#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2edr s SER 2 N 0.00 5.97 0.99 1.61 1.04 -1.26 -5.05 113.70 117.00 2edr s SER 2 Ca 0.00 1.85 -0.16 0.00 0.48 0.00 0.00 55.95 58.13 2edr s SER 2 Cb 0.00 -2.54 0.20 0.00 0.10 0.00 0.00 66.02 63.77 2edr s SER 2 CO 0.00 -1.04 1.23 -0.44 0.98 0.00 0.00 173.24 173.97 2edr s SER 3 N -2.53 2.86 0.00 7.02 0.01 -1.26 -5.05 113.70 114.76 2edr s SER 3 Ca 0.65 0.51 0.00 0.00 1.31 0.00 0.00 55.95 58.42 2edr s SER 3 Cb -0.16 -0.73 0.00 0.00 0.21 0.00 0.00 66.02 65.34 2edr s SER 3 CO 0.31 -2.91 0.00 0.61 0.41 0.00 0.00 173.24 171.66 2edr n GLY 4 N -2.87 0.15 3.72 3.44 0.00 -1.26 -5.14 105.19 103.22 2edr n GLY 4 Ca 0.13 0.26 -0.41 0.00 0.00 0.00 0.00 46.02 45.99 2edr n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2edr s SER 5 N 0.00 7.40 -0.32 1.61 0.01 -1.26 -4.93 113.70 116.20 2edr s SER 5 Ca 0.00 1.68 -0.43 0.00 1.31 0.00 0.00 55.95 58.52 2edr s SER 5 Cb 0.00 -2.57 -0.19 0.00 0.21 0.00 0.00 66.02 63.47 2edr s SER 5 CO 0.00 -0.17 1.37 -0.24 0.41 0.00 0.00 173.24 174.60 2edr n SER 6 N 3.43 0.77 0.00 2.44 2.88 -1.26 -4.94 113.62 116.95 2edr n SER 6 Ca 0.04 1.13 0.00 0.00 -1.33 0.00 0.00 58.87 58.71 2edr n SER 6 Cb 0.50 -0.86 0.00 0.00 -0.75 0.00 0.00 64.21 63.11 2edr n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2edr n GLY 7 N 3.04 0.53 3.10 0.46 0.00 -1.26 -5.04 105.19 106.02 2edr n GLY 7 Ca 0.26 -0.03 -0.26 0.00 0.00 0.00 0.00 46.02 45.99 2edr n GLY 7 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2edr n PRO 8 N 0.00 -2.91 -1.67 1.61 -0.04 -1.26 -4.91 135.00 125.81 2edr n PRO 8 Ca 0.00 -1.55 -0.46 0.00 -0.04 0.00 0.00 63.50 61.45 2edr n PRO 8 Cb 0.00 -1.45 -0.04 0.00 -0.04 0.00 0.00 33.50 31.97 2edr n PRO 8 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2edr n ALA 9 N -4.66 1.29 -2.62 0.55 0.00 -1.26 -4.95 120.51 108.85 2edr n ALA 9 Ca -0.18 0.39 -0.39 0.00 0.00 0.00 0.00 53.44 53.25 2edr n ALA 9 Cb 0.52 -2.42 -0.08 0.00 0.00 0.00 0.00 19.45 17.47 2edr n ALA 9 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.50 174.12 2edr s HIS 10 N 2.02 3.28 -0.83 0.00 -3.43 -1.26 -4.76 115.29 110.31 2edr s HIS 10 Ca 0.83 0.49 -0.32 0.00 -0.80 0.00 0.00 55.06 55.26 2edr s HIS 10 Cb -0.67 -2.58 -0.20 0.00 -1.43 0.00 0.00 32.58 27.70 2edr s HIS 10 CO 0.42 -0.18 2.42 1.19 -2.00 0.00 0.00 174.74 176.59 2edr n PHE 11 N 5.15 0.66 0.08 0.38 3.72 -1.26 -3.37 117.46 122.82 2edr n PHE 11 Ca -0.08 0.44 0.01 0.00 -0.05 0.00 0.00 57.45 57.78 2edr n PHE 11 Cb 0.51 -2.22 -0.03 0.00 -0.94 0.00 0.00 39.48 36.79 2edr n PHE 11 CO 0.00 0.00 0.00 -0.84 -0.05 0.00 0.00 176.76 175.87 2edr h ILE 12 N 7.32 0.71 -2.18 4.37 3.07 -1.79 -3.39 117.51 125.62 2edr h ILE 12 Ca -0.06 -2.14 -0.59 0.00 1.55 0.00 0.00 64.86 63.63 2edr h ILE 12 Cb 1.26 2.24 -0.42 0.00 -0.27 0.00 0.00 36.82 39.63 2edr h ILE 12 CO 1.24 0.40 -0.69 0.61 -1.05 0.00 0.00 178.15 178.66 2edr n GLY 13 N 1.31 4.66 2.69 0.16 0.00 -1.11 -5.01 105.19 107.89 2edr n GLY 13 Ca -0.04 -2.57 -0.36 0.00 0.00 0.00 0.00 46.02 43.05 2edr n GLY 13 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2edr n ARG 14 N 0.69 0.00 -0.22 1.61 5.12 -1.26 -3.29 116.66 119.30 