#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 4.03 -1.03 1.61 0.01 -1.26 -5.08 113.70 111.98 2edr s SER 2 Ca 0.00 -1.28 -0.09 0.00 1.31 0.00 0.00 55.95 55.89 2edr s SER 2 Cb 0.00 -0.42 0.26 0.00 0.21 0.00 0.00 66.02 66.07 2edr s SER 2 CO 0.00 -0.47 1.01 -0.44 0.41 0.00 0.00 173.24 173.75 2edr s SER 3 N -3.76 7.05 0.00 2.44 0.01 -1.26 -4.94 113.70 113.24 2edr s SER 3 Ca 0.37 -3.45 0.00 0.00 1.31 0.00 0.00 55.95 54.18 2edr s SER 3 Cb 0.08 -2.17 0.00 0.00 0.21 0.00 0.00 66.02 64.14 2edr s SER 3 CO 0.19 -0.32 0.00 0.61 0.41 0.00 0.00 173.24 174.13 2edr n GLY 4 N 2.88 3.85 0.48 3.44 0.00 -1.26 -5.07 105.19 109.52 2edr n GLY 4 Ca 0.22 -0.65 -0.14 0.00 0.00 0.00 0.00 46.02 45.45 2edr n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2edr n SER 5 N 0.00 1.32 -4.61 1.61 2.88 -1.26 -4.96 113.62 108.60 2edr n SER 5 Ca 0.00 0.13 -0.41 0.00 -1.33 0.00 0.00 58.87 57.27 2edr n SER 5 Cb 0.00 -0.38 -0.07 0.00 -0.75 0.00 0.00 64.21 63.01 2edr n SER 5 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2edr s SER 6 N -6.10 6.47 0.27 -3.46 0.15 -1.26 -5.06 113.70 104.71 2edr s SER 6 Ca -0.19 0.49 -0.01 0.00 0.70 0.00 0.00 55.95 56.94 2edr s SER 6 Cb 0.07 -2.31 -0.04 0.00 -1.71 0.00 0.00 66.02 62.03 2edr s SER 6 CO 0.26 -0.38 0.47 -0.83 1.20 0.00 0.00 173.24 173.96 2edr s GLY 7 N 1.58 1.61 1.22 9.45 0.00 -1.26 -5.10 107.32 114.81 2edr s GLY 7 Ca 0.23 -0.84 -0.20 0.00 0.00 0.00 0.00 44.72 43.91 2edr s GLY 7 CO 0.10 -0.78 1.11 2.56 0.00 0.00 0.00 173.10 176.09 2edr s PRO 8 N -3.74 -1.39 0.15 2.90 0.04 -1.26 -4.93 135.00 126.77 2edr s PRO 8 Ca 0.40 -0.12 -0.31 0.00 0.04 0.00 0.00 61.00 61.00 2edr s PRO 8 Cb -0.10 -1.58 -0.11 0.00 0.04 0.00 0.00 34.50 32.75 2edr s PRO 8 CO 0.31 -3.81 1.73 0.00 0.04 0.00 0.00 177.00 175.28 2edr s ALA 9 N -3.01 3.81 -0.23 8.56 0.00 -1.26 -4.97 121.76 124.66 2edr s ALA 9 Ca 0.71 1.45 -0.13 0.00 0.00 0.00 0.00 51.96 53.99 2edr s ALA 9 Cb -0.09 -3.71 -0.04 0.00 0.00 0.00 0.00 23.12 19.28 2edr s ALA 9 CO 0.56 -1.04 0.29 -3.38 0.00 0.00 0.00 175.76 172.19 2edr s HIS 10 N 1.98 3.32 -0.96 0.00 -3.43 -1.26 -4.70 115.29 110.24 2edr s HIS 10 Ca 0.76 0.40 -0.22 0.00 -0.80 0.00 0.00 55.06 55.20 2edr s HIS 10 Cb -0.46 -2.43 -0.25 0.00 -1.43 0.00 0.00 32.58 28.01 2edr s HIS 10 CO 0.34 -0.03 2.47 1.19 -2.00 0.00 0.00 174.74 176.71 2edr n PHE 11 N 4.58 0.43 0.17 0.38 3.72 -1.26 -2.97 117.46 122.51 2edr n PHE 11 Ca -0.11 0.21 0.06 0.00 -0.05 0.00 0.00 57.45 57.55 2edr n PHE 11 Cb 0.51 -1.72 0.14 0.00 -0.94 0.00 0.00 39.48 37.47 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 7.60 0.66 -2.49 4.37 3.07 -1.84 -3.38 117.51 125.50 2edr h ILE 12 Ca -0.03 -1.80 -0.60 0.00 1.55 0.00 0.00 64.86 63.99 2edr h ILE 12 Cb 1.23 2.22 -0.40 0.00 -0.27 0.00 0.00 36.82 39.60 2edr h ILE 12 CO 1.45 0.36 -0.81 0.61 -1.05 0.00 0.00 178.15 178.70 2edr n GLY 13 N 0.98 3.29 3.05 0.16 0.00 -1.21 -5.03 105.19 106.43 2edr n GLY 13 Ca 0.02 -1.99 -0.36 0.00 0.00 0.00 0.00 46.02 43.69 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 1.98 -0.05 -0.30 1.61 1.74 -1.26 -3.19 116.66 117.19 2edr n ARG 14 Ca 0.25 -0.01 -0.15 0.00 -0.77 0.00 0.00 57.85 57.17 2edr n ARG 14 Cb 0.44 -1.10 0.14 0.00 -1.02 0.00 0.00 32.46 30.91 2edr n ARG 14 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 2edr n LEU 15 N 2.91 0.00 -3.69 0.55 4.77 -1.26 -4.83 117.00 115.45 2edr n LEU 15 Ca -0.01 -0.50 -0.11 0.00 -0.03 0.00 0.00 56.01 55.36 2edr n LEU 15 Cb 0.57 -0.50 -0.11 0.00 -2.33 0.00 0.00 43.42 41.05 2edr n LEU 15 CO 0.52 -1.91 -0.02 0.00 -1.33 0.00 0.00 177.39 174.65 2edr s ARG 16 N -4.13 0.29 -0.12 3.23 1.70 -1.26 -4.90 118.95 113.76 2edr s ARG 16 Ca 0.34 0.79 -0.41 0.00 -0.47 0.00 0.00 55.73 55.98 2edr s ARG 16 Cb -0.05 0.04 -0.19 0.00 -0.57 0.00 0.00 34.95 34.18 2edr s ARG 16 CO 0.28 -0.21 1.33 1.58 -1.08 0.00 0.00 175.30 177.20 2edr n HIS 17 N 4.73 1.27 -4.67 5.89 -0.00 -1.26 -4.87 115.22 116.30 2edr n HIS 17 Ca -0.17 0.91 -0.25 0.00 -0.00 0.00 0.00 57.72 58.21 2edr n HIS 17 Cb 0.52 -2.23 -0.16 0.00 -0.00 0.00 0.00 29.99 28.12 2edr n HIS 17 CO 0.00 0.00 0.00 1.14 -0.00 0.00 0.00 176.34 177.48 2edr s GLN 18 N 1.19 1.72 -0.49 1.57 -2.07 -1.16 -5.00 119.66 115.41 2edr s GLN 18 Ca 0.93 -0.48 -0.16 0.00 -1.82 0.00 0.00 55.36 53.83 2edr s GLN 18 Cb -1.21 -1.44 0.08 0.00 -1.09 0.00 0.00 33.01 29.34 2edr s GLN 18 CO 0.61 0.11 0.46 -2.00 -1.32 0.00 0.00 175.29 173.14 2edr s GLU 19 N 0.41 3.01 0.65 9.60 2.12 -1.26 -2.03 118.70 131.20 2edr s GLU 19 Ca -0.10 -1.30 0.05 0.00 0.36 0.00 0.00 54.97 53.97 2edr s GLU 19 Cb -0.14 -4.15 0.11 0.00 0.26 0.00 0.00 34.13 30.22 2edr s GLU 19 CO 0.03 -1.11 0.90 -1.12 -0.54 0.00 0.00 175.26 173.43 2edr s SER 20 N 2.74 4.69 0.05 -1.70 0.01 0.16 -4.97 113.70 114.68 2edr s SER 20 Ca 0.06 -0.63 0.08 0.00 1.31 0.00 0.00 55.95 56.77 2edr s SER 20 Cb -0.24 0.19 -0.03 0.00 0.21 0.00 0.00 66.02 66.15 2edr s SER 20 CO 0.07 -1.63 -0.22 -0.63 0.41 0.00 0.00 173.24 171.24 2edr s ILE 21 N -2.92 2.49 0.28 1.44 -1.09 -1.26 -1.36 121.20 118.79 2edr s ILE 21 Ca 0.64 -1.31 -0.30 0.00 -2.23 0.00 0.00 60.65 57.46 2edr s ILE 21 Cb -0.05 -2.02 -0.12 0.00 -1.58 0.00 0.00 42.46 38.69 2edr s ILE 21 CO 0.42 0.33 1.59 1.21 -1.23 0.00 0.00 174.94 177.26 2edr n GLU 22 N 1.60 2.65 0.00 2.79 2.13 0.21 -1.80 120.64 128.23 2edr n GLU 22 Ca -0.17 0.94 0.00 0.00 0.66 0.00 0.00 57.16 58.60 2edr n GLU 22 Cb 0.52 -2.72 0.00 0.00 0.27 0.00 0.00 31.44 29.51 2edr n GLU 22 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2edr n GLY 23 N 2.25 2.80 1.88 8.31 0.00 -0.77 -4.29 105.19 115.37 2edr n GLY 23 Ca 0.09 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.95 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 -0.04 -1.75 -3.91 4.61 0.00 -0.74 -3.87 120.51 114.81 2edr n ALA 24 Ca 0.00 -0.87 -0.33 0.00 0.00 0.00 0.00 53.44 52.24 2edr n ALA 24 Cb 0.00 -0.06 -0.13 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 -2.09 2.74 0.82 0.00 2.01 -1.26 -0.30 115.64 117.56 2edr s THR 25 Ca 0.38 -2.50 -0.14 0.00 0.31 0.00 0.00 61.69 59.74 2edr s THR 25 Cb -0.03 -2.93 0.03 0.00 0.01 0.00 0.00 72.50 69.57 2edr s THR 25 CO 0.29 -0.69 0.73 0.00 -0.69 0.00 0.00 174.62 174.26 2edr n ALA 26 N 4.07 -1.33 -3.27 7.40 0.00 -0.17 -4.69 