#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 6.12 -0.05 1.61 0.01 -1.26 -4.97 113.70 115.16 2edr s SER 2 Ca 0.00 0.81 0.00 0.00 1.31 0.00 0.00 55.95 58.07 2edr s SER 2 Cb 0.00 -2.54 0.03 0.00 0.21 0.00 0.00 66.02 63.72 2edr s SER 2 CO 0.00 -1.61 -0.01 -0.94 0.41 0.00 0.00 173.24 171.08 2edr s SER 3 N 4.82 0.96 0.00 2.44 1.04 -1.26 -5.04 113.70 116.66 2edr s SER 3 Ca 0.65 -0.08 0.00 0.00 0.48 0.00 0.00 55.95 57.00 2edr s SER 3 Cb -0.15 -0.36 0.00 0.00 0.10 0.00 0.00 66.02 65.61 2edr s SER 3 CO 0.31 -0.11 0.00 0.61 0.98 0.00 0.00 173.24 175.02 2edr n GLY 4 N 4.42 -1.89 3.38 7.32 0.00 -1.26 -5.11 105.19 112.06 2edr n GLY 4 Ca -0.20 0.86 -0.45 0.00 0.00 0.00 0.00 46.02 46.24 2edr n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2edr s SER 5 N 0.00 6.28 0.26 1.61 1.04 -1.26 -5.01 113.70 116.62 2edr s SER 5 Ca 0.00 -1.58 0.02 0.00 0.48 0.00 0.00 55.95 54.87 2edr s SER 5 Cb 0.00 -2.31 -0.04 0.00 0.10 0.00 0.00 66.02 63.77 2edr s SER 5 CO 0.00 -1.09 0.15 -0.55 0.98 0.00 0.00 173.24 172.73 2edr s SER 6 N 3.51 0.96 0.29 7.02 0.15 -1.26 -5.18 113.70 119.19 2edr s SER 6 Ca 0.15 -1.48 0.01 0.00 0.70 0.00 0.00 55.95 55.33 2edr s SER 6 Cb -0.20 0.35 -0.02 0.00 -1.71 0.00 0.00 66.02 64.44 2edr s SER 6 CO 0.03 -0.86 0.30 -0.83 1.20 0.00 0.00 173.24 173.09 2edr s GLY 7 N -3.28 1.71 1.21 9.45 0.00 -1.26 -5.17 107.32 109.98 2edr s GLY 7 Ca 0.38 -1.73 -0.20 0.00 0.00 0.00 0.00 44.72 43.17 2edr s GLY 7 CO 0.16 -1.27 1.07 -1.55 0.00 0.00 0.00 173.10 171.51 2edr n PRO 8 N -0.48 -3.11 -1.65 2.90 -0.04 -1.26 -4.89 135.00 126.47 2edr n PRO 8 Ca 0.04 -1.72 -0.42 0.00 -0.04 0.00 0.00 63.50 61.35 2edr n PRO 8 Cb 0.63 -1.61 -0.03 0.00 -0.04 0.00 0.00 33.50 32.45 2edr n PRO 8 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2edr s ALA 9 N -3.02 3.16 0.63 0.55 0.00 -1.26 -4.96 121.76 116.86 2edr s ALA 9 Ca 0.70 1.05 -0.13 0.00 0.00 0.00 0.00 51.96 53.58 2edr s ALA 9 Cb -0.07 -3.96 -0.03 0.00 0.00 0.00 0.00 23.12 19.07 2edr s ALA 9 CO 0.53 -2.18 1.04 -1.58 0.00 0.00 0.00 175.76 173.57 2edr s HIS 10 N 6.37 3.30 -0.61 0.00 2.46 -1.26 -4.66 115.29 120.88 2edr s HIS 10 Ca 0.94 1.40 -0.25 0.00 0.47 0.00 0.00 55.06 57.63 2edr s HIS 10 Cb -0.38 -2.84 0.04 0.00 -0.13 0.00 0.00 32.58 29.27 2edr s HIS 10 CO 0.38 -0.92 1.05 -0.06 -2.47 0.00 0.00 174.74 172.72 2edr s PHE 11 N -2.92 2.65 -0.06 3.88 0.08 -1.26 0.38 117.98 120.73 2edr s PHE 11 Ca 0.58 -0.04 0.14 0.00 0.12 0.00 0.00 56.93 57.73 2edr s PHE 11 Cb -0.13 -4.29 -0.18 0.00 -0.57 0.00 0.00 43.02 37.85 2edr s PHE 11 CO 0.48 -1.57 0.80 -0.84 -0.10 0.00 0.00 175.22 174.00 2edr h ILE 12 N 6.04 0.78 -2.33 0.64 3.07 -1.73 -3.39 117.51 120.59 2edr h ILE 12 Ca -0.27 -2.47 -0.67 0.00 1.55 0.00 0.00 64.86 63.00 2edr h ILE 12 Cb 1.07 2.31 -0.37 0.00 -0.27 0.00 0.00 36.82 39.56 2edr h ILE 12 CO 1.16 0.45 -0.06 0.61 -1.05 0.00 0.00 178.15 179.26 2edr n GLY 13 N 1.47 5.56 2.62 0.16 0.00 -0.77 -4.96 105.19 109.26 2edr n GLY 13 Ca -0.12 -2.72 -0.35 0.00 0.00 0.00 0.00 46.02 42.82 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 0.16 