00 175.10 174.61 2dcr s ARG 41 N 0.90 3.46 0.37 2.72 1.70 0.54 -4.08 118.95 124.56 2dcr s ARG 41 Ca 0.10 -0.47 -0.13 0.00 -0.47 0.00 0.00 55.73 54.76 2dcr s ARG 41 Cb -0.21 -2.99 -0.08 0.00 -0.57 0.00 0.00 34.95 31.10 2dcr s ARG 41 CO -0.05 0.56 0.77 -2.00 -1.08 0.00 0.00 175.30 173.49 2dcr s GLU 42 N -2.83 3.89 1.00 3.89 2.12 -0.13 0.22 118.70 126.85 2dcr s GLU 42 Ca 0.35 0.58 -0.13 0.00 0.36 0.00 0.00 54.97 56.14 2dcr s GLU 42 Cb -0.12 -2.39 0.19 0.00 0.26 0.00 0.00 34.13 32.06 2dcr s GLU 42 CO 0.28 0.04 1.10 0.45 -0.54 0.00 0.00 175.26 176.59 2dcr s SER 43 N -2.76 2.62 -1.02 -1.70 0.15 0.28 -4.14 113.70 107.13 2dcr s SER 43 Ca 0.53 1.10 -0.25 0.00 0.70 0.00 0.00 55.95 58.02 2dcr s SER 43 Cb -0.10 -1.73 -0.14 0.00 -1.71 0.00 0.00 66.02 62.34 2dcr s SER 43 CO 0.25 -3.12 2.10 0.00 1.20 0.00 0.00 173.24 173.67 2dcr s GLN 44 N -5.04 1.85 -1.06 5.44 0.00 -1.26 -3.63 119.66 115.96 2dcr s GLN 44 Ca 0.65 -0.41 0.00 0.00 -0.00 0.00 0.00 55.36 55.60 2dcr s GLN 44 Cb -0.18 -5.02 0.00 0.00 0.00 0.00 0.00 33.01 27.81 2dcr s GLN 44 CO 0.57 -4.52 0.00 0.41 0.00 0.00 0.00 175.29 171.75 2dcr n GLY 45 N 6.32 0.29 3.14 2.60 0.00 -1.26 -5.03 105.19 111.25 2dcr n GLY 45 Ca 0.43 -0.43 -0.23 0.00 0.00 0.00 0.00 46.02 45.80 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 -4.11 1.18 -1.06 1.61 -0.14 -1.24 -5.04 119.74 110.94 2dcr s LYS 46 Ca 0.00 -0.61 -0.08 0.00 -1.36 0.00 0.00 55.97 53.92 2dcr s LYS 46 Cb 0.00 -1.16 -0.06 0.00 -1.68 0.00 0.00 37.83 34.92 2dcr s LYS 46 CO 0.00 0.31 2.26 1.04 -0.76 0.00 0.00 175.35 178.20 2dcr n GLN 47 N 2.48 2.37 -4.13 1.68 6.02 -1.26 -3.44 117.38 121.11 2dcr n GLN 47 Ca -0.15 -1.66 -0.15 0.00 -0.01 0.00 0.00 57.00 55.03 2dcr n GLN 47 Cb 0.55 -2.58 -0.11 0.00 1.02 0.00 0.00 30.24 29.11 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 3.29 0.70 0.26 -1.09 2.56 -1.26 -5.04 118.70 118.13 2dcr s GLU 48 Ca 0.47 -0.95 0.08 0.00 0.00 0.00 0.00 54.97 54.58 2dcr s GLU 48 Cb 0.12 -0.49 -0.04 0.00 2.00 0.00 0.00 34.13 35.72 2dcr s GLU 48 CO -0.03 0.09 0.09 0.71 -0.56 0.00 0.00 175.26 175.56 2dcr s TYR 49 N -1.76 2.89 -0.06 5.30 2.02 -1.26 -0.56 117.35 123.92 2dcr s TYR 49 Ca -0.03 -0.17 -0.00 0.00 -0.37 0.00 0.00 57.07 56.50 2dcr s TYR 49 Cb -0.07 -1.29 0.02 0.00 -0.40 0.00 0.00 41.96 40.22 2dcr s TYR 49 CO 0.00 0.57 -0.03 0.08 -1.57 0.00 0.00 175.55 174.61 2dcr s VAL 50 N -2.23 0.54 0.23 0.71 