120.51 122.51 2edr n ALA 26 Ca 0.03 -0.39 -0.05 0.00 0.00 0.00 0.00 53.44 53.04 2edr n ALA 26 Cb 0.40 -1.97 -0.05 0.00 0.00 0.00 0.00 19.45 17.82 2edr n ALA 26 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2edr s THR 27 N -2.14 -0.74 0.34 0.00 2.01 -1.26 -1.16 115.64 112.69 2edr s THR 27 Ca 0.66 -0.10 0.01 0.00 0.31 0.00 0.00 61.69 62.56 2edr s THR 27 Cb -0.29 -0.92 -0.03 0.00 0.01 0.00 0.00 72.50 71.27 2edr s THR 27 CO 0.58 -0.12 0.54 -0.76 -0.69 0.00 0.00 174.62 174.17 2edr s LEU 28 N 2.64 4.03 -0.14 4.42 1.43 0.11 -4.91 118.68 126.25 2edr s LEU 28 Ca 0.14 0.44 -0.12 0.00 -1.03 0.00 0.00 54.13 53.55 2edr s LEU 28 Cb -0.14 -3.29 0.04 0.00 0.03 0.00 0.00 46.19 42.83 2edr s LEU 28 CO -0.21 -0.28 0.37 -0.60 0.23 0.00 0.00 176.35 175.86 2edr s ARG 29 N -4.28 0.42 0.28 1.70 3.52 -1.26 -2.05 118.95 117.27 2edr s ARG 29 Ca 0.40 0.57 0.06 0.00 -0.13 0.00 0.00 55.73 56.62 2edr s ARG 29 Cb -0.10 0.15 -0.02 0.00 -1.56 0.00 0.00 34.95 33.43 2edr s ARG 29 CO 0.36 -0.08 0.21 0.00 -0.81 0.00 0.00 175.30 174.98 2edr s GLU 31 N -3.13 0.35 0.08 0.00 2.12 -1.19 -3.30 118.70 113.62 2edr s GLU 31 Ca 0.30 -0.58 0.06 0.00 0.36 0.00 0.00 54.97 55.11 2edr s GLU 31 Cb 0.01 -0.04 -0.03 0.00 0.26 0.00 0.00 34.13 34.33 2edr s GLU 31 CO 0.21 -0.01 -0.16 -0.51 -0.54 0.00 0.00 175.26 174.25 2edr s LEU 32 N -1.32 2.27 0.44 2.70 1.43 -0.94 -3.06 118.68 120.21 2edr s LEU 32 Ca -0.12 -0.61 0.24 0.00 -1.03 0.00 0.00 54.13 52.60 2edr s LEU 32 Cb -0.09 -0.64 1.29 0.00 0.03 0.00 0.00 46.19 46.78 2edr s LEU 32 CO -0.00 -0.02 1.69 -1.28 0.23 0.00 0.00 176.35 176.97 2edr h SER 33 N 4.32 0.00 -3.21 2.29 0.87 -1.81 -3.43 113.55 112.58 2edr h SER 33 Ca -0.42 0.00 0.14 0.00 -1.23 0.00 0.00 61.79 60.28 2edr h SER 33 Cb 1.19 0.00 -0.27 0.00 -0.44 0.00 0.00 62.40 62.87 2edr h SER 33 CO 0.40 0.00 0.71 -1.59 -0.53 0.00 0.00 176.83 175.82 2edr s LYS 34 N -3.67 0.31 -0.44 2.24 -2.85 -1.26 -4.95 119.74 109.12 2edr s LYS 34 Ca -0.03 0.19 -0.41 0.00 -1.00 0.00 0.00 55.97 54.73 2edr s LYS 34 Cb 0.07 0.15 -0.16 0.00 -2.06 0.00 0.00 37.83 35.83 2edr s LYS 34 CO 0.22 -0.07 2.16 0.00 0.10 0.00 0.00 175.35 177.75 2edr n ALA 35 N 1.19 0.53 -3.23 0.59 0.00 -1.26 -4.70 120.51 113.63 2edr n ALA 35 Ca -0.08 0.10 -0.14 0.00 0.00 0.00 0.00 53.44 53.32 2edr n ALA 35 Cb 0.57 -2.25 -0.07 0.00 0.00 0.00 0.00 19.45 17.70 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 6.47 -1.00 0.50 0.00 0.00 -1.26 -4.90 121.76 121.56 2edr s ALA 36 Ca 1.16 0.44 -0.21 0.00 0.00 0.00 0.00 51.96 53.34 2edr s ALA 36 Cb -1.27 0.19 -0.07 0.00 0.00 0.00 0.00 23.12 21.98 2edr s ALA 36 CO 0.60 -0.36 1.15 -1.25 0.00 0.00 0.00 175.76 175.89 2edr s PRO 37 N -1.85 3.58 0.21 0.00 0.04 -1.26 -4.97 135.00 130.76 2edr s PRO 37 Ca -0.09 1.70 0.03 0.00 0.04 0.00 0.00 61.00 62.68 2edr s PRO 37 Cb -0.02 -2.23 -0.01 0.00 0.04 0.00 0.00 34.50 32.27 2edr s PRO 37 CO 0.02 -0.68 0.12 1.33 0.04 0.00 0.00 177.00 177.83 2edr n VAL 38 N -0.84 0.00 -3.27 -0.36 0.24 -1.26 -4.62 118.33 108.21 2edr n VAL 38 Ca 0.09 -1.38 -0.05 0.00 -2.04 0.00 0.00 64.34 60.96 2edr n VAL 38 Cb 0.49 0.58 -0.05 0.00 -1.47 0.00 0.00 33.84 33.40 2edr n VAL 38 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 2edr s GLU 39 N -2.84 0.44 0.57 7.34 2.12 0.42 -4.93 118.70 121.81 2edr s GLU 39 Ca 0.17 0.47 -0.18 0.00 0.36 0.00 0.00 54.97 55.79 2edr s GLU 39 Cb 0.01 -0.15 -0.05 0.00 0.26 0.00 0.00 34.13 34.20 2edr s GLU 39 CO 0.12 -0.83 1.12 -1.58 -0.54 0.00 0.00 175.26 173.55 2edr s TRP 40 N 2.63 2.69 -0.20 5.30 0.52 -1.26 -1.05 118.94 127.57 2edr s TRP 40 Ca 0.13 1.55 -0.04 0.00 0.02 0.00 0.00 56.10 57.75 2edr s TRP 40 Cb -0.14 -3.24 0.09 0.00 -1.15 0.00 0.00 33.47 29.04 2edr s TRP 40 CO -0.23 -1.54 0.23 1.03 0.02 0.00 0.00 176.95 176.46 2edr s ARG 41 N -3.50 0.19 -1.04 4.98 0.52 0.21 -0.82 118.95 119.50 2edr s ARG 41 Ca 0.71 0.22 -0.22 0.00 -0.52 0.00 0.00 55.73 55.92 2edr s ARG 41 Cb -0.22 -1.17 0.07 0.00 0.52 0.00 0.00 34.95 34.14 2edr s ARG 41 CO 0.30 -0.65 1.43 0.21 0.02 0.00 0.00 175.30 176.61 2edr s LYS 42 N 2.33 3.64 -0.10 3.54 2.20 -1.07 -1.64 119.74 128.64 2edr s LYS 42 Ca 0.07 -1.33 -0.07 0.00 -0.36 0.00 0.00 55.97 54.28 2edr s LYS 42 Cb -0.16 -5.31 0.03 0.00 -1.51 0.00 0.00 37.83 30.88 2edr s LYS 42 CO -0.12 -2.14 0.14 0.41 -0.36 0.00 0.00 175.35 173.28 2edr n GLY 43 N 6.48 -3.10 2.47 5.54 0.00 -1.05 -3.02 105.19 112.50 2edr n GLY 43 Ca 0.33 1.02 -0.01 0.00 0.00 0.00 0.00 46.02 47.36 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 2.06 -2.89 -4.30 1.61 1.85 -1.26 -4.86 116.66 108.87 2edr n ARG 44 Ca -0.24 0.06 -0.16 0.00 -1.00 0.00 0.00 57.85 56.50 2edr n ARG 44 Cb 0.37 -4.56 -0.10 0.00 -1.05 0.00 0.00 32.46 27.12 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 -4.95 1.19 -0.15 2.89 2.12 -1.17 -5.15 118.70 113.49 2edr s GLU 45 Ca 0.00 -1.51 -0.04 0.00 0.36 0.00 0.00 54.97 53.78 2edr s GLU 45 Cb 0.00 -0.87 -0.03 0.00 0.26 0.00 0.00 34.13 33.48 2edr s GLU 45 CO 0.00 0.13 -0.01 0.45 -0.54 0.00 0.00 175.26 175.29 2edr s SER 46 N -3.20 5.01 -0.11 -1.70 0.15 -1.26 -2.61 113.70 109.97 2edr s SER 46 Ca 0.19 -0.05 0.01 0.00 0.70 0.00 0.00 55.95 56.81 2edr s SER 46 Cb 0.01 -1.75 -0.01 0.00 -1.71 0.00 0.00 66.02 62.55 2edr s SER 46 CO 0.04 0.21 -0.16 -0.76 1.20 0.00 0.00 173.24 173.76 2edr s LEU 47 N 0.15 2.53 0.01 3.45 1.02 0.00 -4.82 118.68 121.01 2edr s LEU 47 Ca 0.00 -0.39 -0.06 0.00 0.02 0.00 0.00 54.13 53.70 2edr s LEU 47 Cb -0.13 -1.55 -0.00 0.00 0.02 0.00 0.00 46.19 44.53 2edr s LEU 47 CO 0.02 0.18 0.11 -0.13 0.02 0.00 0.00 176.35 176.56 2edr s ARG 48 N 0.25 0.47 -0.05 1.70 0.52 -1.26 -4.07 118.95 116.51 2edr s ARG 48 Ca -0.11 -0.45 -0.32 0.00 -0.52 0.00 0.00 55.73 54.33 2edr s ARG 48 Cb -0.16 0.19 -0.10 0.00 0.52 0.00 0.00 34.95 35.40 2edr s ARG 48 CO 0.06 -0.11 1.97 -3.47 0.02 0.00 0.00 175.30 173.77 2edr n ASP 49 N 1.41 3.71 0.00 0.23 -0.08 -1.26 -4.70 116.55 115.87 2edr n ASP 49 Ca -0.23 0.85 0.00 0.00 -1.51 0.00 0.00 54.79 53.91 2edr n ASP 49 Cb 0.56 -1.45 0.00 0.00 2.34 0.00 0.00 41.12 42.56 2edr n ASP 49 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2edr n GLY 50 N 4.67 4.15 0.00 0.27 0.00 -0.77 -5.00 105.19 108.51 2edr n GLY 50 Ca 0.23 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.91 