0.00 -0.21 1.61 5.12 -1.26 -2.86 116.66 119.22 2edr n ARG 14 Ca 0.34 0.00 -0.16 0.00 -1.93 0.00 0.00 57.85 56.10 2edr n ARG 14 Cb 0.35 -0.78 0.16 0.00 -1.16 0.00 0.00 32.46 31.03 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 1.67 0.00 -3.65 0.55 4.77 -1.26 -4.87 117.00 114.21 2edr n LEU 15 Ca 0.12 -0.46 -0.05 0.00 -0.03 0.00 0.00 56.01 55.59 2edr n LEU 15 Cb 0.24 -0.59 -0.07 0.00 -2.33 0.00 0.00 43.42 40.68 2edr n LEU 15 CO 0.43 -2.25 0.17 0.00 -1.33 0.00 0.00 177.39 174.42 2edr s ARG 16 N -3.76 0.49 -0.01 3.23 3.03 -1.26 -4.93 118.95 115.74 2edr s ARG 16 Ca 0.35 1.25 -0.39 0.00 2.03 0.00 0.00 55.73 58.97 2edr s ARG 16 Cb -0.06 0.56 -0.19 0.00 -1.03 0.00 0.00 34.95 34.23 2edr s ARG 16 CO 0.30 -0.21 1.22 -2.39 -1.13 0.00 0.00 175.30 173.08 2edr n HIS 17 N 5.25 1.05 -4.82 5.89 1.44 -1.26 -4.88 115.22 117.89 2edr n HIS 17 Ca -0.12 0.91 -0.25 0.00 -2.01 0.00 0.00 57.72 56.24 2edr n HIS 17 Cb 0.50 -2.19 -0.16 0.00 0.12 0.00 0.00 29.99 28.27 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 0.47 1.58 -0.27 -1.40 -2.07 -1.18 -4.97 119.66 111.82 2edr s GLN 18 Ca 0.90 -0.61 -0.12 0.00 -1.82 0.00 0.00 55.36 53.72 2edr s GLN 18 Cb -1.17 -1.44 -0.05 0.00 -1.09 0.00 0.00 33.01 29.26 2edr s GLN 18 CO 0.55 0.30 0.21 -2.00 -1.32 0.00 0.00 175.29 173.04 2edr s GLU 19 N -0.17 3.99 0.47 9.60 2.12 -1.26 -2.01 118.70 131.44 2edr s GLU 19 Ca 0.01 -0.25 0.05 0.00 0.36 0.00 0.00 54.97 55.14 2edr s GLU 19 Cb -0.09 -3.63 -0.02 0.00 0.26 0.00 0.00 34.13 30.64 2edr s GLU 19 CO 0.01 -0.14 0.15 -1.54 -0.54 0.00 0.00 175.26 173.19 2edr s SER 20 N 1.59 4.29 -0.08 -1.70 1.04 0.11 -4.98 113.70 113.98 2edr s SER 20 Ca 0.09 -1.35 -0.01 0.00 0.48 0.00 0.00 55.95 55.16 2edr s SER 20 Cb -0.15 0.05 -0.03 0.00 0.10 0.00 0.00 66.02 65.99 2edr s SER 20 CO 0.09 -0.75 -0.03 -0.63 0.98 0.00 0.00 173.24 172.90 2edr s ILE 21 N -2.74 4.03 0.09 -1.02 -1.09 -1.26 0.58 121.20 119.78 2edr s ILE 21 Ca 0.27 -0.35 -0.35 0.00 -2.23 0.00 0.00 60.65 57.99 2edr s ILE 21 Cb 0.03 -2.68 -0.15 0.00 -1.58 0.00 0.00 42.46 38.08 2edr s ILE 21 CO 0.15 0.60 1.54 1.21 -1.23 0.00 0.00 174.94 177.21 2edr n GLU 22 N 2.23 1.77 0.00 2.79 2.13 0.19 -1.27 120.64 128.48 2edr n GLU 22 Ca -0.18 0.64 0.00 0.00 0.66 0.00 0.00 57.16 58.28 2edr n GLU 22 Cb 0.53 -2.37 0.00 0.00 0.27 0.00 0.00 31.44 29.87 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 3.27 2.83 3.25 8.31 0.00 -0.94 -4.25 105.19 117.67 2edr n GLY 23 Ca 0.19 -0.72 -0.31 0.00 0.00 0.00 0.00 46.02 45.18 2edr n GLY 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2edr s ALA 24 N -0.96 -0.89 -0.37 4.61 0.00 -0.39 -3.13 121.76 120.63 2edr s ALA 24 Ca 0.00 -0.86 -0.04 0.00 0.00 0.00 0.00 51.96 51.05 2edr s ALA 24 Cb 0.00 -2.92 0.08 0.00 0.00 0.00 0.00 23.12 20.28 2edr s ALA 24 CO 0.00 -4.78 0.14 0.99 0.00 0.00 0.00 175.76 172.11 2edr s THR 25 N -2.18 3.45 0.82 0.00 2.01 -1.26 -1.02 115.64 117.47 2edr s THR 25 Ca 0.68 -1.60 -0.11 0.00 0.31 0.00 0.00 61.69 60.97 2edr s THR 25 Cb -0.12 -3.14 0.09 0.00 0.01 0.00 0.00 72.50 69.34 2edr s THR 25 CO 0.57 -0.41 1.14 