1.01 0.13 -0.76 120.40 120.03 2dcr s VAL 50 Ca 0.32 -0.05 -0.30 0.00 0.00 0.00 0.00 61.98 61.95 2dcr s VAL 50 Cb -0.07 -0.61 -0.09 0.00 0.00 0.00 0.00 36.38 35.61 2dcr s VAL 50 CO 0.22 0.26 1.04 -0.22 0.00 0.00 0.00 175.10 176.40 2dcr s LEU 51 N 1.41 4.56 -0.02 3.92 2.96 0.11 -0.34 118.68 131.28 2dcr s LEU 51 Ca -0.03 2.08 0.01 0.00 -0.22 0.00 0.00 54.13 55.97 2dcr s LEU 51 Cb -0.13 -3.61 0.01 0.00 0.50 0.00 0.00 46.19 42.96 2dcr s LEU 51 CO -0.03 -0.06 -0.02 -0.44 -1.32 0.00 0.00 176.35 174.48 2dcr s SER 52 N -0.69 0.45 -0.02 3.68 0.01 -0.19 -1.47 113.70 115.48 2dcr s SER 52 Ca 0.45 -0.05 -0.04 0.00 1.31 0.00 0.00 55.95 57.62 2dcr s SER 52 Cb -0.29 -0.16 0.00 0.00 0.21 0.00 0.00 66.02 65.79 2dcr s SER 52 CO 0.36 -0.03 0.09 0.54 0.41 0.00 0.00 173.24 174.61 2dcr s VAL 53 N 0.48 0.03 -0.51 3.43 0.11 -1.00 -1.19 120.40 121.75 2dcr s VAL 53 Ca -0.05 -0.24 -0.24 0.00 -2.93 0.00 0.00 61.98 58.52 2dcr s VAL 53 Cb -0.08 -0.22 0.04 0.00 -1.53 0.00 0.00 36.38 34.59 2dcr s VAL 53 CO -0.01 -0.13 0.88 -0.22 -3.33 0.00 0.00 175.10 172.28 2dcr s LEU 54 N -0.41 4.18 -0.12 2.54 2.96 -0.87 -0.24 118.68 126.72 2dcr s LEU 54 Ca -0.05 -0.25 0.02 0.00 -0.22 0.00 0.00 54.13 53.64 2dcr s LEU 54 Cb -0.03 -2.90 0.01 0.00 0.50 0.00 0.00 46.19 43.77 2dcr s LEU 54 CO 0.00 -1.09 -0.19 0.86 -1.32 0.00 0.00 176.35 174.61 2dcr s TRP 55 N 3.65 2.30 -1.50 5.38 -0.00 -0.52 -1.11 118.94 127.15 2dcr s TRP 55 Ca 0.30 -1.11 -0.09 0.00 -0.00 0.00 0.00 56.10 55.21 2dcr s TRP 55 Cb -0.12 -1.60 0.07 0.00 -0.00 0.00 0.00 33.47 31.81 2dcr s TRP 55 CO 0.21 -0.53 0.77 -3.47 -0.00 0.00 0.00 176.95 173.93 2dcr n ASP 56 N 4.09 -2.84 -0.94 5.86 2.03 -1.26 -1.85 116.55 121.65 2dcr n ASP 56 Ca -0.19 -0.88 -0.08 0.00 0.52 0.00 0.00 54.79 54.15 2dcr n ASP 56 Cb 0.51 -3.52 -0.01 0.00 -0.72 0.00 0.00 41.12 37.39 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 -1.67 0.11 2.82 0.27 0.00 -1.26 -5.00 105.19 100.46 2dcr n GLY 57 Ca -0.09 -0.54 -0.14 0.00 0.00 0.00 0.00 46.02 45.24 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 -2.39 -0.35 -0.68 0.99 1.98 -0.77 -5.08 118.68 112.38 2dcr s LEU 58 Ca 0.00 -0.02 -0.26 0.00 -2.89 0.00 0.00 54.13 50.96 2dcr s LEU 58 Cb 0.00 0.72 -0.06 0.00 0.66 0.00 0.00 46.19 47.50 2dcr s LEU 58 CO 0.00 -0.31 2.15 -2.16 -1.89 0.00 0.00 176.35 174.14 2dcr s PRO 59 N 2.43 2.24 0.57 0.98 0.04 -1.26 -1.44 135.00 138.56 2dcr s PRO 