#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 6.45 -1.41 1.61 0.01 -1.26 -2.69 113.70 116.42 2edr s SER 2 Ca 0.00 0.97 -0.09 0.00 1.31 0.00 0.00 55.95 58.14 2edr s SER 2 Cb 0.00 -2.54 0.04 0.00 0.21 0.00 0.00 66.02 63.73 2edr s SER 2 CO 0.00 -1.31 1.06 -0.24 0.41 0.00 0.00 173.24 173.16 2edr n SER 3 N 8.39 -5.05 0.00 2.44 2.88 -1.26 -4.73 113.62 116.30 2edr n SER 3 Ca 0.16 -0.66 0.00 0.00 -1.33 0.00 0.00 58.87 57.04 2edr n SER 3 Cb 0.47 -4.53 0.00 0.00 -0.75 0.00 0.00 64.21 59.41 2edr n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2edr n GLY 4 N -1.79 -0.08 3.86 0.46 0.00 -1.22 -5.14 105.19 101.29 2edr n GLY 4 Ca -0.03 -0.07 -0.21 0.00 0.00 0.00 0.00 46.02 45.71 2edr n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2edr s SER 5 N -1.63 5.60 -0.06 1.61 0.15 -1.09 -4.97 113.70 113.30 2edr s SER 5 Ca 0.00 -0.27 0.04 0.00 0.70 0.00 0.00 55.95 56.43 2edr s SER 5 Cb 0.00 -1.34 -0.00 0.00 -1.71 0.00 0.00 66.02 62.97 2edr s SER 5 CO 0.00 -0.16 -0.20 -0.55 1.20 0.00 0.00 173.24 173.53 2edr s SER 6 N -3.93 2.59 0.00 5.45 0.15 -1.26 -4.48 113.70 112.22 2edr s SER 6 Ca 0.36 -0.44 0.00 0.00 0.70 0.00 0.00 55.95 56.57 2edr s SER 6 Cb -0.08 -0.90 0.00 0.00 -1.71 0.00 0.00 66.02 63.34 2edr s SER 6 CO 0.26 0.16 0.00 0.61 1.20 0.00 0.00 173.24 175.48 2edr n GLY 7 N 3.28 5.85 3.61 9.45 0.00 -1.26 -4.99 105.19 121.12 2edr n GLY 7 Ca -0.19 -1.97 -0.30 0.00 0.00 0.00 0.00 46.02 43.57 2edr n GLY 7 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2edr s PRO 8 N -0.34 -0.83 0.04 1.61 0.04 -1.26 -4.94 135.00 129.34 2edr s PRO 8 Ca 0.00 0.08 -0.30 0.00 0.04 0.00 0.00 61.00 60.82 2edr s PRO 8 Cb 0.00 -1.63 -0.08 0.00 0.04 0.00 0.00 34.50 32.83 2edr s PRO 8 CO 0.00 -3.48 1.67 0.00 0.04 0.00 0.00 177.00 175.24 2edr s ALA 9 N -2.99 3.66 0.31 8.56 0.00 -1.26 -4.98 121.76 125.06 2edr s ALA 9 Ca 0.69 1.17 -0.15 0.00 0.00 0.00 0.00 51.96 53.67 2edr s ALA 9 Cb -0.12 -3.72 -0.09 0.00 0.00 0.00 0.00 23.12 19.20 2edr s ALA 9 CO 0.56 -1.19 0.73 -3.38 0.00 0.00 0.00 175.76 172.48 2edr s HIS 10 N 3.02 3.41 -0.33 0.00 -3.43 -1.26 -4.66 115.29 112.05 2edr s HIS 10 Ca 0.75 1.23 -0.29 0.00 -0.80 0.00 0.00 55.06 55.94 2edr s HIS 10 Cb -0.39 -2.53 0.00 0.00 -1.43 0.00 0.00 32.58 28.23 2edr s HIS 10 CO 0.32 0.13 1.30 -0.06 -2.00 0.00 0.00 174.74 174.44 2edr s PHE 11 N -1.92 2.67 -0.12 0.38 0.08 -1.26 0.94 117.98 118.74 2edr s PHE 11 Ca 0.52 0.85 0.19 0.00 0.12 0.00 0.00 56.93 58.61 2edr s PHE 11 Cb -0.11 -3.98 -0.26 0.00 -0.57 0.00 0.00 43.02 38.09 2edr s PHE 11 CO 0.18 -1.69 0.35 0.44 -0.10 0.00 0.00 175.22 174.40 2edr n ILE 12 N 6.35 0.82 -3.11 0.64 -5.35 -1.09 -4.60 119.36 113.03 2edr n ILE 12 Ca 0.15 -0.69 -0.26 0.00 -0.27 0.00 0.00 62.75 61.68 2edr n ILE 12 Cb 0.47 -0.32 -0.05 0.00 -1.74 0.00 0.00 39.64 37.99 2edr n ILE 12 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2edr n GLY 13 N 1.50 4.96 2.49 3.28 0.00 -1.15 -5.00 105.19 111.27 2edr n GLY 13 Ca -0.18 -2.55 -0.31 0.00 0.00 0.00 0.00 46.02 42.98 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 0.20 0.00 -0.35 1.61 