2edr n ARG 14 Ca 0.29 0.00 -0.09 0.00 -1.93 0.00 0.00 57.85 56.12 2edr n ARG 14 Cb 0.43 -0.80 0.09 0.00 -1.16 0.00 0.00 32.46 31.02 2edr n ARG 14 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 2edr n LEU 15 N 1.71 0.00 -3.66 0.55 4.77 -1.26 -4.89 117.00 114.21 2edr n LEU 15 Ca 0.12 -0.26 -0.09 0.00 -0.03 0.00 0.00 56.01 55.75 2edr n LEU 15 Cb 0.25 -0.40 -0.10 0.00 -2.33 0.00 0.00 43.42 40.84 2edr n LEU 15 CO 0.44 -1.90 0.01 0.00 -1.33 0.00 0.00 177.39 174.62 2edr s ARG 16 N -2.76 0.32 -0.45 3.23 1.70 -1.26 -4.91 118.95 114.81 2edr s ARG 16 Ca 0.20 0.97 -0.46 0.00 -0.47 0.00 0.00 55.73 55.97 2edr s ARG 16 Cb -0.03 0.24 -0.19 0.00 -0.57 0.00 0.00 34.95 34.40 2edr s ARG 16 CO 0.16 -0.24 1.63 -2.39 -1.08 0.00 0.00 175.30 173.38 2edr n HIS 17 N 5.21 1.81 -5.16 5.89 1.44 -1.26 -4.89 115.22 118.26 2edr n HIS 17 Ca -0.11 1.03 -0.31 0.00 -2.01 0.00 0.00 57.72 56.32 2edr n HIS 17 Cb 0.50 -2.27 -0.15 0.00 0.12 0.00 0.00 29.99 28.19 2edr n HIS 17 CO 0.00 0.00 0.00 1.14 -2.81 0.00 0.00 176.34 174.67 2edr s GLN 18 N 3.09 2.10 -0.22 -1.40 -2.07 -1.19 -4.98 119.66 115.00 2edr s GLN 18 Ca 1.04 -0.93 -0.04 0.00 -1.82 0.00 0.00 55.36 53.60 2edr s GLN 18 Cb -1.41 -2.08 -0.01 0.00 -1.09 0.00 0.00 33.01 28.41 2edr s GLN 18 CO 0.79 0.56 -0.03 -2.00 -1.32 0.00 0.00 175.29 173.29 2edr s GLU 19 N -0.77 3.45 0.22 9.60 2.12 -1.26 -1.47 118.70 130.59 2edr s GLU 19 Ca 0.11 -0.59 0.00 0.00 0.36 0.00 0.00 54.97 54.85 2edr s GLU 19 Cb -0.10 -3.04 0.00 0.00 0.26 0.00 0.00 34.13 31.25 2edr s GLU 19 CO -0.00 -0.15 0.04 0.45 -0.54 0.00 0.00 175.26 175.06 2edr n SER 20 N 4.67 2.42 -4.63 -1.70 2.88 0.14 -4.96 113.62 112.45 2edr n SER 20 Ca -0.18 -1.93 -0.31 0.00 -1.33 0.00 0.00 58.87 55.13 2edr n SER 20 Cb 0.51 0.12 -0.09 0.00 -0.75 0.00 0.00 64.21 63.99 2edr n SER 20 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 2edr s ILE 21 N -1.65 3.73 0.21 2.46 -1.09 -1.26 -0.37 121.20 123.23 2edr s ILE 21 Ca 0.03 -0.95 -0.32 0.00 -2.23 0.00 0.00 60.65 57.19 2edr s ILE 21 Cb -0.00 -2.70 -0.12 0.00 -1.58 0.00 0.00 42.46 38.06 2edr s ILE 21 CO 0.02 0.24 1.70 -0.70 -1.23 0.00 0.00 174.94 174.96 2edr s GLU 22 N -1.89 4.13 0.00 2.79 2.12 0.32 -1.96 118.70 124.20 2edr s GLU 22 Ca 0.21 2.58 0.00 0.00 0.36 0.00 0.00 54.97 58.12 2edr s GLU 22 Cb -0.11 -3.07 0.00 0.00 0.26 0.00 0.00 34.13 31.20 2edr s GLU 22 CO 0.13 -0.73 0.00 0.41 -0.54 0.00 0.00 175.26 174.53 2edr n GLY 23 N 3.76 2.71 1.60 -1.50 0.00 0.07 -4.30 105.19 107.53 2edr n GLY 23 Ca 0.15 -0.27 -0.15 0.00 0.00 0.00 0.00 46.02 45.75 2edr n GLY 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2edr n ALA 24 N 0.00 -2.49 -3.82 4.61 0.00 -0.83 -3.02 120.51 114.95 2edr n ALA 24 Ca 0.00 -0.77 -0.35 0.00 0.00 0.00 0.00 53.44 52.32 2edr n ALA 24 Cb 0.00 -0.07 -0.12 0.00 0.00 0.00 0.00 19.45 19.26 2edr n ALA 24 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2edr s THR 25 N -1.61 3.04 0.47 0.00 2.01 -1.26 -0.97 115.64 117.32 2edr s THR 25 Ca 0.34 -2.08 -0.23 0.00 0.31 0.00 0.00 61.69 60.02 2edr s THR 25 Cb -0.06 -3.09 -0.07 0.00 0.01 0.00 0.00 72.50 69.29 2edr s THR 25 CO 0.28 -0.64 1.20 0.00 -0.69 0.00 0.00 174.62 174.77 