59 Ca 0.10 0.62 -0.20 0.00 0.04 0.00 0.00 61.00 61.56 2dcr s PRO 59 Cb -0.16 -4.67 -0.04 0.00 0.04 0.00 0.00 34.50 29.67 2dcr s PRO 59 CO -0.14 -3.39 1.24 1.03 0.04 0.00 0.00 177.00 175.78 2dcr s ARG 60 N 7.78 3.07 -0.22 4.56 1.81 0.66 -4.83 118.95 131.78 2dcr s ARG 60 Ca 0.82 1.93 -0.01 0.00 -1.72 0.00 0.00 55.73 56.74 2dcr s ARG 60 Cb -0.13 -2.05 0.06 0.00 -0.45 0.00 0.00 34.95 32.39 2dcr s ARG 60 CO 0.15 -1.15 0.00 -1.01 -0.68 0.00 0.00 175.30 172.61 2dcr s HIS 61 N -1.51 1.68 -0.04 -0.53 3.76 -1.26 -2.37 115.29 115.02 2dcr s HIS 61 Ca 0.75 -1.33 0.06 0.00 -0.15 0.00 0.00 55.06 54.39 2dcr s HIS 61 Cb -0.33 -1.33 -0.02 0.00 1.11 0.00 0.00 32.58 32.01 2dcr s HIS 61 CO 0.37 -0.70 -0.21 -0.06 -0.85 0.00 0.00 174.74 173.28 2dcr s PHE 62 N 1.64 2.50 0.42 1.40 0.08 -0.54 -5.01 117.98 118.47 2dcr s PHE 62 Ca -0.02 -0.36 -0.25 0.00 0.12 0.00 0.00 56.93 56.42 2dcr s PHE 62 Cb -0.18 -1.57 -0.08 0.00 -0.57 0.00 0.00 43.02 40.62 2dcr s PHE 62 CO -0.09 0.03 1.27 0.42 -0.10 0.00 0.00 175.22 176.76 2dcr s ILE 63 N -0.59 2.70 0.63 0.64 -1.09 -1.26 0.06 121.20 122.28 2dcr s ILE 63 Ca 0.09 0.60 -0.18 0.00 -2.23 0.00 0.00 60.65 58.93 2dcr s ILE 63 Cb -0.11 -3.34 -0.01 0.00 -1.58 0.00 0.00 42.46 37.42 2dcr s ILE 63 CO 0.00 0.07 1.22 -0.63 -1.23 0.00 0.00 174.94 174.37 2dcr s ILE 64 N -1.32 2.48 0.98 2.92 -1.09 0.06 -4.61 121.20 120.63 2dcr s ILE 64 Ca 0.59 0.28 -0.11 0.00 -2.23 0.00 0.00 60.65 59.18 2dcr s ILE 64 Cb -0.36 -3.04 0.18 0.00 -1.58 0.00 0.00 42.46 37.66 2dcr s ILE 64 CO 0.46 -0.08 1.09 -1.10 -1.23 0.00 0.00 174.94 174.07 2dcr s GLN 65 N -3.49 0.54 0.00 2.79 1.11 -1.26 -4.88 119.66 114.46 2dcr s GLN 65 Ca 0.77 1.04 0.00 0.00 0.01 0.00 0.00 55.36 57.19 2dcr s GLN 65 Cb -0.31 -1.71 0.00 0.00 -1.01 0.00 0.00 33.01 29.98 2dcr s GLN 65 CO 0.37 -2.80 0.00 0.45 0.01 0.00 0.00 175.29 173.32 2dcr n SER 66 N -4.30 0.00 0.00 5.90 2.88 -1.26 -4.82 113.62 112.02 2dcr n SER 66 Ca 0.07 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.61 2dcr n SER 66 Cb 0.54 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.00 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 0.05 2.46 -0.00 -1.20 -4.92 117.00 113.38 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 0.00 0.00 -0.67 -0.00 0.00 0.00 177.39 176.72 2dcr n ASP 68 N -0.89 0.66 -0.58 1.45 2.03 -1.26 -4.94 116.55 113.02 2dcr n ASP 68 Ca 0.00 0.14 0.00 0.00 0.52 0.00 