2edr n GLY 50 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2edr n ASP 51 N 0.00 0.00 -0.06 1.61 2.03 -1.26 -4.17 116.55 114.69 2edr n ASP 51 Ca 0.00 0.64 -0.08 0.00 0.52 0.00 0.00 54.79 55.86 2edr n ASP 51 Cb 0.00 -0.20 -0.06 0.00 -0.72 0.00 0.00 41.12 40.13 2edr n ASP 51 CO 0.00 0.00 0.00 -2.11 -1.92 0.00 0.00 177.20 173.17 2edr n ARG 52 N -1.83 0.67 -1.31 -0.67 -4.01 -1.26 -4.98 116.66 103.27 2edr n ARG 52 Ca 0.00 0.06 -0.58 0.00 -1.04 0.00 0.00 57.85 56.29 2edr n ARG 52 Cb 0.00 -1.26 -0.11 0.00 -3.04 0.00 0.00 32.46 28.05 2edr n ARG 52 CO 0.00 0.00 0.00 0.72 -3.04 0.00 0.00 177.63 175.31 2edr n HIS 53 N -2.80 1.28 -3.96 2.89 8.25 -1.26 -4.67 115.22 114.94 2edr n HIS 53 Ca -0.22 0.68 -0.35 0.00 -0.26 0.00 0.00 57.72 57.57 2edr n HIS 53 Cb 0.76 -2.34 -0.14 0.00 1.12 0.00 0.00 29.99 29.40 2edr n HIS 53 CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 2edr s SER 54 N 6.13 4.50 -0.57 0.41 0.01 -0.57 -1.85 113.70 121.76 2edr s SER 54 Ca 1.17 -0.32 0.05 0.00 1.31 0.00 0.00 55.95 58.16 2edr s SER 54 Cb -1.37 -1.77 0.34 0.00 0.21 0.00 0.00 66.02 63.43 2edr s SER 54 CO 0.63 0.00 0.94 0.18 0.41 0.00 0.00 173.24 175.41 2edr n LEU 55 N 4.64 4.36 -4.70 2.44 7.99 -1.26 0.10 117.00 130.57 2edr n LEU 55 Ca -0.18 -5.66 -0.42 0.00 -0.01 0.00 0.00 56.01 49.74 2edr n LEU 55 Cb 0.51 -0.51 -0.03 0.00 -0.11 0.00 0.00 43.42 43.28 2edr n LEU 55 CO 0.30 2.36 1.24 0.00 -1.51 0.00 0.00 177.39 179.77 2edr s ARG 56 N -3.44 4.23 0.20 3.23 1.70 -0.75 -4.79 118.95 119.33 2edr s ARG 56 Ca 0.49 2.26 0.08 0.00 -0.47 0.00 0.00 55.73 58.09 2edr s ARG 56 Cb 0.28 -3.41 -0.04 0.00 -0.57 0.00 0.00 34.95 31.21 2edr s ARG 56 CO -0.14 -0.64 0.03 -0.65 -1.08 0.00 0.00 175.30 172.83 2edr s GLN 57 N 1.94 2.47 0.18 3.89 -0.21 -1.26 -0.87 119.66 125.80 2edr s GLN 57 Ca 0.70 -1.16 0.01 0.00 0.02 0.00 0.00 55.36 54.93 2edr s GLN 57 Cb -0.40 -2.35 -0.00 0.00 1.00 0.00 0.00 33.01 31.26 2edr s GLN 57 CO 0.31 0.43 0.21 -3.47 -2.12 0.00 0.00 175.29 170.65 2edr n ASP 58 N -0.44 -0.58 -4.50 5.90 2.03 0.40 -4.97 116.55 114.38 2edr n ASP 58 Ca -0.09 -2.06 -0.12 0.00 0.52 0.00 0.00 54.79 53.04 2edr n ASP 58 Cb 0.56 1.16 -0.10 0.00 -0.72 0.00 0.00 41.12 42.02 2edr n ASP 58 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2edr n GLY 59 N -0.32 -0.34 2.52 0.27 0.00 -1.26 -2.07 105.19 104.00 2edr n GLY 59 Ca 0.02 0.13 -0.13 0.00 0.00 0.00 0.00 46.02 46.03 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 17.17 -0.60 -3.30 4.61 0.00 -1.26 -4.80 120.51 132.34 2edr n ALA 60 Ca 0.39 0.18 -0.06 0.00 0.00 0.00 0.00 53.44 53.95 2edr n ALA 60 Cb 0.45 -2.64 -0.06 0.00 0.00 0.00 0.00 19.45 17.20 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 -2.95 -0.69 0.29 0.00 1.01 -0.88 -2.20 120.40 114.97 2edr s VAL 61 Ca 0.20 -0.13 -0.01 0.00 0.00 0.00 0.00 61.98 62.03 2edr s VAL 61 Cb -0.09 -0.91 -0.04 0.00 0.00 0.00 0.00 36.38 35.34 2edr s VAL 61 CO 0.25 -0.15 0.50 0.00 0.00 0.00 0.00 175.10 175.70 2edr s GLU 63 N -3.80 0.21 -0.34 0.00 2.02 -0.05 -1.84 118.70 114.91 2edr s GLU 63 Ca 0.41 0.75 -0.08 0.00 0.02 0.00 0.00 54.97 