2edr s ALA 26 N 1.09 2.96 -0.22 7.40 0.00 -0.17 -4.77 121.76 128.05 2edr s ALA 26 Ca 0.08 1.01 -0.04 0.00 0.00 0.00 0.00 51.96 53.02 2edr s ALA 26 Cb -0.22 -3.42 0.09 0.00 0.00 0.00 0.00 23.12 19.58 2edr s ALA 26 CO -0.05 -0.79 0.18 0.99 0.00 0.00 0.00 175.76 176.09 2edr s THR 27 N -1.49 -0.22 0.57 0.00 2.01 -1.25 -0.13 115.64 115.12 2edr s THR 27 Ca 0.65 -0.31 -0.04 0.00 0.31 0.00 0.00 61.69 62.30 2edr s THR 27 Cb -0.31 -0.75 0.01 0.00 0.01 0.00 0.00 72.50 71.46 2edr s THR 27 CO 0.37 -0.36 0.86 -0.76 -0.69 0.00 0.00 174.62 174.04 2edr s LEU 28 N 2.24 3.27 -0.23 4.42 1.43 0.15 -4.88 118.68 125.08 2edr s LEU 28 Ca 0.06 0.54 -0.20 0.00 -1.03 0.00 0.00 54.13 53.51 2edr s LEU 28 Cb -0.16 -3.36 0.06 0.00 0.03 0.00 0.00 46.19 42.76 2edr s LEU 28 CO -0.19 -1.06 0.61 -0.60 0.23 0.00 0.00 176.35 175.35 2edr s ARG 29 N -4.91 0.69 0.27 1.70 3.52 -1.26 -1.92 118.95 117.04 2edr s ARG 29 Ca 0.54 0.91 0.04 0.00 -0.13 0.00 0.00 55.73 57.09 2edr s ARG 29 Cb -0.10 0.29 -0.02 0.00 -1.56 0.00 0.00 34.95 33.56 2edr s ARG 29 CO 0.43 -0.10 0.16 0.00 -0.81 0.00 0.00 175.30 174.98 2edr s GLU 31 N -3.05 0.27 0.11 0.00 2.12 -1.21 -3.21 118.70 113.73 2edr s GLU 31 Ca 0.22 -0.31 0.08 0.00 0.36 0.00 0.00 54.97 55.32 2edr s GLU 31 Cb 0.01 -0.13 -0.04 0.00 0.26 0.00 0.00 34.13 34.23 2edr s GLU 31 CO 0.16 0.03 -0.20 -0.51 -0.54 0.00 0.00 175.26 174.19 2edr s LEU 32 N -0.62 2.32 0.63 2.70 1.43 0.18 -2.53 118.68 122.79 2edr s LEU 32 Ca -0.05 -0.71 0.40 0.00 -1.03 0.00 0.00 54.13 52.74 2edr s LEU 32 Cb -0.04 -0.87 2.16 0.00 0.03 0.00 0.00 46.19 47.46 2edr s LEU 32 CO -0.00 0.04 2.30 -1.28 0.23 0.00 0.00 176.35 177.64 2edr h SER 33 N 3.95 0.00 -4.03 2.29 0.87 -1.85 -3.44 113.55 111.34 2edr h SER 33 Ca -0.46 0.00 0.04 0.00 -1.23 0.00 0.00 61.79 60.15 2edr h SER 33 Cb 1.18 0.00 -0.23 0.00 -0.44 0.00 0.00 62.40 62.91 2edr h SER 33 CO 0.41 0.01 0.43 -1.59 -0.53 0.00 0.00 176.83 175.56 2edr s LYS 34 N -4.20 0.67 -0.45 2.24 -2.85 -1.26 -4.99 119.74 108.90 2edr s LYS 34 Ca -0.04 0.34 -0.43 0.00 -1.00 0.00 0.00 55.97 54.84 2edr s LYS 34 Cb 0.13 0.32 -0.17 0.00 -2.06 0.00 0.00 37.83 36.04 2edr s LYS 34 CO 0.46 -0.17 2.01 0.00 0.10 0.00 0.00 175.35 177.75 2edr n ALA 35 N 1.28 0.04 -3.27 0.59 0.00 -1.25 -4.69 120.51 113.21 2edr n ALA 35 Ca -0.13 0.22 -0.14 0.00 0.00 0.00 0.00 53.44 53.40 2edr n ALA 35 Cb 0.57 -2.15 -0.07 0.00 0.00 0.00 0.00 19.45 17.80 2edr n ALA 35 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2edr s ALA 36 N 5.44 -1.08 0.39 0.00 0.00 -1.26 -4.97 121.76 120.28 2edr s ALA 36 Ca 1.13 0.53 -0.26 0.00 0.00 0.00 0.00 51.96 53.36 2edr s ALA 36 Cb -1.34 0.17 -0.09 0.00 0.00 0.00 0.00 23.12 21.86 2edr s ALA 36 CO 0.66 -0.36 1.19 -1.25 0.00 0.00 0.00 175.76 176.00 2edr s PRO 37 N -1.76 4.10 0.37 0.00 0.04 -1.26 -5.01 135.00 131.47 2edr s PRO 37 Ca -0.10 1.91 0.03 0.00 0.04 0.00 0.00 61.00 62.88 2edr s PRO 37 Cb -0.02 -2.74 -0.04 0.00 0.04 0.00 0.00 34.50 31.73 2edr s PRO 37 CO 0.03 -0.30 0.10 0.14 0.04 0.00 0.00 177.00 177.00 2edr s VAL 38 N -1.36 0.82 -0.26 -0.36 -7.23 -1.26 -4.45 120.40 106.30 2edr s VAL 38 Ca 0.56 -2.00 -0.01 0.00 -1.81 0.00 0.00 61.98 58.71 2edr s VAL 