0.00 54.79 55.46 2dcr n ASP 68 Cb 0.00 -0.16 -0.00 0.00 -0.72 0.00 0.00 41.12 40.24 2dcr n ASP 68 CO 0.00 0.00 0.00 -3.20 -1.92 0.00 0.00 177.20 172.08 2dcr n ASN 69 N -3.22 0.05 -3.91 1.67 5.15 -1.26 -5.10 115.26 108.63 2dcr n ASN 69 Ca 0.00 -1.77 -0.25 0.00 -0.60 0.00 0.00 54.58 51.96 2dcr n ASN 69 Cb 0.00 -0.15 -0.08 0.00 -0.53 0.00 0.00 39.78 39.02 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 1.95 -0.04 1.20 1.43 -1.26 -4.65 118.68 117.31 2dcr s LEU 70 Ca 0.02 -1.74 0.01 0.00 -1.03 0.00 0.00 54.13 51.39 2dcr s LEU 70 Cb 0.03 0.05 0.02 0.00 0.03 0.00 0.00 46.19 46.32 2dcr s LEU 70 CO -0.01 -1.01 -0.03 -0.31 0.23 0.00 0.00 176.35 175.22 2dcr s TYR 71 N -3.21 0.62 -0.04 0.29 2.02 -0.56 -3.24 117.35 113.23 2dcr s TYR 71 Ca 0.25 -0.14 -0.03 0.00 -0.37 0.00 0.00 57.07 56.77 2dcr s TYR 71 Cb 0.01 -0.59 0.01 0.00 -0.40 0.00 0.00 41.96 41.00 2dcr s TYR 71 CO 0.17 -0.17 0.10 -0.98 -1.57 0.00 0.00 175.55 173.10 2dcr s ARG 72 N 0.95 0.10 0.00 -0.62 1.04 -1.26 -1.38 118.95 117.79 2dcr s ARG 72 Ca -0.11 0.16 0.00 0.00 -1.04 0.00 0.00 55.73 54.74 2dcr s ARG 72 Cb -0.14 0.02 0.00 0.00 -2.04 0.00 0.00 34.95 32.79 2dcr s ARG 72 CO -0.00 -0.04 0.00 -0.11 -0.04 0.00 0.00 175.30 175.11 2dcr n LEU 73 N 3.20 0.00 -0.01 -1.89 7.94 -1.26 -4.72 117.00 120.26 2dcr n LEU 73 Ca -0.14 0.00 -0.02 0.00 -1.11 0.00 0.00 56.01 54.73 2dcr n LEU 73 Cb 0.58 0.00 -0.01 0.00 0.53 0.00 0.00 43.42 44.52 2dcr n LEU 73 CO 0.22 0.00 -0.18 1.21 -1.11 0.00 0.00 177.39 177.53 2dcr n GLU 74 N -0.52 0.14 0.00 1.96 0.00 -1.26 -4.62 120.64 116.34 2dcr n GLU 74 Ca 0.00 0.06 0.00 0.00 0.00 0.00 0.00 57.16 57.22 2dcr n GLU 74 Cb 0.05 -0.63 0.00 0.00 0.00 0.00 0.00 31.44 30.85 2dcr n GLU 74 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2dcr n GLY 75 N 2.42 1.22 3.91 8.31 0.00 -1.26 -5.13 105.19 114.67 2dcr n GLY 75 Ca -0.04 -0.10 -0.29 0.00 0.00 0.00 0.00 46.02 45.59 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 0.79 1.62 0.37 1.61 -1.05 -1.26 -4.94 118.70 115.83 2dcr s GLU 76 Ca 0.00 -0.07 0.08 0.00 -0.15 0.00 0.00 54.97 54.82 2dcr s GLU 76 Cb 0.00 -1.94 -0.03 0.00 -0.44 0.00 0.00 34.13 31.71 2dcr s GLU 76 CO 0.00 -1.79 0.24 0.20 0.95 0.00 0.00 175.26 174.86 2dcr s GLY 77 N -4.66 2.02 0.13 -3.83 0.00 -1.26 -4.33 107.32 95.38 2dcr s GLY 77 Ca 0.65 -1.85 0.04 0.00 0.00 0.00 0.00 44.72 43.56 2dcr s GLY 77 CO 0.50 -1.73 -0.10 -1.36 0.00 