1.74 -1.26 -3.11 116.66 115.49 2edr n ARG 14 Ca 0.29 0.00 -0.14 0.00 -0.77 0.00 0.00 57.85 57.23 2edr n ARG 14 Cb 0.44 -0.76 0.14 0.00 -1.02 0.00 0.00 32.46 31.26 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 1.79 0.00 -3.58 0.55 4.77 -1.26 -4.86 117.00 114.41 2edr n LEU 15 Ca 0.08 -0.41 -0.13 0.00 -0.03 0.00 0.00 56.01 55.52 2edr n LEU 15 Cb 0.31 -0.63 -0.12 0.00 -2.33 0.00 0.00 43.42 40.65 2edr n LEU 15 CO 0.41 -2.26 -0.11 0.00 -1.33 0.00 0.00 177.39 174.10 2edr s ARG 16 N -3.38 0.21 -0.21 3.23 1.70 -1.26 -4.90 118.95 114.34 2edr s ARG 16 Ca 0.31 0.64 -0.33 0.00 -0.47 0.00 0.00 55.73 55.89 2edr s ARG 16 Cb -0.06 -0.29 -0.15 0.00 -0.57 0.00 0.00 34.95 33.88 2edr s ARG 16 CO 0.26 -0.41 1.03 -2.39 -1.08 0.00 0.00 175.30 172.71 2edr n HIS 17 N 5.35 0.94 -4.66 5.89 1.44 -1.26 -4.91 115.22 118.01 2edr n HIS 17 Ca -0.06 0.84 -0.25 0.00 -2.01 0.00 0.00 57.72 56.24 2edr n HIS 17 Cb 0.50 -1.64 -0.17 0.00 0.12 0.00 0.00 29.99 28.80 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 1.23 1.83 -0.58 -1.40 -2.07 -1.12 -4.99 119.66 112.55 2edr s GLN 18 Ca 0.75 -0.47 -0.18 0.00 -1.82 0.00 0.00 55.36 53.63 2edr s GLN 18 Cb -1.05 -1.49 0.11 0.00 -1.09 0.00 0.00 33.01 29.48 2edr s GLN 18 CO 0.53 0.06 0.67 -2.00 -1.32 0.00 0.00 175.29 173.23 2edr s GLU 19 N 0.58 3.04 0.61 9.60 2.12 -1.26 -2.27 118.70 131.13 2edr s GLU 19 Ca -0.14 -1.38 -0.03 0.00 0.36 0.00 0.00 54.97 53.79 2edr s GLU 19 Cb -0.16 -4.27 0.04 0.00 0.26 0.00 0.00 34.13 30.01 2edr s GLU 19 CO 0.04 -1.50 0.88 -1.12 -0.54 0.00 0.00 175.26 173.02 2edr s SER 20 N 3.61 5.12 -0.09 -1.70 0.01 0.11 -4.92 113.70 115.83 2edr s SER 20 Ca 0.10 0.24 -0.01 0.00 1.31 0.00 0.00 55.95 57.59 2edr s SER 20 Cb -0.25 -1.05 -0.03 0.00 0.21 0.00 0.00 66.02 64.90 2edr s SER 20 CO 0.06 -1.32 -0.03 -0.63 0.41 0.00 0.00 173.24 171.73 2edr s ILE 21 N -2.98 4.05 0.25 1.44 -1.09 -1.26 -0.60 121.20 121.01 2edr s ILE 21 Ca 0.58 -0.34 -0.30 0.00 -2.23 0.00 0.00 60.65 58.36 2edr s ILE 21 Cb -0.10 -2.70 -0.14 0.00 -1.58 0.00 0.00 42.46 37.94 2edr s ILE 21 CO 0.41 0.59 1.14 1.21 -1.23 0.00 0.00 174.94 177.06 2edr n GLU 22 N 2.34 1.46 0.00 2.79 2.13 0.22 -0.88 120.64 128.70 2edr n GLU 22 Ca -0.18 0.52 0.00 0.00 0.66 0.00 0.00 57.16 58.15 2edr n GLU 22 Cb 0.53 -1.99 0.00 0.00 0.27 0.00 0.00 31.44 30.26 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 1.58 2.66 1.79 8.31 0.00 -0.58 -4.31 105.19 114.64 2edr n GLY 23 Ca 0.11 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.98 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 -0.01 -1.86 -3.75 4.61 0.00 -0.06 -3.89 120.51 115.55 2edr n ALA 24 Ca 0.00 -0.84 -0.34 0.00 0.00 0.00 0.00 53.44 52.26 2edr n ALA 24 Cb 0.00 -0.06 -0.14 0.00 0.00 0.00 0.00 19.45 19.25 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 -1.98 2.82 0.02 0.00 2.01 -1.26 -1.21 115.64 116.04 2edr s THR 25 Ca 0.36 -1.12 -0.30 0.00 0.31 0.00 0.00 61.69 60.94 2edr s THR 25 Cb -0.04 -2.47 -0.06 0.00 0.01 0.00 0.00 72.50 69.95 2edr s THR 25 CO 0.28 0.15 1.35 0.00 -0.69 0.00 0.00 174.62 175.71 2edr s ALA 26 N 1.30 3.55 -0.45 