0.00 -0.69 0.00 0.00 174.62 175.24 2edr s ALA 26 N 1.27 1.87 -0.28 7.40 0.00 0.19 -4.76 121.76 127.45 2edr s ALA 26 Ca 0.02 0.56 0.00 0.00 0.00 0.00 0.00 51.96 52.54 2edr s ALA 26 Cb -0.21 -3.40 0.16 0.00 0.00 0.00 0.00 23.12 19.67 2edr s ALA 26 CO -0.01 -2.23 0.46 0.99 0.00 0.00 0.00 175.76 174.97 2edr s THR 27 N -2.57 -0.75 0.53 0.00 2.01 -1.25 -0.88 115.64 112.73 2edr s THR 27 Ca 0.67 -0.12 -0.01 0.00 0.31 0.00 0.00 61.69 62.54 2edr s THR 27 Cb -0.22 -0.93 0.02 0.00 0.01 0.00 0.00 72.50 71.37 2edr s THR 27 CO 0.54 -0.13 0.78 -0.76 -0.69 0.00 0.00 174.62 174.36 2edr s LEU 28 N 2.65 3.36 -0.20 4.42 1.43 0.09 -4.89 118.68 125.54 2edr s LEU 28 Ca 0.13 0.29 -0.19 0.00 -1.03 0.00 0.00 54.13 53.32 2edr s LEU 28 Cb -0.14 -3.13 0.05 0.00 0.03 0.00 0.00 46.19 43.00 2edr s LEU 28 CO -0.23 -1.00 0.56 -0.60 0.23 0.00 0.00 176.35 175.31 2edr s ARG 29 N -4.77 0.66 0.24 1.70 3.52 -1.26 -2.17 118.95 116.86 2edr s ARG 29 Ca 0.53 0.76 -0.04 0.00 -0.13 0.00 0.00 55.73 56.85 2edr s ARG 29 Cb -0.10 0.32 -0.03 0.00 -1.56 0.00 0.00 34.95 33.58 2edr s ARG 29 CO 0.40 -0.08 0.27 0.00 -0.81 0.00 0.00 175.30 175.08 2edr s GLU 31 N -3.96 0.85 0.25 0.00 2.12 -1.14 -2.47 118.70 114.35 2edr s GLU 31 Ca 0.34 -0.77 0.08 0.00 0.36 0.00 0.00 54.97 54.97 2edr s GLU 31 Cb 0.04 -0.83 -0.05 0.00 0.26 0.00 0.00 34.13 33.54 2edr s GLU 31 CO 0.13 0.20 -0.11 -0.51 -0.54 0.00 0.00 175.26 174.43 2edr s LEU 32 N -1.25 2.52 0.58 2.70 1.43 -0.41 -1.85 118.68 122.40 2edr s LEU 32 Ca -0.00 -1.10 0.39 0.00 -1.03 0.00 0.00 54.13 52.38 2edr s LEU 32 Cb -0.08 -0.69 2.02 0.00 0.03 0.00 0.00 46.19 47.47 2edr s LEU 32 CO 0.01 -0.24 2.18 0.77 0.23 0.00 0.00 176.35 179.31 2edr h SER 33 N 2.40 0.00 -3.42 2.29 4.64 -0.34 -3.43 113.55 115.69 2edr h SER 33 Ca -0.39 0.00 0.17 0.00 -0.47 0.00 0.00 61.79 61.10 2edr h SER 33 Cb 1.23 0.00 -0.26 0.00 -0.31 0.00 0.00 62.40 63.06 2edr h SER 33 CO 0.64 0.00 0.77 -1.59 -0.87 0.00 0.00 176.83 175.79 2edr s LYS 34 N -3.95 0.28 -0.47 4.77 -2.85 -1.26 -4.96 119.74 111.30 2edr s LYS 34 Ca -0.03 0.10 -0.44 0.00 -1.00 0.00 0.00 55.97 54.60 2edr s LYS 34 Cb 0.11 0.13 -0.18 0.00 -2.06 0.00 0.00 37.83 35.83 2edr s LYS 34 CO 0.40 -0.08 1.95 0.00 0.10 0.00 0.00 175.35 177.72 2edr n ALA 35 N 0.76 -0.20 -3.33 0.59 0.00 -1.25 -4.78 120.51 112.30 2edr n ALA 35 Ca -0.05 0.27 -0.15 0.00 0.00 0.00 0.00 53.44 53.51 2edr n ALA 35 Cb 0.58 -2.09 -0.07 0.00 0.00 0.00 0.00 19.45 17.88 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 5.04 -1.25 0.33 0.00 0.00 -1.26 -4.98 121.76 119.63 2edr s ALA 36 Ca 1.13 0.70 -0.28 0.00 0.00 0.00 0.00 51.96 53.51 2edr s ALA 36 Cb -1.41 0.17 -0.10 0.00 0.00 0.00 0.00 23.12 21.78 2edr s ALA 36 CO 0.69 -0.38 1.22 -1.25 0.00 0.00 0.00 175.76 176.04 2edr s PRO 37 N -1.72 4.38 0.42 0.00 0.04 -1.26 -5.02 135.00 131.84 2edr s PRO 37 Ca -0.10 2.03 0.03 0.00 0.04 0.00 0.00 61.00 63.01 2edr s PRO 37 Cb -0.02 -3.03 -0.03 0.00 0.04 0.00 0.00 34.50 31.46 2edr s PRO 37 CO 0.04 -0.10 0.09 0.14 0.04 0.00 0.00 177.00 177.21 2edr s VAL 38 N -1.19 0.82 -0.26 -0.36 -7.23 -1.26 -4.58 120.40 106.34 2edr s VAL 38 Ca 0.49 -2.00 -0.01 0.00 -1.81 0.00 0.00 61.98 58.65 2edr s VAL 38 Cb -0.36 -2.38 0.13 0.00 0.56 0.00 0.00 36.38 34.34 2edr s VAL 38 CO 0.47 0.00 0.34 -0.70 -0.31 0.00 0.00 175.10 174.90 2edr s GLU 39 N -3.77 0.33 0.50 4.82 2.12 0.58 -4.93 118.70 118.36 2edr s GLU 39 Ca 0.22 0.21 -0.21 0.00 0.36 0.00 0.00 54.97 55.55 2edr s GLU 39 Cb 0.03 -0.59 -0.07 0.00 0.26 0.00 0.00 34.13 33.76 2edr s GLU 39 CO 0.12 -0.84 1.15 -1.58 -0.54 0.00 0.00 175.26 173.57 2edr s TRP 40 N 2.46 2.77 -0.16 5.30 0.52 -1.25 -0.49 118.94 128.09 2edr s TRP 40 Ca 0.10 1.54 -0.04 0.00 0.02 0.00 0.00 56.10 57.72 2edr s TRP 40 Cb -0.14 -3.34 0.06 0.00 -1.15 0.00 0.00 33.47 28.90 2edr s TRP 40 CO -0.23 -1.55 0.12 1.03 0.02 0.00 0.00 176.95 176.35 2edr s ARG 41 N -2.99 0.07 -0.84 4.98 0.52 0.28 0.11 118.95 121.07 2edr s ARG 41 Ca 0.68 0.08 -0.20 0.00 -0.52 0.00 0.00 55.73 55.77 2edr s ARG 41 Cb -0.26 -1.44 0.11 0.00 0.52 0.00 0.00 34.95 33.88 2edr s ARG 41 CO 0.31 -0.61 1.08 0.21 0.02 0.00 0.00 175.30 176.31 2edr s LYS 42 N 2.20 3.43 -0.13 3.54 2.20 -1.14 -1.11 119.74 128.73 2edr s LYS 42 Ca 0.04 -1.44 -0.09 0.00 -0.36 0.00 0.00 55.97 54.11 2edr s LYS 42 Cb -0.15 -4.71 0.03 0.00 -1.51 0.00 0.00 37.83 31.49 2edr s LYS 42 CO -0.09 -1.80 0.17 0.41 -0.36 0.00 0.00 175.35 173.69 2edr n GLY 43 N 5.50 -3.60 2.82 5.54 0.00 -0.39 -3.11 105.19 111.95 2edr n GLY 43 Ca 0.15 1.26 -0.12 0.00 0.00 0.00 0.00 46.02 47.31 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 2.00 -2.02 -4.31 1.61 1.85 -1.26 -4.85 116.66 109.68 2edr n ARG 44 Ca -0.30 0.04 -0.17 0.00 -1.00 0.00 0.00 57.85 56.43 2edr n ARG 44 Cb 0.46 -3.83 -0.10 0.00 -1.05 0.00 0.00 32.46 27.94 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 -4.89 1.25 -0.15 2.89 2.12 -1.18 -5.15 118.70 113.59 2edr s GLU 45 Ca 0.24 -1.58 -0.02 0.00 0.36 0.00 0.00 54.97 53.97 2edr s GLU 45 Cb -0.14 -0.82 -0.02 0.00 0.26 0.00 0.00 34.13 33.41 2edr s GLU 45 CO 0.30 0.06 -0.07 0.45 -0.54 0.00 0.00 175.26 175.46 2edr s SER 46 N -3.27 4.45 -0.07 -1.70 0.15 -1.26 -2.91 113.70 109.09 2edr s SER 46 Ca 0.22 -0.23 0.02 0.00 0.70 0.00 0.00 55.95 56.67 2edr s SER 46 Cb 0.02 -1.71 -0.02 0.00 -1.71 0.00 0.00 66.02 62.60 2edr s SER 46 CO 0.05 0.15 -0.12 -0.76 1.20 0.00 0.00 173.24 173.77 2edr s LEU 47 N 0.43 2.84 0.01 3.45 1.02 0.12 -4.86 118.68 121.69 2edr s LEU 47 Ca -0.06 -0.18 -0.18 0.00 0.02 0.00 0.00 54.13 53.73 2edr s LEU 47 Cb -0.15 -1.60 0.03 0.00 0.02 0.00 0.00 46.19 44.50 2edr s LEU 47 CO 0.04 0.31 0.39 0.00 0.02 0.00 0.00 176.35 177.11 2edr s ARG 48 N -0.53 0.83 -0.21 1.70 1.70 -1.26 -3.93 118.95 117.25 2edr s ARG 48 Ca 0.07 -0.24 -0.39 0.00 -0.47 0.00 0.00 55.73 54.71 2edr s ARG 48 Cb -0.12 0.37 -0.15 0.00 -0.57 0.00 0.00 34.95 34.49 2edr s ARG 48 CO 0.02 -0.26 1.74 -0.40 -1.08 0.00 0.00 175.30 175.32 2edr n ASP 49 N 0.85 2.57 0.00 -2.89 5.75 -1.26 -4.82 116.55 116.75 2edr n ASP 49 Ca -0.20 1.06 0.00 0.00 -0.01 0.00 0.00 54.79 55.64 2edr n ASP 49 Cb 0.58 -1.20 0.00 0.00 -1.03 0.00 0.00 41.12 39.47 