0.00 0.00 173.10 170.41 2dcr s PHE 78 N -2.44 1.18 -1.17 1.90 0.40 -0.48 -4.89 117.98 112.48 2dcr s PHE 78 Ca 0.42 -0.76 0.29 0.00 -0.60 0.00 0.00 56.93 56.28 2dcr s PHE 78 Cb -0.02 -0.62 1.34 0.00 0.51 0.00 0.00 43.02 44.23 2dcr s PHE 78 CO 0.25 0.04 1.97 -0.35 0.70 0.00 0.00 175.22 177.82 2dcr n PRO 79 N -0.02 0.17 -4.08 0.24 -0.04 -1.26 -1.49 135.00 128.52 2dcr n PRO 79 Ca -0.12 0.01 -0.12 0.00 -0.04 0.00 0.00 63.50 63.23 2dcr n PRO 79 Cb 0.60 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 32.45 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 -2.83 0.86 0.07 3.54 0.01 -1.26 -4.88 113.70 109.21 2dcr s SER 80 Ca 0.20 -0.64 -0.23 0.00 1.31 0.00 0.00 55.95 56.58 2dcr s SER 80 Cb 0.19 0.06 -0.16 0.00 0.21 0.00 0.00 66.02 66.32 2dcr s SER 80 CO 0.49 -0.27 1.66 0.40 0.41 0.00 0.00 173.24 175.93 2dcr h ILE 81 N 4.19 1.07 -0.04 1.44 2.04 -1.96 -2.98 117.51 121.27 2dcr h ILE 81 Ca -0.35 -0.20 -0.05 0.00 1.00 0.00 0.00 64.86 65.26 2dcr h ILE 81 Cb 1.19 1.20 -0.01 0.00 -0.74 0.00 0.00 36.82 38.47 2dcr h ILE 81 CO 0.46 0.05 -0.20 1.55 0.00 0.00 0.00 178.15 180.01 2dcr h PRO 82 N -0.08 0.06 -0.23 2.37 0.13 -1.90 -1.39 132.00 130.95 2dcr h PRO 82 Ca 0.00 -0.01 -0.09 0.00 -0.87 0.00 0.00 66.00 65.02 2dcr h PRO 82 Cb 0.09 -0.01 -0.01 0.00 0.13 0.00 0.00 31.00 31.19 2dcr h PRO 82 CO -0.00 0.26 -0.25 -0.07 -0.23 0.00 0.00 178.00 177.71 2dcr h LEU 83 N 0.05 0.45 -0.20 1.56 4.07 -1.67 -2.89 115.31 116.68 2dcr h LEU 83 Ca 0.01 -0.15 -0.21 0.00 0.08 0.00 0.00 57.88 57.61 2dcr h LEU 83 Cb 0.39 -0.12 -0.00 0.00 1.08 0.00 0.00 40.66 42.00 2dcr h LEU 83 CO 0.03 0.70 -0.93 0.25 -1.08 0.00 0.00 178.44 177.40 2dcr h LEU 84 N 0.39 0.38 -0.53 1.67 6.46 -1.13 -3.23 115.31 119.32 2dcr h LEU 84 Ca 0.06 -0.31 0.11 0.00 -0.12 0.00 0.00 57.88 57.61 2dcr h LEU 84 Cb 0.65 -0.12 -0.09 0.00 -0.73 0.00 0.00 40.66 40.38 2dcr h LEU 84 CO 0.05 1.12 -0.02 0.40 -0.62 0.00 0.00 178.44 179.37 2dcr h ILE 85 N 0.15 0.56 -0.75 4.05 1.08 -1.10 -1.50 117.51 120.01 2dcr h ILE 85 Ca -0.06 -0.03 -0.06 0.00 -0.39 0.00 0.00 64.86 64.31 2dcr h ILE 85 Cb 1.57 0.46 -0.03 0.00 -3.07 0.00 0.00 36.82 35.75 2dcr h ILE 85 CO 0.15 0.02 0.24 -0.78 -0.69 0.00 0.00 178.15 177.09 2dcr h ASP 86 N 0.10 1.09 0.41 1.72 3.58 -1.56 0.20 116.42 121.95 2dcr h ASP 86 Ca 0.27 -0.21 0.00 0.00 0.42 0.00 0.00 57.03 57.51 2dcr h ASP 86 Cb 0.41 -0.28 0.00 0.00 1.72 0.00 0.00 