7.40 0.00 0.08 -4.81 121.76 128.82 2edr s ALA 26 Ca -0.01 0.90 0.03 0.00 0.00 0.00 0.00 51.96 52.87 2edr s ALA 26 Cb -0.17 -3.56 0.13 0.00 0.00 0.00 0.00 23.12 19.52 2edr s ALA 26 CO -0.04 -0.78 0.24 0.99 0.00 0.00 0.00 175.76 176.17 2edr s THR 27 N 1.96 1.71 0.67 0.00 2.01 -1.25 -0.18 115.64 120.56 2edr s THR 27 Ca 0.63 -2.72 -0.11 0.00 0.31 0.00 0.00 61.69 59.80 2edr s THR 27 Cb -0.32 -2.20 -0.01 0.00 0.01 0.00 0.00 72.50 69.99 2edr s THR 27 CO 0.27 -0.86 1.07 -0.76 -0.69 0.00 0.00 174.62 173.65 2edr s LEU 28 N 0.23 3.05 -0.16 4.42 1.43 -0.58 -4.88 118.68 122.19 2edr s LEU 28 Ca 0.17 1.27 -0.11 0.00 -1.03 0.00 0.00 54.13 54.42 2edr s LEU 28 Cb -0.25 -4.18 0.05 0.00 0.03 0.00 0.00 46.19 41.85 2edr s LEU 28 CO -0.00 -1.13 0.41 -0.60 0.23 0.00 0.00 176.35 175.26 2edr s ARG 29 N -5.28 0.43 0.26 1.70 3.52 -1.26 -2.53 118.95 115.80 2edr s ARG 29 Ca 0.57 0.70 0.02 0.00 -0.13 0.00 0.00 55.73 56.88 2edr s ARG 29 Cb -0.11 0.09 -0.04 0.00 -1.56 0.00 0.00 34.95 33.33 2edr s ARG 29 CO 0.53 -0.11 0.16 0.00 -0.81 0.00 0.00 175.30 175.06 2edr s GLU 31 N -3.93 1.15 0.22 0.00 2.12 -1.18 -2.64 118.70 114.43 2edr s GLU 31 Ca 0.38 -0.74 0.10 0.00 0.36 0.00 0.00 54.97 55.07 2edr s GLU 31 Cb 0.06 -1.17 -0.05 0.00 0.26 0.00 0.00 34.13 33.23 2edr s GLU 31 CO 0.16 0.30 -0.19 -0.51 -0.54 0.00 0.00 175.26 174.49 2edr s LEU 32 N -0.92 2.52 0.62 2.70 1.43 -0.92 -2.66 118.68 121.45 2edr s LEU 32 Ca 0.04 -0.96 0.32 0.00 -1.03 0.00 0.00 54.13 52.50 2edr s LEU 32 Cb -0.07 -0.93 1.77 0.00 0.03 0.00 0.00 46.19 46.99 2edr s LEU 32 CO 0.01 -0.02 2.08 0.77 0.23 0.00 0.00 176.35 179.41 2edr h SER 33 N 2.73 0.00 -2.84 2.29 4.64 0.30 -3.43 113.55 117.24 2edr h SER 33 Ca -0.41 0.00 0.14 0.00 -0.47 0.00 0.00 61.79 61.05 2edr h SER 33 Cb 1.23 0.00 -0.29 0.00 -0.31 0.00 0.00 62.40 63.03 2edr h SER 33 CO 0.57 0.00 0.72 -1.59 -0.87 0.00 0.00 176.83 175.65 2edr s LYS 34 N -4.40 0.26 -0.39 4.77 -2.85 -1.26 -4.95 119.74 110.93 2edr s LYS 34 Ca -0.04 0.24 -0.35 0.00 -1.00 0.00 0.00 55.97 54.82 2edr s LYS 34 Cb 0.13 0.13 -0.15 0.00 -2.06 0.00 0.00 37.83 35.88 2edr s LYS 34 CO 0.45 -0.05 1.59 0.00 0.10 0.00 0.00 175.35 177.44 2edr n ALA 35 N 1.55 -0.07 -3.33 0.59 0.00 -1.26 -4.70 120.51 113.28 2edr n ALA 35 Ca -0.10 0.20 -0.15 0.00 0.00 0.00 0.00 53.44 53.39 2edr n ALA 35 Cb 0.57 -1.60 -0.06 0.00 0.00 0.00 0.00 19.45 18.36 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 4.22 -1.28 0.29 0.00 0.00 -1.26 -4.87 121.76 118.86 2edr s ALA 36 Ca 0.91 0.69 -0.29 0.00 0.00 0.00 0.00 51.96 53.27 2edr s ALA 36 Cb -1.17 0.21 -0.10 0.00 0.00 0.00 0.00 23.12 22.06 2edr s ALA 36 CO 0.54 -0.41 1.24 -1.25 0.00 0.00 0.00 175.76 175.88 2edr s PRO 37 N -1.87 4.45 0.35 0.00 0.04 -1.26 -4.97 135.00 131.74 2edr s PRO 37 Ca -0.09 2.06 0.03 0.00 0.04 0.00 0.00 61.00 63.04 2edr s PRO 37 Cb -0.01 -3.13 -0.01 0.00 0.04 0.00 0.00 34.50 31.38 2edr s PRO 37 CO 0.03 -0.07 0.11 1.33 0.04 0.00 0.00 177.00 178.43 2edr n VAL 38 N 1.28 0.00 -3.41 -0.36 0.24 -1.26 -4.67 118.33 110.14 2edr n VAL 38 Ca 0.01 -1.97 -0.14 0.00 -2.04 0.00 0.00 64.34 