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 4.11 4.60 0.00 6.12 0.00 -0.92 -5.02 105.19 114.09 2edr n GLY 50 Ca 0.25 -0.56 0.00 0.00 0.00 0.00 0.00 46.02 45.71 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 -0.06 1.61 8.00 -1.26 -4.16 116.55 120.68 2edr n ASP 51 Ca 0.00 0.55 -0.10 0.00 0.71 0.00 0.00 54.79 55.95 2edr n ASP 51 Cb 0.00 -0.19 -0.05 0.00 -0.02 0.00 0.00 41.12 40.86 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 -1.85 0.29 -1.20 -1.24 5.12 -1.26 -4.97 116.66 111.55 2edr n ARG 52 Ca 0.00 0.09 -0.39 0.00 -1.93 0.00 0.00 57.85 55.62 2edr n ARG 52 Cb 0.00 -1.14 -0.12 0.00 -1.16 0.00 0.00 32.46 30.04 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 -3.09 0.61 -3.69 -1.55 8.25 -1.25 -4.83 115.22 109.67 2edr n HIS 53 Ca -0.23 0.41 -0.37 0.00 -0.26 0.00 0.00 57.72 57.28 2edr n HIS 53 Cb 0.71 -1.97 -0.11 0.00 1.12 0.00 0.00 29.99 29.74 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 6.83 5.83 -0.45 0.41 0.15 -0.86 -2.17 113.70 123.44 2edr s SER 54 Ca 1.10 -0.00 0.03 0.00 0.70 0.00 0.00 55.95 57.79 2edr s SER 54 Cb -1.11 -2.06 0.47 0.00 -1.71 0.00 0.00 66.02 61.60 2edr s SER 54 CO 0.45 0.01 1.58 0.18 1.20 0.00 0.00 173.24 176.67 2edr n LEU 55 N 4.62 6.04 -4.66 3.45 7.99 -1.26 -0.93 117.00 132.24 2edr n LEU 55 Ca -0.15 -4.44 -0.45 0.00 -0.01 0.00 0.00 56.01 50.96 2edr n LEU 55 Cb 0.52 -0.64 -0.03 0.00 -0.11 0.00 0.00 43.42 43.16 2edr n LEU 55 CO 0.33 1.74 0.99 -2.11 -1.51 0.00 0.00 177.39 176.84 2edr n ARG 56 N -0.85 1.93 -5.23 3.23 1.85 -1.22 -4.72 116.66 111.66 2edr n ARG 56 Ca 0.51 0.69 -0.31 0.00 -1.00 0.00 0.00 57.85 57.74 2edr n ARG 56 Cb 0.87 -2.33 -0.16 0.00 -1.05 0.00 0.00 32.46 29.78 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 -0.31 2.05 -0.60 2.89 -0.21 -1.26 -2.49 119.66 119.73 2edr s GLN 57 Ca 0.70 -0.97 0.05 0.00 0.02 0.00 0.00 55.36 55.16 2edr s GLN 57 Cb -0.68 -2.03 0.20 0.00 1.00 0.00 0.00 33.01 31.51 2edr s GLN 57 CO 0.49 0.55 0.54 -3.47 -2.12 0.00 0.00 175.29 171.28 2edr n ASP 58 N 2.31 2.25 0.00 5.90 2.03 -0.09 -5.01 116.55 123.93 2edr n ASP 58 Ca -0.16 -3.06 0.00 0.00 0.52 0.00 0.00 54.79 52.09 2edr n ASP 58 Cb 0.51 -0.68 0.00 0.00 -0.72 0.00 0.00 41.12 40.23 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 1.75 1.78 1.35 0.27 0.00 -1.26 -3.25 105.19 105.83 2edr n GLY 59 Ca 0.25 -0.25 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 5.76 3.87 -3.65 4.61 0.00 -1.26 -3.84 120.51 126.00 2edr n ALA 60 Ca 0.00 -2.52 -0.22 0.00 0.00 0.00 0.00 53.44 50.70 2edr n ALA 60 Cb 0.00 -0.91 -0.17 0.00 0.00 0.00 0.00 19.45 18.38 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 -2.99 0.65 0.12 0.00 1.01 -1.20 -1.29 120.40 116.70 2edr s VAL 61 Ca 0.47 -0.16 0.06 0.00 0.00 0.00 0.00 61.98 62.36 2edr s VAL 61 Cb 0.39 -0.68 -0.04 0.00 0.00 0.00 0.00 36.38 36.05 2edr s VAL 61 CO 0.08 0.27 0.00 0.00 0.00 0.00 0.00 175.10 175.45 2edr s GLU 63 N -2.53 -0.02 -0.29 0.00 2.02 -1.04 -1.64 118.70 115.20 2edr s GLU 63 Ca 0.26 0.37 -0.09 0.00 0.02 0.00 0.00 54.97 55.53 2edr s GLU 63 Cb -0.11 -0.34 -0.02 0.00 0.10 0.00 0.00 34.13 