56.06 2edr s GLU 63 Cb -0.10 0.00 0.03 0.00 0.10 0.00 0.00 34.13 34.16 2edr s GLU 63 CO 0.32 -0.24 0.13 -1.17 0.02 0.00 0.00 175.26 174.32 2edr s LEU 64 N 2.08 4.30 -0.11 1.80 2.96 -0.87 -1.81 118.68 127.04 2edr s LEU 64 Ca -0.03 -0.96 -0.05 0.00 -0.22 0.00 0.00 54.13 52.88 2edr s LEU 64 Cb -0.11 -1.92 -0.04 0.00 0.50 0.00 0.00 46.19 44.62 2edr s LEU 64 CO -0.10 -0.30 0.07 -1.58 -1.32 0.00 0.00 176.35 173.12 2edr s GLN 65 N 1.48 3.26 -0.17 1.98 0.74 0.11 -0.71 119.66 126.35 2edr s GLN 65 Ca 0.01 -0.28 -0.02 0.00 0.05 0.00 0.00 55.36 55.12 2edr s GLN 65 Cb -0.19 -3.00 0.05 0.00 1.10 0.00 0.00 33.01 30.97 2edr s GLN 65 CO 0.04 0.71 0.01 0.42 -0.55 0.00 0.00 175.29 175.92 2edr s ILE 66 N -0.86 0.61 0.56 -2.34 1.01 -0.31 -1.51 121.20 118.37 2edr s ILE 66 Ca 0.13 -0.47 -0.10 0.00 0.00 0.00 0.00 60.65 60.22 2edr s ILE 66 Cb -0.12 -1.00 -0.04 0.00 0.01 0.00 0.00 42.46 41.31 2edr s ILE 66 CO 0.03 -0.07 0.95 0.00 0.00 0.00 0.00 174.94 175.85 2edr n GLY 68 N -2.44 -0.75 3.37 0.00 0.00 -1.16 -4.94 105.19 99.27 2edr n GLY 68 Ca 0.05 0.35 -0.30 0.00 0.00 0.00 0.00 46.02 46.11 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 -3.81 -2.09 -3.58 0.99 4.77 0.59 -4.71 117.00 109.17 2edr n LEU 69 Ca -0.18 -0.18 -0.13 0.00 -0.03 0.00 0.00 56.01 55.49 2edr n LEU 69 Cb 0.64 -1.11 -0.06 0.00 -2.33 0.00 0.00 43.42 40.56 2edr n LEU 69 CO 0.63 -3.25 0.61 0.00 -1.33 0.00 0.00 177.39 174.05 2edr s ALA 70 N -2.32 -1.87 0.61 -1.18 0.00 -1.26 -1.85 121.76 113.90 2edr s ALA 70 Ca 0.63 1.62 0.31 0.00 0.00 0.00 0.00 51.96 54.52 2edr s ALA 70 Cb -0.20 -0.69 1.76 0.00 0.00 0.00 0.00 23.12 23.99 2edr s ALA 70 CO 0.66 -0.32 2.11 0.28 0.00 0.00 0.00 175.76 178.49 2edr h VAL 71 N 3.10 0.35 0.00 0.00 2.07 -1.89 0.41 116.25 120.29 2edr h VAL 71 Ca -0.24 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.28 2edr h VAL 71 Cb 1.16 0.84 0.00 0.00 -1.52 0.00 0.00 31.29 31.76 2edr h VAL 71 CO 0.26 0.00 -0.16 0.00 0.02 0.00 0.00 177.57 177.69 2edr n ALA 72 N -2.24 2.53 1.43 1.67 0.00 -1.26 -3.17 120.51 119.46 2edr n ALA 72 Ca 0.01 -0.12 0.12 0.00 0.00 0.00 0.00 53.44 53.45 2edr n ALA 72 Cb 0.30 -1.39 0.49 0.00 0.00 0.00 0.00 19.45 18.85 2edr n ALA 72 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2edr n ASP 73 N -1.95 1.43 -4.75 0.00 9.92 0.14 -4.87 116.55 116.47 2edr n ASP 73 Ca 0.06 -1.56 -0.40 0.00 -0.53 0.00 0.00 54.79 52.36 2edr n ASP 73 Cb 0.40 -0.04 -0.05 0.00 -0.64 0.00 0.00 41.12 40.78 2edr n ASP 73 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2edr s ALA 74 N -1.91 3.39 0.00 2.24 0.00 -1.19 -4.85 121.76 119.44 2edr s ALA 74 Ca 0.36 0.23 0.00 0.00 0.00 0.00 0.00 51.96 52.55 2edr s ALA 74 Cb 0.19 -2.95 0.00 0.00 0.00 0.00 0.00 23.12 20.37 2edr s ALA 74 CO 0.30 0.08 0.00 0.41 0.00 0.00 0.00 175.76 176.55 2edr n GLY 75 N 2.42 -1.90 3.15 0.00 0.00 -0.77 -4.99 105.19 103.10 2edr n GLY 75 Ca -0.03 0.77 0.05 0.00 0.00 0.00 0.00 46.02 46.81 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 0.40 0.21 0.20 1.61 2.12 -1.26 -3.06 118.70 118.91 2edr s GLU 76 Ca 0.00 0.33 -0.09 0.00 0.36 0.00 0.00 54.97 55.57 2edr s GLU 