39.33 41.18 2dcr h ASP 86 CO -0.46 1.00 0.00 1.57 -2.88 0.00 0.00 179.24 178.47 2dcr n HIS 87 N -4.26 0.00 -0.10 0.28 -0.00 -0.79 -1.04 115.22 109.32 2dcr n HIS 87 Ca 0.06 0.00 -0.12 0.00 0.46 0.00 0.00 57.72 58.12 2dcr n HIS 87 Cb 0.23 -0.29 -0.12 0.00 -0.12 0.00 0.00 29.99 29.69 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 -1.29 1.59 -0.12 0.27 4.77 -0.63 -4.37 117.00 117.22 2dcr n LEU 88 Ca 0.10 -0.06 -0.11 0.00 -0.03 0.00 0.00 56.01 55.91 2dcr n LEU 88 Cb 0.17 -0.21 -0.02 0.00 -2.33 0.00 0.00 43.42 41.03 2dcr n LEU 88 CO 0.17 0.66 0.76 0.25 -1.33 0.00 0.00 177.39 177.90 2dcr h LEU 89 N 0.00 0.64 0.00 2.23 6.46 -0.24 0.48 115.31 124.88 2dcr h LEU 89 Ca -0.48 -0.33 0.00 0.00 -0.12 0.00 0.00 57.88 56.95 2dcr h LEU 89 Cb 1.90 -0.17 0.00 0.00 -0.73 0.00 0.00 40.66 41.66 2dcr h LEU 89 CO -0.03 0.81 -0.14 -1.28 -0.62 0.00 0.00 178.44 177.19 2dcr h SER 90 N 0.45 0.00 0.00 1.25 0.87 -1.32 -3.32 113.55 111.48 2dcr h SER 90 Ca 0.10 -0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.64 2dcr h SER 90 Cb 0.50 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.46 2dcr h SER 90 CO 0.02 0.01 -1.36 0.35 -0.53 0.00 0.00 176.83 175.32 2dcr n THR 91 N -2.67 0.00 -3.35 2.23 -2.24 -1.15 -5.03 114.28 102.08 2dcr n THR 91 Ca 0.04 -0.24 -0.16 0.00 -2.27 0.00 0.00 64.05 61.42 2dcr n THR 91 Cb 0.49 0.35 0.08 0.00 -2.10 0.00 0.00 70.33 69.14 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 -1.79 -4.77 -3.50 -0.78 1.13 0.15 -5.02 117.38 102.80 2dcr n GLN 92 Ca -0.01 0.85 -0.35 0.00 -1.94 0.00 0.00 57.00 55.55 2dcr n GLN 92 Cb 0.26 -5.83 -0.05 0.00 0.11 0.00 0.00 30.24 24.72 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 -4.95 3.83 0.31 -1.09 -0.21 -1.17 -4.91 119.66 111.48 2dcr s GLN 93 Ca 0.19 0.27 -0.28 0.00 0.02 0.00 0.00 55.36 55.56 2dcr s GLN 93 Cb -0.02 -2.95 -0.09 0.00 1.00 0.00 0.00 33.01 30.94 2dcr s GLN 93 CO 0.73 0.52 1.08 -1.25 -2.12 0.00 0.00 175.29 174.25 2dcr s PRO 94 N -2.01 4.51 0.42 2.91 0.04 -1.26 -4.30 135.00 135.32 2dcr s PRO 94 Ca 0.36 1.72 0.25 0.00 0.04 0.00 0.00 61.00 63.37 2dcr s PRO 94 Cb -0.14 -3.02 0.59 0.00 0.04 0.00 0.00 34.50 31.97 2dcr s PRO 94 CO 0.19 0.12 1.70 -0.07 0.04 0.00 0.00 177.00 178.98 2dcr h LEU 95 N 3.47 0.00 -7.00 -3.56 3.38 -1.02 -3.40 115.31 107.18 2dcr h LEU 95 Ca -0.47 0.00 0.10 0.00 0.09 0.00 0.00 57.88 57.60 2dcr h LEU 95 Cb 1.21 0.00 -0.17 0.00 0.09 