33.76 2edr s GLU 63 CO 0.18 -0.26 0.14 -1.17 0.02 0.00 0.00 175.26 174.17 2edr s LEU 64 N 1.78 3.94 -0.20 1.80 2.96 -0.92 -3.37 118.68 124.66 2edr s LEU 64 Ca -0.01 -0.37 -0.08 0.00 -0.22 0.00 0.00 54.13 53.44 2edr s LEU 64 Cb -0.12 -2.00 -0.04 0.00 0.50 0.00 0.00 46.19 44.52 2edr s LEU 64 CO -0.04 -0.14 0.09 -1.58 -1.32 0.00 0.00 176.35 173.36 2edr s GLN 65 N 1.64 3.97 -0.24 1.98 0.74 -0.11 -0.73 119.66 126.90 2edr s GLN 65 Ca 0.05 -0.34 0.02 0.00 0.05 0.00 0.00 55.36 55.14 2edr s GLN 65 Cb -0.16 -3.31 0.06 0.00 1.10 0.00 0.00 33.01 30.69 2edr s GLN 65 CO 0.06 0.17 -0.08 0.42 -0.55 0.00 0.00 175.29 175.31 2edr s ILE 66 N 0.68 1.84 0.53 -2.34 1.01 -0.06 -2.03 121.20 120.83 2edr s ILE 66 Ca 0.05 -1.39 -0.06 0.00 0.00 0.00 0.00 60.65 59.24 2edr s ILE 66 Cb -0.13 -2.01 -0.02 0.00 0.01 0.00 0.00 42.46 40.31 2edr s ILE 66 CO 0.02 -0.04 0.84 0.00 0.00 0.00 0.00 174.94 175.76 2edr n GLY 68 N -2.41 -0.71 3.38 0.00 0.00 -1.24 -4.95 105.19 99.27 2edr n GLY 68 Ca 0.02 0.32 -0.31 0.00 0.00 0.00 0.00 46.02 46.05 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 -3.83 -1.25 -3.63 0.99 4.77 -0.19 -4.75 117.00 109.11 2edr n LEU 69 Ca -0.19 -0.01 -0.05 0.00 -0.03 0.00 0.00 56.01 55.73 2edr n LEU 69 Cb 0.64 -1.13 -0.06 0.00 -2.33 0.00 0.00 43.42 40.55 2edr n LEU 69 CO 0.62 -3.18 0.40 0.00 -1.33 0.00 0.00 177.39 173.90 2edr s ALA 70 N -2.34 -2.00 0.55 -1.18 0.00 -1.26 -2.20 121.76 113.32 2edr s ALA 70 Ca 0.60 2.37 0.48 0.00 0.00 0.00 0.00 51.96 55.42 2edr s ALA 70 Cb -0.18 -1.56 1.72 0.00 0.00 0.00 0.00 23.12 23.10 2edr s ALA 70 CO 0.66 -0.49 1.58 0.28 0.00 0.00 0.00 175.76 177.78 2edr h VAL 71 N 5.19 0.01 -0.05 0.00 2.07 -1.88 1.21 116.25 122.80 2edr h VAL 71 Ca -0.27 -0.00 -0.14 0.00 0.82 0.00 0.00 66.70 67.11 2edr h VAL 71 Cb 1.20 0.01 0.01 0.00 -1.52 0.00 0.00 31.29 30.98 2edr h VAL 71 CO 0.15 0.00 -0.51 0.00 0.02 0.00 0.00 177.57 177.23 2edr h ALA 72 N 1.08 0.12 -1.43 1.67 0.00 -1.95 -3.20 119.26 115.56 2edr h ALA 72 Ca 0.94 -0.52 0.42 0.00 0.00 0.00 0.00 54.91 55.74 2edr h ALA 72 Cb 3.67 0.01 -0.09 0.00 0.00 0.00 0.00 17.79 21.39 2edr h ALA 72 CO -0.07 0.33 0.99 -0.44 0.00 0.00 0.00 179.25 180.06 2edr h ASP 73 N -0.05 0.13 -2.70 0.00 5.19 0.11 -3.41 116.42 115.70 2edr h ASP 73 Ca -0.05 0.05 -0.60 0.00 -0.62 0.00 0.00 57.03 55.82 2edr h ASP 73 Cb 1.19 0.04 0.10 0.00 0.18 0.00 0.00 39.33 40.85 2edr h ASP 73 CO 0.10 -0.04 0.33 0.00 -3.12 0.00 0.00 179.24 176.51 2edr n ALA 74 N -2.70 0.38 -1.63 3.45 0.00 -1.18 -4.75 120.51 114.08 2edr n ALA 74 Ca 0.34 0.39 0.00 0.00 0.00 0.00 0.00 53.44 54.17 2edr n ALA 74 Cb 1.47 -2.13 0.00 0.00 0.00 0.00 0.00 19.45 18.79 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 1.32 -2.00 3.15 0.00 0.00 -1.08 -5.01 105.19 101.57 2edr n GLY 75 Ca 0.09 0.81 0.05 0.00 0.00 0.00 0.00 46.02 46.97 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 0.63 0.32 0.23 1.61 2.12 -1.26 -3.73 118.70 118.62 2edr s GLU 76 Ca 0.00 0.53 -0.00 0.00 0.36 0.00 0.00 54.97 55.86 2edr s GLU 76 Cb 0.00 0.29 -0.04 0.00 0.26 0.00 0.00 34.13 34.64 2edr s GLU 76 