60.19 2edr n VAL 38 Cb 0.43 0.68 -0.10 0.00 -1.47 0.00 0.00 33.84 33.38 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 -3.31 0.28 0.49 7.34 2.56 0.36 -4.93 118.70 121.49 2edr s GLU 39 Ca 0.16 0.29 -0.20 0.00 0.00 0.00 0.00 54.97 55.22 2edr s GLU 39 Cb 0.01 -0.80 -0.08 0.00 2.00 0.00 0.00 34.13 35.26 2edr s GLU 39 CO 0.11 -0.71 1.07 -1.58 -0.56 0.00 0.00 175.26 173.59 2edr s TRP 40 N 2.43 2.91 -0.04 5.30 0.52 -1.25 -0.49 118.94 128.32 2edr s TRP 40 Ca 0.10 1.57 -0.02 0.00 0.02 0.00 0.00 56.10 57.77 2edr s TRP 40 Cb -0.15 -3.16 0.03 0.00 -1.15 0.00 0.00 33.47 29.04 2edr s TRP 40 CO -0.17 -1.08 0.05 1.03 0.02 0.00 0.00 176.95 176.80 2edr s ARG 41 N -3.16 0.01 -0.84 4.98 0.52 0.29 -0.11 118.95 120.65 2edr s ARG 41 Ca 0.68 0.31 -0.15 0.00 -0.52 0.00 0.00 55.73 56.05 2edr s ARG 41 Cb -0.20 -0.52 0.21 0.00 0.52 0.00 0.00 34.95 34.96 2edr s ARG 41 CO 0.23 -0.30 0.82 0.21 0.02 0.00 0.00 175.30 176.29 2edr s LYS 42 N 1.95 3.60 -0.11 3.54 2.20 -1.06 -0.35 119.74 129.50 2edr s LYS 42 Ca 0.02 -2.36 -0.08 0.00 -0.36 0.00 0.00 55.97 53.20 2edr s LYS 42 Cb -0.12 -4.50 0.03 0.00 -1.51 0.00 0.00 37.83 31.73 2edr s LYS 42 CO -0.03 -1.36 0.16 0.41 -0.36 0.00 0.00 175.35 174.16 2edr n GLY 43 N 4.20 -3.48 1.94 5.54 0.00 -0.78 -2.99 105.19 109.62 2edr n GLY 43 Ca 0.15 1.13 -0.01 0.00 0.00 0.00 0.00 46.02 47.29 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 2.01 -2.17 -4.40 1.61 1.85 -1.26 -4.85 116.66 109.44 2edr n ARG 44 Ca -0.26 0.06 -0.20 0.00 -1.00 0.00 0.00 57.85 56.44 2edr n ARG 44 Cb 0.41 -4.38 -0.10 0.00 -1.05 0.00 0.00 32.46 27.34 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 -3.85 1.49 -0.20 2.89 2.12 -1.16 -5.14 118.70 114.85 2edr s GLU 45 Ca 0.00 -1.73 0.01 0.00 0.36 0.00 0.00 54.97 53.62 2edr s GLU 45 Cb 0.00 -1.13 0.03 0.00 0.26 0.00 0.00 34.13 33.28 2edr s GLU 45 CO 0.00 0.08 -0.17 0.45 -0.54 0.00 0.00 175.26 175.07 2edr s SER 46 N -3.40 3.39 -0.20 -1.70 0.15 -1.26 -2.56 113.70 108.11 2edr s SER 46 Ca 0.28 -0.81 -0.15 0.00 0.70 0.00 0.00 55.95 55.97 2edr s SER 46 Cb 0.02 -1.47 -0.04 0.00 -1.71 0.00 0.00 66.02 62.83 2edr s SER 46 CO 0.10 -0.05 0.36 -0.76 1.20 0.00 0.00 173.24 174.10 2edr s LEU 47 N 1.27 4.17 0.11 3.45 1.43 0.84 -4.90 118.68 125.04 2edr s LEU 47 Ca 0.02 0.48 0.07 0.00 -1.03 0.00 0.00 54.13 53.67 2edr s LEU 47 Cb -0.15 -2.46 -0.04 0.00 0.03 0.00 0.00 46.19 43.58 2edr s LEU 47 CO -0.11 -0.03 -0.17 -0.13 0.23 0.00 0.00 176.35 176.14 2edr s ARG 48 N 1.14 1.06 0.09 1.70 0.52 -1.26 -3.96 118.95 118.22 2edr s ARG 48 Ca 0.18 -1.18 -0.31 0.00 -0.52 0.00 0.00 55.73 53.90 2edr s ARG 48 Cb -0.14 -1.12 -0.10 0.00 0.52 0.00 0.00 34.95 34.11 2edr s ARG 48 CO 0.07 0.24 1.90 -0.40 0.02 0.00 0.00 175.30 177.13 2edr n ASP 49 N 0.82 4.13 0.00 0.23 5.75 -1.26 -4.75 116.55 121.48 2edr n ASP 49 Ca -0.18 0.95 0.00 0.00 -0.01 0.00 0.00 54.79 55.55 2edr n ASP 49 Cb 0.55 -1.54 0.00 0.00 -1.03 0.00 0.00 41.12 39.10 2edr n ASP 49 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2edr n GLY 50 N 4.39 4.17 0.00 6.12 0.00 -0.10 -5.01 105.19 114.75 2edr n GLY 50 Ca 