0.00 0.00 40.66 41.79 2dcr h LEU 95 CO 0.66 0.00 0.49 0.28 0.09 0.00 0.00 178.44 179.96 2dcr s THR 96 N -3.28 0.00 0.49 0.22 -1.32 -1.26 -4.90 115.64 105.59 2dcr s THR 96 Ca 0.06 0.00 0.24 0.00 -1.21 0.00 0.00 61.69 60.79 2dcr s THR 96 Cb 0.07 -1.00 0.42 0.00 -1.51 0.00 0.00 72.50 70.48 2dcr s THR 96 CO 0.63 0.00 1.90 0.50 -2.21 0.00 0.00 174.62 175.44 2dcr h LYS 97 N 2.15 0.17 -0.22 7.08 1.63 -1.91 -1.07 116.57 124.41 2dcr h LYS 97 Ca -0.22 -0.01 -0.06 0.00 -0.85 0.00 0.00 60.65 59.51 2dcr h LYS 97 Cb 1.22 -0.04 -0.01 0.00 -0.60 0.00 0.00 32.23 32.80 2dcr h LYS 97 CO 0.31 0.11 -0.12 0.87 -3.45 0.00 0.00 179.45 177.17 2dcr h LYS 98 N 0.17 0.35 0.00 1.90 1.79 -2.00 -3.38 116.57 115.41 2dcr h LYS 98 Ca 0.40 -0.09 0.00 0.00 -2.18 0.00 0.00 60.65 58.78 2dcr h LYS 98 Cb 1.31 -0.04 0.00 0.00 -1.58 0.00 0.00 32.23 31.91 2dcr h LYS 98 CO -0.07 0.48 -0.01 -1.13 -1.08 0.00 0.00 179.45 177.64 2dcr n SER 99 N -4.24 0.03 -0.53 0.86 3.41 -0.92 -5.05 113.62 107.18 2dcr n SER 99 Ca -0.00 -0.10 -0.07 0.00 -0.26 0.00 0.00 58.87 58.44 2dcr n SER 99 Cb 0.29 0.20 -0.03 0.00 -0.26 0.00 0.00 64.21 64.41 2dcr n SER 99 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dcr n GLY 100 N 0.21 0.79 3.74 5.00 0.00 -0.45 -4.94 105.19 109.54 2dcr n GLY 100 Ca 0.00 -0.15 -0.40 0.00 0.00 0.00 0.00 46.02 45.47 2dcr n GLY 100 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dcr s VAL 101 N -1.87 4.16 0.02 1.61 0.11 -1.26 -4.61 120.40 118.55 2dcr s VAL 101 Ca 0.00 2.05 0.08 0.00 -2.93 0.00 0.00 61.98 61.17 2dcr s VAL 101 Cb 0.00 -4.30 -0.03 0.00 -1.53 0.00 0.00 36.38 30.52 2dcr s VAL 101 CO 0.00 0.43 -0.23 0.68 -3.33 0.00 0.00 175.10 172.65 2dcr s VAL 102 N -0.81 2.35 0.37 2.04 -7.23 -1.26 -0.43 120.40 115.42 2dcr s VAL 102 Ca 0.43 -1.21 -0.27 0.00 -1.81 0.00 0.00 61.98 59.12 2dcr s VAL 102 Cb -0.26 -1.91 -0.09 0.00 0.56 0.00 0.00 36.38 34.69 2dcr s VAL 102 CO 0.32 0.44 1.27 -0.76 -0.31 0.00 0.00 175.10 176.06 2dcr s LEU 103 N -1.06 4.31 0.00 1.32 1.43 -1.26 -4.76 118.68 118.65 2dcr s LEU 103 Ca 0.12 2.60 0.00 0.00 -1.03 0.00 0.00 54.13 55.82 2dcr s LEU 103 Cb -0.10 -3.81 0.00 0.00 0.03 0.00 0.00 46.19 42.31 2dcr s LEU 103 CO 0.02 -0.67 0.00 1.41 0.23 0.00 0.00 176.35 177.34 2dcr n HIS 104 N 0.43 0.00 -3.97 0.29 8.25 -1.11 -4.65 115.22 114.46 2dcr n HIS 104 Ca 0.02 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.38 2dcr n HIS 104 