CO 0.00 -0.39 0.42 0.71 -0.54 0.00 0.00 175.26 175.45 2edr s TYR 77 N 2.92 3.48 -0.07 5.30 1.51 -1.13 -1.26 117.35 128.10 2edr s TYR 77 Ca 0.09 0.32 -0.08 0.00 -1.01 0.00 0.00 57.07 56.39 2edr s TYR 77 Cb -0.11 -1.84 0.02 0.00 -0.11 0.00 0.00 41.96 39.92 2edr s TYR 77 CO -0.16 0.34 0.21 -1.12 -1.11 0.00 0.00 175.55 173.71 2edr s SER 78 N -3.37 -0.19 -0.36 2.29 0.01 -0.27 0.00 113.70 111.81 2edr s SER 78 Ca 0.38 0.32 -0.09 0.00 1.31 0.00 0.00 55.95 57.88 2edr s SER 78 Cb -0.11 0.40 0.04 0.00 0.21 0.00 0.00 66.02 66.57 2edr s SER 78 CO 0.30 -0.14 0.17 0.00 0.41 0.00 0.00 173.24 173.98 2edr s VAL 80 N 1.48 5.31 -0.11 0.00 1.01 0.35 -3.11 120.40 125.34 2edr s VAL 80 Ca 0.01 0.45 -0.02 0.00 0.00 0.00 0.00 61.98 62.42 2edr s VAL 80 Cb -0.20 -3.60 -0.06 0.00 0.00 0.00 0.00 36.38 32.52 2edr s VAL 80 CO 0.05 0.37 -0.12 0.00 0.00 0.00 0.00 175.10 175.39 2edr n GLY 82 N 2.70 -1.74 0.02 0.00 0.00 -1.26 -4.79 105.19 100.12 2edr n GLY 82 Ca -0.21 0.55 -0.02 0.00 0.00 0.00 0.00 46.02 46.33 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 -2.78 1.55 -3.78 1.61 1.02 -1.26 -5.01 120.64 111.99 2edr n GLU 83 Ca 0.00 0.01 -0.36 0.00 -0.02 0.00 0.00 57.16 56.80 2edr n GLU 83 Cb 0.00 -1.09 -0.07 0.00 -0.02 0.00 0.00 31.44 30.26 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 -2.09 3.93 -0.12 3.49 0.41 -1.26 -5.08 118.70 117.98 2edr s GLU 84 Ca -0.04 -0.18 -0.01 0.00 -0.41 0.00 0.00 54.97 54.33 2edr s GLU 84 Cb 0.01 -3.34 0.04 0.00 -1.78 0.00 0.00 34.13 29.06 2edr s GLU 84 CO 0.12 0.47 -0.01 0.50 -0.49 0.00 0.00 175.26 175.84 2edr s ARG 85 N -0.14 0.90 0.00 1.61 3.52 -1.26 -3.51 118.95 120.08 2edr s ARG 85 Ca 0.11 -0.15 -0.03 0.00 -0.13 0.00 0.00 55.73 55.53 2edr s ARG 85 Cb -0.11 -1.46 -0.04 0.00 -1.56 0.00 0.00 34.95 31.77 2edr s ARG 85 CO 0.00 -0.38 0.20 -0.08 -0.81 0.00 0.00 175.30 174.23 2edr s THR 86 N 1.85 5.41 0.23 4.11 -1.32 -1.18 -4.91 115.64 119.84 2edr s THR 86 Ca 0.03 -0.13 0.12 0.00 -1.21 0.00 0.00 61.69 60.50 2edr s THR 86 Cb -0.14 -3.55 -0.05 0.00 -1.51 0.00 0.00 72.50 67.25 2edr s THR 86 CO -0.07 0.31 -0.22 -0.94 -2.21 0.00 0.00 174.62 171.49 2edr s SER 87 N -1.96 3.48 -0.24 8.08 1.04 -1.26 -0.54 113.70 122.30 2edr s SER 87 Ca 0.28 -0.95 -0.03 0.00 0.48 0.00 0.00 55.95 55.74 2edr s SER 87 Cb -0.13 -0.27 0.13 0.00 0.10 0.00 0.00 66.02 65.85 2edr s SER 87 CO 0.19 0.08 0.34 0.00 0.98 0.00 0.00 173.24 174.83 2edr s ALA 88 N -2.09 -0.88 0.01 5.32 0.00 0.10 -4.59 121.76 119.63 2edr s ALA 88 Ca 0.25 0.69 -0.30 0.00 0.00 0.00 0.00 51.96 52.60 2edr s ALA 88 Cb -0.06 -1.61 -0.08 0.00 0.00 0.00 0.00 23.12 21.36 2edr s ALA 88 CO 0.12 -1.28 1.99 0.99 0.00 0.00 0.00 175.76 177.58 2edr s THR 89 N 2.49 3.03 -0.23 0.00 2.01 -1.26 -2.83 115.64 118.85 2edr s THR 89 Ca 0.11 0.04 -0.12 0.00 0.31 0.00 0.00 61.69 62.03 2edr s THR 89 Cb -0.15 -3.02 -0.05 0.00 0.01 0.00 0.00 72.50 69.29 2edr s THR 89 CO -0.16 -0.00 0.23 -0.22 -0.69 0.00 0.00 174.62 173.77 2edr s LEU 90 N 4.84 4.13 -0.22 4.42 2.96 -1.24 -3.12 118.68 130.45 2edr s LEU 90 Ca 0.89 0.23 -0.05 0.00 -0.22 0.00 