0.19 -0.67 0.00 0.00 0.00 0.00 0.00 46.02 45.54 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 -0.11 1.61 8.00 -1.26 -4.06 116.55 120.73 2edr n ASP 51 Ca 0.00 0.63 -0.21 0.00 0.71 0.00 0.00 54.79 55.92 2edr n ASP 51 Cb 0.00 -0.26 -0.07 0.00 -0.02 0.00 0.00 41.12 40.77 2edr n ASP 51 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2edr n ARG 52 N -2.18 0.51 -1.27 -1.24 5.12 -1.26 -4.93 116.66 111.41 2edr n ARG 52 Ca 0.00 0.22 -0.46 0.00 -1.93 0.00 0.00 57.85 55.68 2edr n ARG 52 Cb 0.00 -1.37 -0.12 0.00 -1.16 0.00 0.00 32.46 29.80 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 -4.20 0.78 -4.56 -1.55 8.25 -1.23 -4.83 115.22 107.88 2edr n HIS 53 Ca -0.38 0.52 -0.33 0.00 -0.26 0.00 0.00 57.72 57.27 2edr n HIS 53 Cb 0.73 -2.15 -0.13 0.00 1.12 0.00 0.00 29.99 29.56 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 6.96 4.52 -0.41 0.41 0.15 -0.85 -0.93 113.70 123.54 2edr s SER 54 Ca 1.18 -0.18 0.04 0.00 0.70 0.00 0.00 55.95 57.70 2edr s SER 54 Cb -1.27 -1.64 0.45 0.00 -1.71 0.00 0.00 66.02 61.85 2edr s SER 54 CO 0.53 0.19 1.39 0.18 1.20 0.00 0.00 173.24 176.73 2edr n LEU 55 N 3.35 5.57 -4.75 3.45 7.99 -1.26 -0.81 117.00 130.55 2edr n LEU 55 Ca -0.18 -4.74 -0.38 0.00 -0.01 0.00 0.00 56.01 50.71 2edr n LEU 55 Cb 0.53 -0.52 0.05 0.00 -0.11 0.00 0.00 43.42 43.36 2edr n LEU 55 CO 0.31 1.99 0.94 0.00 -1.51 0.00 0.00 177.39 179.12 2edr s ARG 56 N -3.66 2.99 0.12 3.23 3.03 -1.17 -4.66 118.95 118.83 2edr s ARG 56 Ca 0.53 2.12 0.06 0.00 2.03 0.00 0.00 55.73 60.47 2edr s ARG 56 Cb 0.43 -2.11 -0.04 0.00 -1.03 0.00 0.00 34.95 32.20 2edr s ARG 56 CO -0.03 -1.27 -0.15 -0.65 -1.13 0.00 0.00 175.30 172.07 2edr s GLN 57 N -3.08 1.04 -0.49 3.89 -0.21 -1.26 -1.40 119.66 118.16 2edr s GLN 57 Ca 0.75 -1.22 0.07 0.00 0.02 0.00 0.00 55.36 54.98 2edr s GLN 57 Cb -0.38 -0.99 0.23 0.00 1.00 0.00 0.00 33.01 32.87 2edr s GLN 57 CO 0.43 0.20 0.55 -3.47 -2.12 0.00 0.00 175.29 170.88 2edr n ASP 58 N 0.64 1.29 -2.77 5.90 2.03 0.11 -4.96 116.55 118.78 2edr n ASP 58 Ca -0.16 -2.89 -0.02 0.00 0.52 0.00 0.00 54.79 52.23 2edr n ASP 58 Cb 0.56 -0.64 -0.02 0.00 -0.72 0.00 0.00 41.12 40.30 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 1.51 -3.73 3.16 0.27 0.00 -1.26 -3.84 105.19 101.30 2edr n GLY 59 Ca 0.25 0.86 -0.23 0.00 0.00 0.00 0.00 46.02 46.90 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 1.33 -1.02 -3.34 4.61 0.00 -1.26 -4.81 120.51 116.02 2edr n ALA 60 Ca -0.16 0.21 -0.10 0.00 0.00 0.00 0.00 53.44 53.40 2edr n ALA 60 Cb 0.30 -3.49 -0.07 0.00 0.00 0.00 0.00 19.45 16.19 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 -3.08 -0.59 0.20 0.00 1.01 -1.25 -2.17 120.40 114.51 2edr s VAL 61 Ca 0.34 -0.19 -0.08 0.00 0.00 0.00 0.00 61.98 62.05 2edr s VAL 61 Cb -0.17 -0.89 -0.07 0.00 0.00 0.00 0.00 36.38 35.26 2edr s VAL 61 CO 0.43 -0.21 0.49 0.00 0.00 0.00 0.00 175.10 175.80 2edr s GLU 63 N -2.74 0.09 -0.26 0.00 2.02 -0.49 -1.67 118.70 115.64 2edr s GLU 63 Ca 0.45 0.50 -0.13 0.00 0.02 0.00 0.00 54.97 55.82 2edr s GLU 63 Cb -0.12 -0.47 -0.04 0.00 0.10 0.00 0.00 34.13 33.60 