38 Cb -0.32 -2.53 0.14 0.00 0.56 0.00 0.00 36.38 34.22 2edr s VAL 38 CO 0.41 0.00 0.35 -0.70 -0.31 0.00 0.00 175.10 174.85 2edr s GLU 39 N -3.81 0.34 0.37 4.82 2.56 0.62 -4.91 118.70 118.70 2edr s GLU 39 Ca 0.29 0.28 -0.26 0.00 0.00 0.00 0.00 54.97 55.28 2edr s GLU 39 Cb 0.05 -0.55 -0.09 0.00 2.00 0.00 0.00 34.13 35.54 2edr s GLU 39 CO 0.15 -0.81 1.16 -1.58 -0.56 0.00 0.00 175.26 173.62 2edr s TRP 40 N 2.49 3.18 -0.09 5.30 0.52 -1.26 -0.35 118.94 128.72 2edr s TRP 40 Ca 0.11 1.57 -0.01 0.00 0.02 0.00 0.00 56.10 57.79 2edr s TRP 40 Cb -0.14 -3.38 0.03 0.00 -1.15 0.00 0.00 33.47 28.83 2edr s TRP 40 CO -0.22 -1.17 -0.01 1.03 0.02 0.00 0.00 176.95 176.60 2edr s ARG 41 N -2.12 0.80 -1.08 4.98 0.52 0.24 -0.10 118.95 122.20 2edr s ARG 41 Ca 0.54 -0.02 -0.14 0.00 -0.52 0.00 0.00 55.73 55.59 2edr s ARG 41 Cb -0.31 -1.21 0.18 0.00 0.52 0.00 0.00 34.95 34.14 2edr s ARG 41 CO 0.39 -0.33 1.23 0.21 0.02 0.00 0.00 175.30 176.82 2edr s LYS 42 N 1.91 3.93 -0.20 3.54 2.20 -1.19 -1.06 119.74 128.87 2edr s LYS 42 Ca 0.04 -2.47 -0.11 0.00 -0.36 0.00 0.00 55.97 53.07 2edr s LYS 42 Cb -0.13 -4.87 0.04 0.00 -1.51 0.00 0.00 37.83 31.36 2edr s LYS 42 CO -0.06 -1.63 0.23 0.41 -0.36 0.00 0.00 175.35 173.94 2edr n GLY 43 N 4.21 -5.19 2.67 5.54 0.00 -1.12 -3.59 105.19 107.72 2edr n GLY 43 Ca 0.29 1.70 -0.04 0.00 0.00 0.00 0.00 46.02 47.96 2edr n GLY 43 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2edr n ARG 44 N 1.62 -2.78 -4.39 1.61 1.85 -1.26 -4.86 116.66 108.45 2edr n ARG 44 Ca -0.39 0.05 -0.19 0.00 -1.00 0.00 0.00 57.85 56.32 2edr n ARG 44 Cb 0.60 -4.57 -0.10 0.00 -1.05 0.00 0.00 32.46 27.33 2edr n ARG 44 CO 0.00 0.00 0.00 -2.00 -0.01 0.00 0.00 177.63 175.62 2edr s GLU 45 N -5.20 1.54 -0.10 2.89 2.56 -1.24 -5.15 118.70 114.00 2edr s GLU 45 Ca 0.07 -1.84 0.03 0.00 0.00 0.00 0.00 54.97 53.23 2edr s GLU 45 Cb -0.04 -0.65 0.01 0.00 2.00 0.00 0.00 34.13 35.45 2edr s GLU 45 CO 0.09 -0.21 -0.20 0.45 -0.56 0.00 0.00 175.26 174.83 2edr s SER 46 N -3.41 2.75 0.09 -1.70 0.15 -1.26 -3.17 113.70 107.15 2edr s SER 46 Ca 0.36 -0.50 0.01 0.00 0.70 0.00 0.00 55.95 56.52 2edr s SER 46 Cb 0.08 -1.26 -0.04 0.00 -1.71 0.00 0.00 66.02 63.09 2edr s SER 46 CO 0.14 0.10 0.23 -0.76 1.20 0.00 0.00 173.24 174.15 2edr s LEU 47 N 0.57 4.32 0.07 3.45 1.02 0.86 -4.87 118.68 124.09 2edr s LEU 47 Ca -0.14 0.21 -0.13 0.00 0.02 0.00 0.00 54.13 54.09 2edr s LEU 47 Cb -0.17 -2.91 0.02 0.00 0.02 0.00 0.00 46.19 43.15 2edr s LEU 47 CO 0.05 0.13 0.30 -0.13 0.02 0.00 0.00 176.35 176.71 2edr s ARG 48 N -2.77 0.87 -0.06 1.70 1.81 -1.26 -4.51 118.95 114.73 2edr s ARG 48 Ca 0.34 -0.66 -0.30 0.00 -1.72 0.00 0.00 55.73 53.40 2edr s ARG 48 Cb -0.12 0.37 -0.03 0.00 -0.45 0.00 0.00 34.95 34.72 2edr s ARG 48 CO 0.28 -0.29 1.25 0.34 -0.68 0.00 0.00 175.30 176.19 2edr s ASP 49 N -2.41 7.00 0.00 0.23 2.15 -1.26 -4.72 116.67 117.67 2edr s ASP 49 Ca -0.01 1.85 0.00 0.00 0.43 0.00 0.00 52.55 54.82 2edr s ASP 49 Cb 0.01 -2.56 0.00 0.00 -0.30 0.00 0.00 42.92 40.08 2edr s ASP 49 CO -0.07 -0.63 0.00 0.61 -0.17 0.00 0.00 175.17 174.91 2edr n GLY 50 N 3.45 4.08 0.00 2.66 0.00 -0.83 -5.01 105.19 109.54 2edr n GLY 50 Ca 0.12 -0.30 0.00 0.00 0.00 0.00 0.00 46.02 45.84 2edr n GLY 50 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2edr n ASP 51 N 0.00 0.00 -0.08 1.61 9.92 -1.26 -4.22 116.55 122.52 2edr n ASP 51 Ca 0.00 0.58 -0.17 0.00 -0.53 0.00 0.00 54.79 54.68 2edr n ASP 51 Cb 0.00 -0.20 -0.06 0.00 -0.64 0.00 0.00 41.12 40.22 2edr n ASP 51 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 2edr n ARG 52 N -1.85 0.36 -1.04 -1.24 5.12 -1.26 -4.97 116.66 111.79 2edr n ARG 52 Ca 0.00 0.15 -0.38 0.00 -1.93 0.00 0.00 57.85 55.69 2edr n ARG 52 Cb 0.00 -1.13 -0.10 0.00 -1.16 0.00 0.00 32.46 30.07 2edr n ARG 52 CO 0.00 0.00 0.00 0.72 -1.93 0.00 0.00 177.63 176.42 2edr n HIS 53 N -3.63 0.64 -3.93 -1.55 8.25 -1.26 -4.85 115.22 108.91 2edr n HIS 53 Ca -0.32 0.43 -0.36 0.00 -0.26 0.00 0.00 57.72 57.21 2edr n HIS 53 Cb 0.74 -1.76 -0.12 0.00 1.12 0.00 0.00 29.99 29.97 2edr n HIS 53 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2edr s SER 54 N 5.69 5.15 -0.23 0.41 0.15 -0.85 -1.96 113.70 122.07 2edr s SER 54 Ca 0.97 -0.14 0.12 0.00 0.70 0.00 0.00 55.95 57.60 2edr s SER 54 Cb -1.04 -1.90 0.47 0.00 -1.71 0.00 0.00 66.02 61.84 2edr s SER 54 CO 0.43 0.04 1.38 0.18 1.20 0.00 0.00 173.24 176.47 2edr n LEU 55 N 4.39 3.61 -4.31 3.45 7.99 -1.26 -0.21 117.00 130.67 2edr n LEU 55 Ca -0.16 -3.55 -0.40 0.00 -0.01 0.00 0.00 56.01 51.89 2edr n LEU 55 Cb 0.52 -0.57 0.01 0.00 -0.11 0.00 0.00 43.42 43.27 2edr n LEU 55 CO 0.32 1.09 -0.43 -2.11 -1.51 0.00 0.00 177.39 174.75 2edr n ARG 56 N -1.04 0.13 -4.27 3.23 1.85 -1.23 -4.62 116.66 110.70 2edr n ARG 56 Ca 0.26 0.05 -0.19 0.00 -1.00 0.00 0.00 57.85 56.97 2edr n ARG 56 Cb 0.90 -1.15 -0.13 0.00 -1.05 0.00 0.00 32.46 31.03 2edr n ARG 56 CO 0.00 0.00 0.00 -0.65 -0.01 0.00 0.00 177.63 176.97 2edr s GLN 57 N -1.22 0.83 -0.52 2.89 -0.21 -1.26 -2.64 119.66 117.53 2edr s GLN 57 Ca 0.60 -0.76 0.05 0.00 0.02 0.00 0.00 55.36 55.27 2edr s GLN 57 Cb -0.53 -0.81 0.18 0.00 1.00 0.00 0.00 33.01 32.86 2edr s GLN 57 CO 0.63 0.19 0.44 -3.47 -2.12 0.00 0.00 175.29 170.96 2edr n ASP 58 N 1.79 1.02 0.00 5.90 -0.08 0.39 -5.02 116.55 120.55 2edr n ASP 58 Ca -0.19 -2.76 0.00 0.00 -1.51 0.00 0.00 54.79 50.34 2edr n ASP 58 Cb 0.55 -0.64 0.00 0.00 2.34 0.00 0.00 41.12 43.37 2edr n ASP 58 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2edr n GLY 59 N 2.25 1.63 1.22 0.27 0.00 -1.26 -2.63 105.19 106.68 2edr n GLY 59 Ca 0.26 -0.03 0.08 0.00 0.00 0.00 0.00 46.02 46.33 2edr n GLY 59 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2edr n ALA 60 N 6.45 3.10 -3.60 4.61 0.00 -1.26 -3.96 120.51 125.85 2edr n ALA 60 Ca 0.00 -1.93 -0.27 0.00 0.00 0.00 0.00 53.44 51.24 2edr n ALA 60 Cb 0.00 -0.82 -0.17 0.00 0.00 0.00 0.00 19.45 18.46 2edr n ALA 60 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2edr s VAL 61 N -2.38 1.31 0.18 0.00 1.01 -1.08 0.50 120.40 119.94 2edr s VAL 61 Ca 0.44 -0.54 0.07 0.00 0.00 0.00 0.00 61.98 61.95 2edr s VAL 61 Cb 0.33 -1.21 -0.04 0.00 0.00 0.00 0.00 36.38 35.46 2edr s VAL 61 CO 0.14 0.40 0.00 0.00 0.00 0.00 0.00 175.10 175.65 2edr s GLU 63 N -2.99 0.10 -0.27 0.00 2.02 -1.08 -1.61 118.70 114.87 2edr s GLU 63 Ca 0.28 0.37 -0.05 