76 Cb 0.00 0.18 -0.07 0.00 0.26 0.00 0.00 34.13 34.50 2edr s GLU 76 CO 0.00 -0.25 0.52 0.71 -0.54 0.00 0.00 175.26 175.69 2edr s TYR 77 N 2.95 3.46 0.02 5.30 1.51 -1.12 -2.53 117.35 126.93 2edr s TYR 77 Ca 0.05 0.84 0.02 0.00 -1.01 0.00 0.00 57.07 56.97 2edr s TYR 77 Cb -0.09 -2.23 -0.01 0.00 -0.11 0.00 0.00 41.96 39.52 2edr s TYR 77 CO -0.14 0.33 -0.08 -1.12 -1.11 0.00 0.00 175.55 173.43 2edr s SER 78 N -2.26 0.90 -0.24 2.29 0.01 -0.65 -0.17 113.70 113.57 2edr s SER 78 Ca 0.44 -0.30 -0.03 0.00 1.31 0.00 0.00 55.95 57.37 2edr s SER 78 Cb -0.12 -0.05 0.01 0.00 0.21 0.00 0.00 66.02 66.07 2edr s SER 78 CO 0.21 -0.02 -0.04 0.00 0.41 0.00 0.00 173.24 173.80 2edr s VAL 80 N 1.41 5.33 -0.11 0.00 1.01 -0.22 -2.69 120.40 125.13 2edr s VAL 80 Ca 0.03 0.16 0.02 0.00 0.00 0.00 0.00 61.98 62.18 2edr s VAL 80 Cb -0.16 -3.41 -0.08 0.00 0.00 0.00 0.00 36.38 32.74 2edr s VAL 80 CO -0.03 0.48 -0.09 0.00 0.00 0.00 0.00 175.10 175.46 2edr n GLY 82 N 2.89 -2.14 0.06 0.00 0.00 -1.26 -4.75 105.19 100.00 2edr n GLY 82 Ca -0.20 0.69 -0.08 0.00 0.00 0.00 0.00 46.02 46.44 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 0.00 1.25 -4.08 1.61 1.02 -1.26 -5.01 120.64 114.17 2edr n GLU 83 Ca 0.00 0.04 -0.31 0.00 -0.02 0.00 0.00 57.16 56.87 2edr n GLU 83 Cb 0.00 -1.29 -0.07 0.00 -0.02 0.00 0.00 31.44 30.06 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 -2.28 2.88 -0.09 3.49 0.41 -1.26 -5.12 118.70 116.74 2edr s GLU 84 Ca -0.13 -0.66 -0.04 0.00 -0.41 0.00 0.00 54.97 53.73 2edr s GLU 84 Cb 0.04 -2.73 0.05 0.00 -1.78 0.00 0.00 34.13 29.70 2edr s GLU 84 CO 0.40 0.58 0.20 0.50 -0.49 0.00 0.00 175.26 176.44 2edr s ARG 85 N -2.23 0.12 0.28 1.61 3.52 -1.26 -3.17 118.95 117.82 2edr s ARG 85 Ca 0.27 0.52 0.06 0.00 -0.13 0.00 0.00 55.73 56.46 2edr s ARG 85 Cb -0.12 -0.16 -0.03 0.00 -1.56 0.00 0.00 34.95 33.08 2edr s ARG 85 CO 0.20 -0.21 0.32 -0.08 -0.81 0.00 0.00 175.30 174.71 2edr s THR 86 N 1.63 4.41 0.01 4.11 -1.32 -1.09 -4.92 115.64 118.46 2edr s THR 86 Ca -0.05 -1.20 -0.01 0.00 -1.21 0.00 0.00 61.69 59.22 2edr s THR 86 Cb -0.11 -3.49 -0.01 0.00 -1.51 0.00 0.00 72.50 67.38 2edr s THR 86 CO -0.07 -0.27 0.00 -0.44 -2.21 0.00 0.00 174.62 171.63 2edr s SER 87 N -3.98 0.13 -0.18 8.08 0.01 -1.26 -0.86 113.70 115.65 2edr s SER 87 Ca 0.37 -0.29 -0.05 0.00 1.31 0.00 0.00 55.95 57.30 2edr s SER 87 Cb -0.08 0.09 0.06 0.00 0.21 0.00 0.00 66.02 66.30 2edr s SER 87 CO 0.28 -0.20 0.09 0.00 0.41 0.00 0.00 173.24 173.81 2edr s ALA 88 N -0.94 0.45 0.02 1.44 0.00 0.76 -4.63 121.76 118.86 2edr s ALA 88 Ca -0.10 -0.35 -0.34 0.00 0.00 0.00 0.00 51.96 51.17 2edr s ALA 88 Cb -0.06 -1.05 -0.12 0.00 0.00 0.00 0.00 23.12 21.88 2edr s ALA 88 CO -0.00 -1.19 1.79 2.41 0.00 0.00 0.00 175.76 178.76 2edr n THR 89 N 5.27 0.39 -3.79 0.00 -1.04 -1.26 -2.79 114.28 111.05 2edr n THR 89 Ca -0.07 -0.07 -0.36 0.00 -2.04 0.00 0.00 64.05 61.51 2edr n THR 89 Cb 0.49 -1.81 -0.11 0.00 -1.82 0.00 0.00 70.33 67.07 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 2.96 3.74 -0.17 -4.42 2.96 -1.17 -3.00 118.68 119.57 2edr s LEU 90 Ca 0.87 -0.05 -0.05 0.00 -0.22 