2edr s GLU 63 CO 0.22 -0.39 0.26 -1.17 0.02 0.00 0.00 175.26 174.21 2edr s LEU 64 N 2.32 4.06 -0.33 1.80 2.96 -1.05 -3.06 118.68 125.38 2edr s LEU 64 Ca 0.03 0.16 -0.07 0.00 -0.22 0.00 0.00 54.13 54.03 2edr s LEU 64 Cb -0.13 -2.25 0.02 0.00 0.50 0.00 0.00 46.19 44.34 2edr s LEU 64 CO -0.08 -0.07 0.11 -1.58 -1.32 0.00 0.00 176.35 173.41 2edr s GLN 65 N 1.67 2.85 -0.34 1.98 0.74 0.01 -1.53 119.66 125.05 2edr s GLN 65 Ca 0.11 -1.03 0.01 0.00 0.05 0.00 0.00 55.36 54.50 2edr s GLN 65 Cb -0.15 -3.46 0.09 0.00 1.10 0.00 0.00 33.01 30.58 2edr s GLN 65 CO 0.09 -0.58 0.05 0.42 -0.55 0.00 0.00 175.29 174.72 2edr s ILE 66 N 1.46 2.65 0.77 -2.34 1.01 0.75 -2.01 121.20 123.49 2edr s ILE 66 Ca 0.01 -1.97 -0.12 0.00 0.00 0.00 0.00 60.65 58.57 2edr s ILE 66 Cb -0.18 -2.76 0.06 0.00 0.01 0.00 0.00 42.46 39.58 2edr s ILE 66 CO 0.03 -0.43 1.14 0.00 0.00 0.00 0.00 174.94 175.69 2edr n GLY 68 N -3.19 -0.42 3.49 0.00 0.00 -1.19 -4.92 105.19 98.96 2edr n GLY 68 Ca 0.08 0.15 -0.33 0.00 0.00 0.00 0.00 46.02 45.92 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 -4.44 1.05 -3.71 0.99 4.77 -0.35 -4.73 117.00 110.58 2edr n LEU 69 Ca -0.18 0.43 -0.12 0.00 -0.03 0.00 0.00 56.01 56.12 2edr n LEU 69 Cb 0.63 -1.28 -0.10 0.00 -2.33 0.00 0.00 43.42 40.33 2edr n LEU 69 CO 0.62 -3.09 0.07 0.00 -1.33 0.00 0.00 177.39 173.66 2edr s ALA 70 N -2.28 -1.05 0.66 -1.18 0.00 -1.26 -1.53 121.76 115.12 2edr s ALA 70 Ca 0.62 1.37 0.16 0.00 0.00 0.00 0.00 51.96 54.11 2edr s ALA 70 Cb -0.25 -0.82 0.84 0.00 0.00 0.00 0.00 23.12 22.88 2edr s ALA 70 CO 0.62 -0.23 1.47 0.28 0.00 0.00 0.00 175.76 177.89 2edr h VAL 71 N 5.05 0.01 0.11 0.00 2.07 -1.88 1.13 116.25 122.74 2edr h VAL 71 Ca -0.32 0.00 -0.28 0.00 0.82 0.00 0.00 66.70 66.92 2edr h VAL 71 Cb 1.18 0.33 -0.01 0.00 -1.52 0.00 0.00 31.29 31.28 2edr h VAL 71 CO 0.27 0.00 -1.36 0.00 0.02 0.00 0.00 177.57 176.50 2edr h ALA 72 N 0.68 0.22 0.00 1.67 0.00 -1.95 -3.28 119.26 116.60 2edr h ALA 72 Ca 0.02 -1.01 -0.00 0.00 0.00 0.00 0.00 54.91 53.93 2edr h ALA 72 Cb 1.39 0.13 -0.00 0.00 0.00 0.00 0.00 17.79 19.30 2edr h ALA 72 CO -0.00 1.09 -0.01 -0.44 0.00 0.00 0.00 179.25 179.89 2edr h ASP 73 N 0.06 0.00 -3.23 0.00 5.19 0.93 -3.43 116.42 115.94 2edr h ASP 73 Ca -0.18 0.00 -0.58 0.00 -0.62 0.00 0.00 57.03 55.66 2edr h ASP 73 Cb 1.98 0.00 0.14 0.00 0.18 0.00 0.00 39.33 41.63 2edr h ASP 73 CO 0.17 0.01 0.12 0.00 -3.12 0.00 0.00 179.24 176.42 2edr n ALA 74 N -2.50 0.11 0.00 3.45 0.00 -1.17 -4.71 120.51 115.69 2edr n ALA 74 Ca -0.03 0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.55 2edr n ALA 74 Cb 0.09 -2.08 0.00 0.00 0.00 0.00 0.00 19.45 17.47 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 1.25 -1.62 3.26 0.00 0.00 -0.93 -5.01 105.19 102.15 2edr n GLY 75 Ca 0.11 0.60 0.03 0.00 0.00 0.00 0.00 46.02 46.76 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 0.23 0.31 1.61 2.12 -1.26 -3.44 118.70 118.27 2edr s GLU 76 Ca 0.00 0.51 0.04 0.00 0.36 0.00 0.00 54.97 55.88 2edr s GLU 76 Cb 0.00 0.30 -0.02 0.00 0.26 0.00 0.00 34.13 34.67 2edr s GLU 76 CO 0.00 -0.16 0.46 