0.00 0.02 0.00 0.00 54.97 55.59 2edr s GLU 63 Cb -0.09 -0.16 0.01 0.00 0.10 0.00 0.00 34.13 33.99 2edr s GLU 63 CO 0.19 -0.16 0.02 -1.17 0.02 0.00 0.00 175.26 174.16 2edr s LEU 64 N 1.12 3.56 -0.16 1.80 2.96 -0.81 -3.52 118.68 123.64 2edr s LEU 64 Ca -0.09 -0.74 -0.08 0.00 -0.22 0.00 0.00 54.13 53.01 2edr s LEU 64 Cb -0.11 -1.80 -0.04 0.00 0.50 0.00 0.00 46.19 44.74 2edr s LEU 64 CO -0.06 -0.16 0.11 -1.58 -1.32 0.00 0.00 176.35 173.34 2edr s GLN 65 N 1.44 3.79 -0.18 1.98 0.74 0.71 -0.68 119.66 127.47 2edr s GLN 65 Ca 0.02 -0.23 -0.03 0.00 0.05 0.00 0.00 55.36 55.17 2edr s GLN 65 Cb -0.17 -3.25 0.06 0.00 1.10 0.00 0.00 33.01 30.75 2edr s GLN 65 CO -0.00 0.49 0.04 0.42 -0.55 0.00 0.00 175.29 175.69 2edr s ILE 66 N -0.22 0.45 0.56 -2.34 1.01 0.82 -2.00 121.20 119.48 2edr s ILE 66 Ca 0.10 -0.43 -0.05 0.00 0.00 0.00 0.00 60.65 60.27 2edr s ILE 66 Cb -0.12 -0.92 0.00 0.00 0.01 0.00 0.00 42.46 41.43 2edr s ILE 66 CO 0.01 -0.15 0.86 0.00 0.00 0.00 0.00 174.94 175.65 2edr n GLY 68 N -2.48 -0.37 3.45 0.00 0.00 -1.20 -4.95 105.19 99.65 2edr n GLY 68 Ca 0.04 0.12 -0.32 0.00 0.00 0.00 0.00 46.02 45.85 2edr n GLY 68 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2edr n LEU 69 N -4.13 0.14 -3.66 0.99 4.77 -0.14 -4.69 117.00 110.29 2edr n LEU 69 Ca -0.29 0.24 -0.08 0.00 -0.03 0.00 0.00 56.01 55.86 2edr n LEU 69 Cb 0.67 -1.23 -0.08 0.00 -2.33 0.00 0.00 43.42 40.45 2edr n LEU 69 CO 0.62 -3.20 0.26 0.00 -1.33 0.00 0.00 177.39 173.75 2edr s ALA 70 N -2.43 -1.65 0.61 -1.18 0.00 -1.26 -0.75 121.76 115.10 2edr s ALA 70 Ca 0.60 2.17 0.24 0.00 0.00 0.00 0.00 51.96 54.97 2edr s ALA 70 Cb -0.20 -1.31 0.89 0.00 0.00 0.00 0.00 23.12 22.49 2edr s ALA 70 CO 0.65 -0.38 1.33 0.28 0.00 0.00 0.00 175.76 177.64 2edr h VAL 71 N 5.21 0.03 0.02 0.00 2.07 -1.89 1.56 116.25 123.25 2edr h VAL 71 Ca -0.31 0.00 -0.26 0.00 0.82 0.00 0.00 66.70 66.95 2edr h VAL 71 Cb 1.21 0.07 0.02 0.00 -1.52 0.00 0.00 31.29 31.07 2edr h VAL 71 CO 0.19 0.00 -1.03 0.00 0.02 0.00 0.00 177.57 176.75 2edr h ALA 72 N 0.57 0.09 -0.70 1.67 0.00 -1.96 -3.21 119.26 115.71 2edr h ALA 72 Ca 0.41 -0.70 0.18 0.00 0.00 0.00 0.00 54.91 54.81 2edr h ALA 72 Cb 2.66 0.07 -0.04 0.00 0.00 0.00 0.00 17.79 20.48 2edr h ALA 72 CO -0.00 0.64 0.49 -0.44 0.00 0.00 0.00 179.25 179.94 2edr h ASP 73 N 0.31 0.12 -2.79 0.00 5.19 0.19 -3.42 116.42 116.02 2edr h ASP 73 Ca -0.14 0.01 -0.59 0.00 -0.62 0.00 0.00 57.03 55.69 2edr h ASP 73 Cb 1.70 -0.01 0.12 0.00 0.18 0.00 0.00 39.33 41.32 2edr h ASP 73 CO 0.20 0.06 0.11 0.00 -3.12 0.00 0.00 179.24 176.49 2edr n ALA 74 N -2.62 -0.09 0.00 3.45 0.00 -1.19 -4.72 120.51 115.34 2edr n ALA 74 Ca 0.14 0.28 0.00 0.00 0.00 0.00 0.00 53.44 53.86 2edr n ALA 74 Cb 0.69 -2.04 0.00 0.00 0.00 0.00 0.00 19.45 18.10 2edr n ALA 74 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2edr n GLY 75 N 1.24 -1.78 3.15 0.00 0.00 -1.13 -5.02 105.19 101.66 2edr n GLY 75 Ca 0.09 0.71 0.05 0.00 0.00 0.00 0.00 46.02 46.88 2edr n GLY 75 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2edr s GLU 76 N 0.00 0.20 0.33 1.61 2.12 -1.26 -3.46 118.70 118.24 2edr s GLU 76 Ca 0.00 0.33 -0.03 0.00 0.36 0.00 0.00 54.97 