0.00 54.13 54.99 2edr s LEU 90 Cb -0.42 -2.22 -0.02 0.00 0.50 0.00 0.00 46.19 44.03 2edr s LEU 90 CO 0.41 0.03 0.00 -0.89 -1.32 0.00 0.00 176.35 174.58 2edr s THR 91 N 1.09 3.85 -0.12 3.68 2.01 -0.85 -2.65 115.64 122.65 2edr s THR 91 Ca 0.11 -0.34 -0.07 0.00 0.31 0.00 0.00 61.69 61.71 2edr s THR 91 Cb -0.14 -2.76 -0.04 0.00 0.01 0.00 0.00 72.50 69.57 2edr s THR 91 CO 0.05 0.40 0.12 -0.69 -0.69 0.00 0.00 174.62 173.82 2edr s VAL 92 N 1.32 5.38 0.50 3.82 1.01 -1.26 0.08 120.40 131.24 2edr s VAL 92 Ca 0.04 0.16 0.08 0.00 0.00 0.00 0.00 61.98 62.26 2edr s VAL 92 Cb -0.15 -3.34 0.03 0.00 0.00 0.00 0.00 36.38 32.93 2edr s VAL 92 CO 0.01 0.61 0.53 -0.54 0.00 0.00 0.00 175.10 175.71 2edr s LYS 93 N -0.96 2.43 -0.26 2.72 -0.14 0.20 -4.83 119.74 118.89 2edr s LYS 93 Ca 0.15 -1.66 -0.09 0.00 -1.36 0.00 0.00 55.97 53.00 2edr s LYS 93 Cb -0.12 -2.43 -0.04 0.00 -1.68 0.00 0.00 37.83 33.56 2edr s LYS 93 CO 0.04 -0.52 0.13 0.00 -0.76 0.00 0.00 175.35 174.24 2edr s ALA 94 N -2.60 3.35 0.44 5.17 0.00 -1.26 0.55 121.76 127.41 2edr s ALA 94 Ca 0.49 -1.10 -0.24 0.00 0.00 0.00 0.00 51.96 51.12 2edr s ALA 94 Cb -0.05 -2.27 -0.08 0.00 0.00 0.00 0.00 23.12 20.73 2edr s ALA 94 CO 0.30 -0.49 1.18 -0.48 0.00 0.00 0.00 175.76 176.26 2edr s LEU 95 N 1.64 4.09 -0.56 0.00 0.05 -1.26 -4.82 118.68 117.82 2edr s LEU 95 Ca 0.07 2.34 -0.27 0.00 0.05 0.00 0.00 54.13 56.32 2edr s LEU 95 Cb -0.15 -4.14 -0.02 0.00 -2.05 0.00 0.00 46.19 39.83 2edr s LEU 95 CO 0.07 -0.83 1.83 -2.16 -0.55 0.00 0.00 176.35 174.71 2edr s PRO 96 N -2.53 2.79 -0.48 1.48 0.04 -1.26 -4.94 135.00 130.11 2edr s PRO 96 Ca 0.61 0.76 -0.01 0.00 0.04 0.00 0.00 61.00 62.40 2edr s PRO 96 Cb -0.30 -4.34 0.13 0.00 0.04 0.00 0.00 34.50 30.03 2edr s PRO 96 CO 0.37 -2.53 0.25 0.45 0.04 0.00 0.00 177.00 175.58 2edr s SER 97 N 7.54 5.01 0.00 6.66 0.15 -1.26 -4.95 113.70 126.85 2edr s SER 97 Ca 0.69 -2.45 0.00 0.00 0.70 0.00 0.00 55.95 54.89 2edr s SER 97 Cb -0.14 -1.77 0.00 0.00 -1.71 0.00 0.00 66.02 62.40 2edr s SER 97 CO 0.23 -0.41 0.00 0.61 1.20 0.00 0.00 173.24 174.87 2edr n GLY 98 N 3.98 0.65 3.63 9.45 0.00 -1.26 -5.09 105.19 116.55 2edr n GLY 98 Ca 0.03 -1.16 -0.29 0.00 0.00 0.00 0.00 46.02 44.60 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 -3.19 -0.49 0.17 1.61 0.04 -1.26 -4.94 135.00 126.94 2edr s PRO 99 Ca 0.00 0.19 -0.23 0.00 0.04 0.00 0.00 61.00 61.00 2edr s PRO 99 Cb 0.00 -1.66 0.06 0.00 0.04 0.00 0.00 34.50 32.94 2edr s PRO 99 CO 0.00 -3.28 1.59 1.03 0.04 0.00 0.00 177.00 176.39 2edr h SER 100 N -2.27 -1.16 -3.52 6.66 0.87 -2.04 -3.35 113.55 108.74 2edr h SER 100 Ca -0.50 0.20 -0.58 0.00 -1.23 0.00 0.00 61.79 59.68 2edr h SER 100 Cb 1.31 0.54 -0.08 0.00 -0.44 0.00 0.00 62.40 63.73 2edr h SER 100 CO 0.46 -0.33 0.72 -0.55 -0.53 0.00 0.00 176.83 176.60 2edr s SER 101 N -5.08 6.71 0.00 6.23 0.15 -1.26 -5.29 113.70 115.15 2edr s SER 101 Ca -0.15 0.61 0.04 0.00 0.70 0.00 0.00 55.95 57.16 2edr s SER 101 Cb 0.13 -2.50 0.03 0.00 -1.71 0.00 0.00 66.02 61.98 2edr s SER 101 CO 0.68 -0.97 0.63 0.61 1.20 0.00 0.00 173.24 175.39