0.71 -0.54 0.00 0.00 175.26 175.73 2edr s TYR 77 N 2.63 3.32 -0.05 5.30 1.51 -1.17 -1.86 117.35 127.04 2edr s TYR 77 Ca -0.00 -0.00 -0.11 0.00 -1.01 0.00 0.00 57.07 55.95 2edr s TYR 77 Cb -0.08 -1.84 0.02 0.00 -0.11 0.00 0.00 41.96 39.95 2edr s TYR 77 CO -0.15 0.16 0.26 -1.12 -1.11 0.00 0.00 175.55 173.59 2edr s SER 78 N -4.08 -0.19 -0.28 2.29 0.01 0.52 -1.09 113.70 110.89 2edr s SER 78 Ca 0.40 0.24 -0.03 0.00 1.31 0.00 0.00 55.95 57.87 2edr s SER 78 Cb -0.09 0.40 0.03 0.00 0.21 0.00 0.00 66.02 66.57 2edr s SER 78 CO 0.32 -0.27 -0.01 0.00 0.41 0.00 0.00 173.24 173.69 2edr s VAL 80 N 1.33 5.28 -0.03 0.00 1.01 0.36 -2.64 120.40 125.71 2edr s VAL 80 Ca -0.02 0.53 -0.00 0.00 0.00 0.00 0.00 61.98 62.49 2edr s VAL 80 Cb -0.18 -3.59 -0.02 0.00 0.00 0.00 0.00 36.38 32.59 2edr s VAL 80 CO -0.02 0.51 -0.03 0.00 0.00 0.00 0.00 175.10 175.56 2edr n GLY 82 N 3.14 -2.23 0.01 0.00 0.00 -1.26 -4.81 105.19 100.04 2edr n GLY 82 Ca -0.06 0.71 0.09 0.00 0.00 0.00 0.00 46.02 46.76 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 -0.84 0.61 -4.39 1.61 1.02 -1.26 -5.00 120.64 112.40 2edr n GLU 83 Ca 0.00 -0.17 -0.27 0.00 -0.02 0.00 0.00 57.16 56.70 2edr n GLU 83 Cb 0.00 -1.46 -0.09 0.00 -0.02 0.00 0.00 31.44 29.87 2edr n GLU 83 CO 0.00 0.00 0.00 -1.83 1.18 0.00 0.00 177.13 176.48 2edr s GLU 84 N -3.32 2.12 -0.29 3.49 1.03 -1.26 -5.15 118.70 115.32 2edr s GLU 84 Ca -0.07 -2.02 -0.23 0.00 0.03 0.00 0.00 54.97 52.67 2edr s GLU 84 Cb 0.12 -1.80 0.14 0.00 -0.80 0.00 0.00 34.13 31.79 2edr s GLU 84 CO 0.81 -0.14 1.07 0.50 -1.33 0.00 0.00 175.26 176.17 2edr s ARG 85 N -3.84 0.42 0.44 -4.83 3.52 -1.26 -3.17 118.95 110.23 2edr s ARG 85 Ca 0.34 0.54 0.07 0.00 -0.13 0.00 0.00 55.73 56.56 2edr s ARG 85 Cb 0.06 0.18 -0.02 0.00 -1.56 0.00 0.00 34.95 33.61 2edr s ARG 85 CO 0.18 -0.06 0.35 -0.08 -0.81 0.00 0.00 175.30 174.89 2edr s THR 86 N 0.45 2.42 0.02 4.11 -1.32 -1.08 -4.92 115.64 115.31 2edr s THR 86 Ca 0.01 -1.43 -0.07 0.00 -1.21 0.00 0.00 61.69 58.99 2edr s THR 86 Cb -0.05 -2.85 -0.00 0.00 -1.51 0.00 0.00 72.50 68.09 2edr s THR 86 CO -0.09 0.00 0.13 -0.94 -2.21 0.00 0.00 174.62 171.50 2edr s SER 87 N -4.12 0.08 -0.24 8.08 1.04 -1.26 -1.30 113.70 115.98 2edr s SER 87 Ca 0.45 -0.34 -0.02 0.00 0.48 0.00 0.00 55.95 56.51 2edr s SER 87 Cb -0.02 0.22 0.12 0.00 0.10 0.00 0.00 66.02 66.44 2edr s SER 87 CO 0.26 -0.44 0.31 0.00 0.98 0.00 0.00 173.24 174.35 2edr s ALA 88 N -1.93 -0.68 0.17 5.32 0.00 -0.25 -4.52 121.76 119.87 2edr s ALA 88 Ca -0.11 0.41 -0.34 0.00 0.00 0.00 0.00 51.96 51.93 2edr s ALA 88 Cb -0.05 -1.59 -0.14 0.00 0.00 0.00 0.00 23.12 21.34 2edr s ALA 88 CO -0.01 -1.35 1.47 2.41 0.00 0.00 0.00 175.76 178.28 2edr n THR 89 N 5.34 0.30 -4.31 0.00 -1.04 -1.26 -3.03 114.28 110.28 2edr n THR 89 Ca -0.04 -0.07 -0.34 0.00 -2.04 0.00 0.00 64.05 61.56 2edr n THR 89 Cb 0.49 -1.37 -0.12 0.00 -1.82 0.00 0.00 70.33 67.51 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 0.61 3.20 -0.26 -4.42 2.96 -1.22 -2.80 118.68 116.74 2edr s LEU 90 Ca 0.77 -0.17 -0.03 0.00 -0.22 0.00 0.00 54.13 54.47 2edr s