55.64 2edr s GLU 76 Cb 0.00 0.18 -0.04 0.00 0.26 0.00 0.00 34.13 34.53 2edr s GLU 76 CO 0.00 -0.25 0.57 0.71 -0.54 0.00 0.00 175.26 175.75 2edr s TYR 77 N 2.95 3.50 -0.04 5.30 1.51 -1.20 -2.78 117.35 126.59 2edr s TYR 77 Ca 0.04 0.54 -0.04 0.00 -1.01 0.00 0.00 57.07 56.61 2edr s TYR 77 Cb -0.09 -2.04 0.01 0.00 -0.11 0.00 0.00 41.96 39.73 2edr s TYR 77 CO -0.13 0.10 0.11 -1.12 -1.11 0.00 0.00 175.55 173.40 2edr s SER 78 N -3.61 -0.12 -0.33 2.29 0.01 -0.22 -0.78 113.70 110.94 2edr s SER 78 Ca 0.43 0.23 -0.09 0.00 1.31 0.00 0.00 55.95 57.83 2edr s SER 78 Cb -0.10 0.23 0.01 0.00 0.21 0.00 0.00 66.02 66.37 2edr s SER 78 CO 0.34 -0.04 0.14 0.00 0.41 0.00 0.00 173.24 174.09 2edr s VAL 80 N 1.54 5.31 -0.13 0.00 1.01 0.52 -2.89 120.40 125.76 2edr s VAL 80 Ca 0.03 0.48 -0.01 0.00 0.00 0.00 0.00 61.98 62.48 2edr s VAL 80 Cb -0.18 -3.61 -0.08 0.00 0.00 0.00 0.00 36.38 32.51 2edr s VAL 80 CO 0.05 0.36 -0.13 0.00 0.00 0.00 0.00 175.10 175.38 2edr n GLY 82 N 2.68 -1.78 0.04 0.00 0.00 -1.26 -4.72 105.19 100.16 2edr n GLY 82 Ca -0.24 0.65 -0.05 0.00 0.00 0.00 0.00 46.02 46.38 2edr n GLY 82 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2edr n GLU 83 N -2.36 2.09 -4.43 1.61 1.02 -1.26 -5.00 120.64 112.31 2edr n GLU 83 Ca 0.00 0.01 -0.35 0.00 -0.02 0.00 0.00 57.16 56.80 2edr n GLU 83 Cb 0.00 -1.22 -0.10 0.00 -0.02 0.00 0.00 31.44 30.11 2edr n GLU 83 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 2edr s GLU 84 N -2.21 2.95 -0.06 3.49 0.41 -1.26 -5.11 118.70 116.92 2edr s GLU 84 Ca -0.07 -0.44 -0.02 0.00 -0.41 0.00 0.00 54.97 54.04 2edr s GLU 84 Cb 0.03 -2.76 0.03 0.00 -1.78 0.00 0.00 34.13 29.65 2edr s GLU 84 CO 0.32 0.68 0.02 0.50 -0.49 0.00 0.00 175.26 176.30 2edr s ARG 85 N -0.84 0.41 0.41 1.61 3.52 -1.26 -3.27 118.95 119.53 2edr s ARG 85 Ca 0.13 0.19 0.06 0.00 -0.13 0.00 0.00 55.73 55.97 2edr s ARG 85 Cb -0.11 -0.84 0.00 0.00 -1.56 0.00 0.00 34.95 32.44 2edr s ARG 85 CO 0.02 -0.31 0.57 -0.08 -0.81 0.00 0.00 175.30 174.69 2edr s THR 86 N 2.03 3.49 0.01 4.11 -1.32 -1.14 -4.91 115.64 117.91 2edr s THR 86 Ca 0.05 -0.89 -0.08 0.00 -1.21 0.00 0.00 61.69 59.56 2edr s THR 86 Cb -0.12 -3.22 0.00 0.00 -1.51 0.00 0.00 72.50 67.66 2edr s THR 86 CO -0.05 -0.10 0.16 -0.44 -2.21 0.00 0.00 174.62 171.98 2edr s SER 87 N -4.28 0.02 -0.21 8.08 0.01 -1.26 -1.21 113.70 114.85 2edr s SER 87 Ca 0.51 -0.23 -0.04 0.00 1.31 0.00 0.00 55.95 57.50 2edr s SER 87 Cb -0.10 0.23 0.09 0.00 0.21 0.00 0.00 66.02 66.45 2edr s SER 87 CO 0.34 -0.42 0.20 0.00 0.41 0.00 0.00 173.24 173.77 2edr s ALA 88 N -1.65 -0.09 -0.10 1.44 0.00 0.04 -4.65 121.76 116.75 2edr s ALA 88 Ca -0.13 -0.02 -0.35 0.00 0.00 0.00 0.00 51.96 51.47 2edr s ALA 88 Cb -0.06 -1.33 -0.12 0.00 0.00 0.00 0.00 23.12 21.61 2edr s ALA 88 CO 0.01 -1.29 1.86 2.41 0.00 0.00 0.00 175.76 178.74 2edr n THR 89 N 5.30 0.54 -3.68 0.00 -1.04 -1.26 -3.23 114.28 110.92 2edr n THR 89 Ca -0.05 -0.10 -0.37 0.00 -2.04 0.00 0.00 64.05 61.49 2edr n THR 89 Cb 0.48 -1.81 -0.06 0.00 -1.82 0.00 0.00 70.33 67.12 2edr n THR 89 CO 0.00 0.00 0.00 -0.22 -0.64 0.00 0.00 175.07 174.21 2edr s LEU 90 N 3.95 4.38 -0.13 -4.42 2.96 -1.22 -3.16 118.68 