0.00 0.00 54.13 54.68 2edr s LEU 90 Cb -0.65 -1.99 -0.03 0.00 0.50 0.00 0.00 46.19 44.01 2edr s LEU 90 CO 0.45 0.03 -0.01 -0.89 -1.32 0.00 0.00 176.35 174.62 2edr s THR 91 N 1.23 4.09 -0.04 3.68 2.01 -0.86 -1.84 115.64 123.91 2edr s THR 91 Ca 0.05 -0.28 0.01 0.00 0.31 0.00 0.00 61.69 61.78 2edr s THR 91 Cb -0.14 -2.82 -0.03 0.00 0.01 0.00 0.00 72.50 69.52 2edr s THR 91 CO 0.04 0.47 -0.02 -0.69 -0.69 0.00 0.00 174.62 173.74 2edr s VAL 92 N 0.49 4.07 0.42 3.82 1.01 -1.26 0.39 120.40 129.33 2edr s VAL 92 Ca -0.02 -0.50 0.07 0.00 0.00 0.00 0.00 61.98 61.54 2edr s VAL 92 Cb -0.14 -2.75 -0.05 0.00 0.00 0.00 0.00 36.38 33.43 2edr s VAL 92 CO 0.02 0.48 0.16 -0.54 0.00 0.00 0.00 175.10 175.22 2edr s LYS 93 N -1.22 2.19 -0.33 2.72 -0.14 -0.46 -4.85 119.74 117.65 2edr s LYS 93 Ca 0.16 -1.89 -0.14 0.00 -1.36 0.00 0.00 55.97 52.74 2edr s LYS 93 Cb -0.11 -1.93 -0.02 0.00 -1.68 0.00 0.00 37.83 34.09 2edr s LYS 93 CO 0.06 -0.12 0.33 0.00 -0.76 0.00 0.00 175.35 174.86 2edr s ALA 94 N -2.62 3.51 0.49 5.17 0.00 -1.26 0.68 121.76 127.73 2edr s ALA 94 Ca 0.40 -1.16 -0.24 0.00 0.00 0.00 0.00 51.96 50.95 2edr s ALA 94 Cb 0.05 -2.75 -0.07 0.00 0.00 0.00 0.00 23.12 20.34 2edr s ALA 94 CO 0.22 -0.95 1.41 1.47 0.00 0.00 0.00 175.76 177.91 2edr n LEU 95 N 5.31 5.28 -0.12 0.00 -0.00 -1.26 -4.88 117.00 121.32 2edr n LEU 95 Ca -0.10 1.07 -0.13 0.00 -0.00 0.00 0.00 56.01 56.85 2edr n LEU 95 Cb 0.50 -1.59 -0.02 0.00 -0.00 0.00 0.00 43.42 42.30 2edr n LEU 95 CO 0.39 -0.31 0.55 1.55 -0.00 0.00 0.00 177.39 179.57 2edr h PRO 96 N 1.97 0.95 -2.76 1.47 0.13 -1.95 -3.48 132.00 128.34 2edr h PRO 96 Ca -0.51 -0.50 -0.13 0.00 -0.87 0.00 0.00 66.00 64.00 2edr h PRO 96 Cb 1.28 0.02 0.05 0.00 0.13 0.00 0.00 31.00 32.48 2edr h PRO 96 CO 0.59 1.15 -0.23 0.45 -0.23 0.00 0.00 178.00 179.74 2edr n SER 97 N -4.06 -3.10 0.00 1.44 2.88 -1.26 -4.60 113.62 104.92 2edr n SER 97 Ca -0.02 -0.19 0.00 0.00 -1.33 0.00 0.00 58.87 57.33 2edr n SER 97 Cb 0.54 -2.01 0.00 0.00 -0.75 0.00 0.00 64.21 61.99 2edr n SER 97 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2edr n GLY 98 N -1.01 1.08 3.56 0.46 0.00 -1.26 -5.05 105.19 102.96 2edr n GLY 98 Ca -0.02 -0.38 -0.39 0.00 0.00 0.00 0.00 46.02 45.23 2edr n GLY 98 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2edr s PRO 99 N 0.00 2.78 0.17 1.61 0.04 -1.26 -4.95 135.00 133.39 2edr s PRO 99 Ca 0.00 0.76 -0.32 0.00 0.04 0.00 0.00 61.00 61.49 2edr s PRO 99 Cb 0.00 -4.34 -0.11 0.00 0.04 0.00 0.00 34.50 30.09 2edr s PRO 99 CO 0.00 -2.54 1.68 0.45 0.04 0.00 0.00 177.00 176.63 2edr s SER 100 N 7.60 6.47 0.16 6.66 0.15 -1.26 -4.84 113.70 128.64 2edr s SER 100 Ca 0.69 2.74 -0.15 0.00 0.70 0.00 0.00 55.95 59.93 2edr s SER 100 Cb -0.14 -2.59 0.09 0.00 -1.71 0.00 0.00 66.02 61.67 2edr s SER 100 CO 0.23 -0.92 1.74 0.77 1.20 0.00 0.00 173.24 176.27 2edr h SER 101 N 7.13 0.09 0.00 5.45 4.64 -1.98 -3.53 113.55 125.36 2edr h SER 101 Ca -0.43 0.05 0.00 0.00 -0.47 0.00 0.00 61.79 60.94 2edr h SER 101 Cb 1.20 0.05 0.00 0.00 -0.31 0.00 0.00 62.40 63.35 2edr h SER 101 CO 0.94 0.09 0.00 0.61 -0.87 0.00 0.00 176.83 177.60