LEU 90 Cb -0.73 -1.78 0.02 0.00 0.50 0.00 0.00 46.19 44.20 2edr s LEU 90 CO 0.43 0.13 -0.01 -0.89 -1.32 0.00 0.00 176.35 174.69 2edr s THR 91 N 0.59 3.24 -0.09 3.68 2.01 -0.96 -2.19 115.64 121.92 2edr s THR 91 Ca -0.02 -0.91 -0.13 0.00 0.31 0.00 0.00 61.69 60.93 2edr s THR 91 Cb -0.14 -2.65 -0.05 0.00 0.01 0.00 0.00 72.50 69.66 2edr s THR 91 CO 0.02 0.16 0.32 -0.69 -0.69 0.00 0.00 174.62 173.74 2edr s VAL 92 N 1.38 5.23 0.41 3.82 1.01 -1.26 0.04 120.40 131.03 2edr s VAL 92 Ca 0.01 0.62 0.08 0.00 0.00 0.00 0.00 61.98 62.68 2edr s VAL 92 Cb -0.17 -3.63 -0.02 0.00 0.00 0.00 0.00 36.38 32.56 2edr s VAL 92 CO -0.02 0.51 0.35 -0.54 0.00 0.00 0.00 175.10 175.40 2edr s LYS 93 N -0.45 2.52 -0.34 2.72 -0.14 0.23 -4.84 119.74 119.45 2edr s LYS 93 Ca 0.20 -1.54 -0.16 0.00 -1.36 0.00 0.00 55.97 53.11 2edr s LYS 93 Cb -0.14 -2.35 -0.01 0.00 -1.68 0.00 0.00 37.83 33.64 2edr s LYS 93 CO 0.08 -0.16 0.42 0.00 -0.76 0.00 0.00 175.35 174.93 2edr s ALA 94 N -2.47 3.49 0.48 5.17 0.00 -1.26 0.70 121.76 127.88 2edr s ALA 94 Ca 0.47 -1.11 -0.24 0.00 0.00 0.00 0.00 51.96 51.08 2edr s ALA 94 Cb -0.03 -2.89 -0.07 0.00 0.00 0.00 0.00 23.12 20.14 2edr s ALA 94 CO 0.27 -1.10 1.39 -0.48 0.00 0.00 0.00 175.76 175.85 2edr s LEU 95 N 2.16 4.02 -0.59 0.00 0.05 -1.26 -4.86 118.68 118.19 2edr s LEU 95 Ca 0.14 2.83 -0.27 0.00 0.05 0.00 0.00 54.13 56.89 2edr s LEU 95 Cb -0.16 -4.07 -0.02 0.00 -2.05 0.00 0.00 46.19 39.89 2edr s LEU 95 CO 0.12 -1.30 1.85 -2.16 -0.55 0.00 0.00 176.35 174.31 2edr s PRO 96 N -2.62 2.70 -0.21 1.48 0.04 -1.26 -4.97 135.00 130.16 2edr s PRO 96 Ca 0.65 0.68 -0.04 0.00 0.04 0.00 0.00 61.00 62.33 2edr s PRO 96 Cb -0.42 -4.37 -0.01 0.00 0.04 0.00 0.00 34.50 29.74 2edr s PRO 96 CO 0.52 -2.65 -0.04 0.45 0.04 0.00 0.00 177.00 175.33 2edr s SER 97 N 7.88 4.41 0.00 6.66 0.15 -1.26 -5.02 113.70 126.51 2edr s SER 97 Ca 0.68 -0.34 0.00 0.00 0.70 0.00 0.00 55.95 56.99 2edr s SER 97 Cb -0.13 -1.75 0.00 0.00 -1.71 0.00 0.00 66.02 62.43 2edr s SER 97 CO 0.22 0.02 0.00 0.61 1.20 0.00 0.00 173.24 175.29 2edr n GLY 98 N 4.56 3.65 0.00 9.45 0.00 -1.26 -4.86 105.19 116.72 2edr n GLY 98 Ca -0.18 -1.58 0.07 0.00 0.00 0.00 0.00 46.02 44.34 2edr n GLY 98 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2edr n PRO 99 N -0.75 0.21 -4.27 1.61 -0.04 -1.26 -4.70 135.00 125.80 2edr n PRO 99 Ca 0.00 0.14 -0.33 0.00 -0.04 0.00 0.00 63.50 63.28 2edr n PRO 99 Cb 0.00 -1.50 -0.09 0.00 -0.04 0.00 0.00 33.50 31.87 2edr n PRO 99 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2edr s SER 100 N -2.56 5.17 0.10 3.54 1.04 -1.26 -5.06 113.70 114.67 2edr s SER 100 Ca 0.14 0.01 -0.34 0.00 0.48 0.00 0.00 55.95 56.24 2edr s SER 100 Cb 0.10 -1.37 -0.13 0.00 0.10 0.00 0.00 66.02 64.72 2edr s SER 100 CO 0.22 0.28 1.65 -1.54 0.98 0.00 0.00 173.24 174.84 2edr n SER 101 N 1.40 3.19 0.00 7.02 3.41 -1.26 -4.94 113.62 122.44 2edr n SER 101 Ca -0.15 1.05 0.00 0.00 -0.26 0.00 0.00 58.87 59.52 2edr n SER 101 Cb 0.53 -1.41 0.00 0.00 -0.26 0.00 0.00 64.21 63.06 2edr n SER 101 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49