121.03 2edr s LEU 90 Ca 0.93 0.62 0.03 0.00 -0.22 0.00 0.00 54.13 55.49 2edr s LEU 90 Cb -0.73 -2.30 0.01 0.00 0.50 0.00 0.00 46.19 43.67 2edr s LEU 90 CO 0.53 0.31 -0.22 -0.89 -1.32 0.00 0.00 176.35 174.76 2edr s THR 91 N -0.67 2.12 -0.06 3.68 2.01 -0.54 -2.83 115.64 119.35 2edr s THR 91 Ca 0.18 -0.97 -0.01 0.00 0.31 0.00 0.00 61.69 61.20 2edr s THR 91 Cb -0.14 -1.84 -0.03 0.00 0.01 0.00 0.00 72.50 70.50 2edr s THR 91 CO 0.07 0.55 0.01 -0.69 -0.69 0.00 0.00 174.62 173.86 2edr s VAL 92 N 0.72 4.30 0.38 3.82 1.01 -1.26 0.28 120.40 129.66 2edr s VAL 92 Ca -0.09 -0.33 0.08 0.00 0.00 0.00 0.00 61.98 61.64 2edr s VAL 92 Cb -0.16 -2.84 -0.02 0.00 0.00 0.00 0.00 36.38 33.36 2edr s VAL 92 CO 0.00 0.55 0.33 -0.54 0.00 0.00 0.00 175.10 175.44 2edr s LYS 93 N -1.06 2.58 -0.36 2.72 -0.14 0.50 -4.86 119.74 119.12 2edr s LYS 93 Ca 0.15 -1.46 -0.17 0.00 -1.36 0.00 0.00 55.97 53.13 2edr s LYS 93 Cb -0.11 -2.39 -0.00 0.00 -1.68 0.00 0.00 37.83 33.64 2edr s LYS 93 CO 0.04 -0.07 0.44 0.00 -0.76 0.00 0.00 175.35 175.00 2edr s ALA 94 N -2.41 3.47 0.42 5.17 0.00 -1.26 0.12 121.76 127.27 2edr s ALA 94 Ca 0.45 -1.18 -0.25 0.00 0.00 0.00 0.00 51.96 50.98 2edr s ALA 94 Cb -0.04 -2.95 -0.08 0.00 0.00 0.00 0.00 23.12 20.05 2edr s ALA 94 CO 0.27 -1.23 1.24 -0.48 0.00 0.00 0.00 175.76 175.55 2edr s LEU 95 N 2.20 4.15 -0.66 0.00 0.05 -1.26 -4.86 118.68 118.30 2edr s LEU 95 Ca 0.15 2.50 -0.26 0.00 0.05 0.00 0.00 54.13 56.56 2edr s LEU 95 Cb -0.16 -4.03 -0.03 0.00 -2.05 0.00 0.00 46.19 39.93 2edr s LEU 95 CO 0.13 -0.86 1.88 -2.16 -0.55 0.00 0.00 176.35 174.79 2edr s PRO 96 N -2.38 2.61 -0.56 1.48 0.04 -1.26 -4.84 135.00 130.09 2edr s PRO 96 Ca 0.59 0.47 0.01 0.00 0.04 0.00 0.00 61.00 62.11 2edr s PRO 96 Cb -0.34 -4.50 0.44 0.00 0.04 0.00 0.00 34.50 30.14 2edr s PRO 96 CO 0.43 -2.84 1.71 -1.13 0.04 0.00 0.00 177.00 175.21 2edr n SER 97 N 12.96 6.63 -3.74 6.66 3.41 -1.26 -4.93 113.62 133.35 2edr n SER 97 Ca 0.24 -3.78 -0.23 0.00 -0.26 0.00 0.00 58.87 54.84 2edr n SER 97 Cb 0.51 -0.76 -0.17 0.00 -0.26 0.00 0.00 64.21 63.53 2edr n SER 97 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2edr s GLY 98 N -2.41 0.45 0.63 5.00 0.00 -1.26 -5.14 107.32 104.58 2edr s GLY 98 Ca 0.58 -0.14 -0.16 0.00 0.00 0.00 0.00 44.72 45.00 2edr s GLY 98 CO -0.05 1.24 1.11 2.56 0.00 0.00 0.00 173.10 177.96 2edr s PRO 99 N 2.00 2.96 -0.68 2.90 0.04 -1.26 -4.87 135.00 136.09 2edr s PRO 99 Ca 0.04 1.45 -0.25 0.00 0.04 0.00 0.00 61.00 62.28 2edr s PRO 99 Cb -0.13 -1.97 -0.12 0.00 0.04 0.00 0.00 34.50 32.32 2edr s PRO 99 CO -0.05 -1.14 2.42 0.43 0.04 0.00 0.00 177.00 178.70 2edr n SER 100 N -2.11 1.83 -3.14 6.66 7.64 -1.26 -4.81 113.62 118.43 2edr n SER 100 Ca 0.11 -1.01 -0.10 0.00 1.01 0.00 0.00 58.87 58.88 2edr n SER 100 Cb 0.52 -1.56 0.00 0.00 -1.01 0.00 0.00 64.21 62.16 2edr n SER 100 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2edr s SER 101 N 10.96 0.14 0.00 6.43 1.04 -1.26 -5.35 113.70 125.66 2edr s SER 101 Ca 0.98 -1.14 0.00 0.00 0.48 0.00 0.00 55.95 56.27 2edr s SER 101 Cb -0.21 0.79 0.00 0.00 0.10 0.00 0.00 66.02 66.70 2edr s SER 101 CO 0.19 -1.56 0.00 0.61 0.98 0.00 0.00 173.24 173.46