Cb 0.43 0.00 -0.12 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 0.28 -0.06 -0.41 6.06 0.15 -4.91 118.95 119.06 2dcr s ARG 105 Ca 0.00 -0.52 0.06 0.00 -2.50 0.00 0.00 55.73 52.77 2dcr s ARG 105 Cb 0.00 0.06 -0.01 0.00 0.06 0.00 0.00 34.95 35.06 2dcr s ARG 105 CO 0.00 -0.03 -0.23 0.00 -2.50 0.00 0.00 175.30 172.53 2dcr s ALA 106 N -1.21 2.24 -0.12 6.12 0.00 -1.26 -1.02 121.76 126.50 2dcr s ALA 106 Ca -0.13 -1.04 -0.26 0.00 0.00 0.00 0.00 51.96 50.53 2dcr s ALA 106 Cb -0.08 -0.71 -0.02 0.00 0.00 0.00 0.00 23.12 22.30 2dcr s ALA 106 CO -0.01 0.44 0.86 0.08 0.00 0.00 0.00 175.76 177.12 2dcr s VAL 107 N -0.25 4.89 -0.50 0.00 1.01 -1.18 -4.89 120.40 119.47 2dcr s VAL 107 Ca -0.01 1.72 -0.28 0.00 0.00 0.00 0.00 61.98 63.41 2dcr s VAL 107 Cb -0.13 -4.17 0.03 0.00 0.00 0.00 0.00 36.38 32.11 2dcr s VAL 107 CO 0.03 0.07 1.09 -2.16 0.00 0.00 0.00 175.10 174.14 2dcr s PRO 108 N 1.79 3.61 0.00 2.72 0.04 -1.26 -2.29 135.00 139.61 2dcr s PRO 108 Ca 0.41 0.36 0.24 0.00 0.04 0.00 0.00 61.00 62.06 2dcr s PRO 108 Cb -0.17 -3.94 0.92 0.00 0.04 0.00 0.00 34.50 31.34 2dcr s PRO 108 CO 0.16 -1.42 1.66 0.45 0.04 0.00 0.00 177.00 177.88 2dcr n SER 109 N 7.82 1.54 0.00 6.66 2.88 -0.15 -5.00 113.62 127.37 2dcr n SER 109 Ca 0.09 -1.59 0.00 0.00 -1.33 0.00 0.00 58.87 56.04 2dcr n SER 109 Cb 0.49 -0.05 0.00 0.00 -0.75 0.00 0.00 64.21 63.90 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 1.15 -2.16 0.12 0.46 0.00 -1.26 -4.58 105.19 98.91 2dcr n GLY 110 Ca 0.18 -1.49 0.14 0.00 0.00 0.00 0.00 46.02 44.85 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 -0.25 0.61 -3.92 1.61 -0.04 -1.26 -4.43 135.00 127.32 2dcr n PRO 111 Ca 0.00 -0.24 -0.08 0.00 -0.04 0.00 0.00 63.50 63.14 2dcr n PRO 111 Cb 0.00 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 31.93 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 -2.55 -0.18 0.29 3.54 0.15 -1.26 -4.58 113.70 109.11 2dcr s SER 112 Ca 0.26 -0.75 0.09 0.00 0.70 0.00 0.00 55.95 56.25 2dcr s SER 112 Cb 0.20 0.64 -0.04 0.00 -1.71 0.00 0.00 66.02 65.11 2dcr s SER 112 CO 0.50 -1.22 0.03 -0.44 1.20 0.00 0.00 173.24 173.32 2dcr s SER 113 N -2.96 4.52 0.00 5.45 0.01 -1.26 -5.03 113.70 114.43 2dcr s SER 113 Ca 0.16 -0.73 0.00 0.00 1.31 0.00 0.00 55.95 56.70 2dcr s SER 113 Cb -0.03 -0.77 0.00 0.00 0.21 0.00 0.00 66.02 65.43 2dcr s SER 113 CO 0.07 -0.10 0.00 0.61 0.41 0.00 0.00 173.24 174.23