#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 2.01 -0.07 1.61 0.15 -1.26 -5.16 113.70 110.98 2edr s SER 2 Ca 0.00 -0.88 -0.31 0.00 0.70 0.00 0.00 55.95 55.46 2edr s SER 2 Cb 0.00 -0.06 0.08 0.00 -1.71 0.00 0.00 66.02 64.33 2edr s SER 2 CO 0.00 -0.19 0.75 -0.55 1.20 0.00 0.00 173.24 174.45 2edr s SER 3 N -2.73 -0.59 -0.15 5.45 0.15 -1.26 -5.15 113.70 109.42 2edr s SER 3 Ca 0.12 0.63 -0.11 0.00 0.70 0.00 0.00 55.95 57.30 2edr s SER 3 Cb -0.03 0.48 -0.05 0.00 -1.71 0.00 0.00 66.02 64.72 2edr s SER 3 CO 0.03 -0.55 0.20 -0.83 1.20 0.00 0.00 173.24 173.29 2edr s GLY 4 N -1.20 2.16 -1.26 9.45 0.00 -1.26 -4.32 107.32 110.90 2edr s GLY 4 Ca -0.09 -0.57 -0.07 0.00 0.00 0.00 0.00 44.72 43.99 2edr s GLY 4 CO 0.08 0.07 1.10 1.44 0.00 0.00 0.00 173.10 175.79 2edr n SER 5 N 2.95 -5.66 -4.65 1.64 7.64 -1.26 -5.01 113.62 109.27 2edr n SER 5 Ca -0.16 -0.52 -0.28 0.00 1.01 0.00 0.00 58.87 58.93 2edr n SER 5 Cb 0.53 -4.77 -0.10 0.00 -1.01 0.00 0.00 64.21 58.85 2edr n SER 5 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2edr s SER 6 N -3.42 3.98 0.00 6.43 0.15 -1.26 -5.09 113.70 114.49 2edr s SER 6 Ca 0.49 -1.36 0.00 0.00 0.70 0.00 0.00 55.95 55.78 2edr s SER 6 Cb -0.22 -0.32 0.00 0.00 -1.71 0.00 0.00 66.02 63.78 2edr s SER 6 CO 0.69 -0.51 0.00 0.61 1.20 0.00 0.00 173.24 175.23 2edr n GLY 7 N -1.04 0.78 3.64 9.45 0.00 -1.26 -5.03 105.19 111.73 2edr n GLY 7 Ca -0.06 -2.00 -0.29 0.00 0.00 0.00 0.00 46.02 43.67 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 -1.63 -0.35 -0.20 1.61 0.04 -1.26 -4.88 135.00 128.33 2edr s PRO 8 Ca 0.00 0.25 -0.33 0.00 0.04 0.00 0.00 61.00 60.95 2edr s PRO 8 Cb 0.00 -1.67 -0.10 0.00 0.04 0.00 0.00 34.50 32.77 2edr s PRO 8 CO 0.00 -3.20 2.05 0.00 0.04 0.00 0.00 177.00 175.90 2edr n ALA 9 N -4.45 1.14 -1.78 8.56 0.00 -1.26 -4.93 120.51 117.79 2edr n ALA 9 Ca 0.08 0.06 -0.37 0.00 0.00 0.00 0.00 53.44 53.21 2edr n ALA 9 Cb 0.58 -2.61 -0.05 0.00 0.00 0.00 0.00 19.45 17.37 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 6.04 3.50 -0.34 0.00 -3.43 -1.26 -4.50 115.29 115.30 2edr s HIS 10 Ca 1.00 1.72 -0.29 0.00 -0.80 0.00 0.00 55.06 56.69 2edr s HIS 10 Cb -0.66 -3.06 -0.00 0.00 -1.43 0.00 0.00 32.58 27.43 2edr s HIS 10 CO 0.47 -0.24 1.51 -0.06 -2.00 0.00 0.00 174.74 174.43 2edr s PHE 11 N -1.56 2.26 -0.16 0.38 0.08 -1.26 0.27 117.98 117.99 2edr s PHE 11 Ca 0.52 0.67 0.13 0.00 0.12 0.00 0.00 56.93 58.37 2edr s PHE 11 Cb -0.22 -4.15 -0.23 0.00 -0.57 0.00 0.00 43.02 37.85 2edr s PHE 11 CO 0.28 -2.33 0.21 0.44 -0.10 0.00 0.00 175.22 173.72 2edr n ILE 12 N 6.88 1.49 -3.14 0.64 -5.35 -1.23 -4.59 119.36 114.06 2edr n ILE 12 Ca 0.18 -0.79 -0.31 0.00 -0.27 0.00 0.00 62.75 61.56 2edr n ILE 12 Cb 0.47 -0.83 -0.04 0.00 -1.74 0.00 0.00 39.64 37.49 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 1.78 5.24 3.14 3.28 0.00 -1.25 -5.00 105.19 112.38 2edr n GLY 13 Ca -0.30 -2.74 -0.40 0.00 0.00 0.00 0.00 46.02 42.57 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 0.55 0.00 -0.20 1.61 5.12 -1.26 -3.10 116.66 119.38 2edr n ARG 14 Ca 0.31 0.00 -0.10 0.00 -1.93 0.00 0.00 57.85 56.13 2edr n ARG 14 Cb 0.37 -0.95 0.10 0.00 -1.16 0.00 0.00 32.46 30.82 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 2.21 0.00 -3.59 0.55 4.77 -1.26 -4.89 117.00 114.79 2edr n LEU 15 Ca 0.11 -0.30 -0.08 0.00 -0.03 0.00 0.00 56.01 55.71 2edr n LEU 15 Cb 0.37 -0.42 -0.09 0.00 -2.33 0.00 0.00 43.42 40.95 2edr n LEU 15 CO 0.52 -1.96 0.02 0.00 -1.33 0.00 0.00 177.39 174.64 2edr s ARG 16 N -3.04 0.34 -0.46 3.23 3.03 -1.26 -4.95 118.95 115.84 2edr s ARG 16 Ca 0.23 0.96 -0.41 0.00 2.03 0.00 0.00 55.73 58.53 2edr s ARG 16 Cb -0.04 0.21 -0.18 0.00 -1.03 0.00 0.00 34.95 33.91 2edr s ARG 16 CO 0.19 -0.33 1.88 -2.39 -1.13 0.00 0.00 175.30 173.52 2edr n HIS 17 N 5.39 1.19 -4.50 5.89 1.44 -1.26 -4.89 115.22 118.49 2edr n HIS 17 Ca -0.07 0.79 -0.32 0.00 -2.01 0.00 0.00 57.72 56.10 2edr n HIS 17 Cb 0.50 -2.11 -0.11 0.00 0.12 0.00 0.00 29.99 28.39 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 4.97 2.56 -0.20 -1.40 -2.07 -1.22 -4.97 119.66 117.33 2edr s GLN 18 Ca 1.08 -0.71 -0.02 0.00 -1.82 0.00 0.00 55.36 53.90 2edr s GLN 18 Cb -1.39 -2.50 0.00 0.00 -1.09 0.00 0.00 33.01 28.03 2edr s GLN 18 CO 0.64 0.61 -0.10 -2.00 -1.32 0.00 0.00 175.29 173.12 2edr s GLU 19 N -1.32 3.25 0.23 9.60 2.12 -1.26 -1.13 118.70 130.18 2edr s GLU 19 Ca 0.16 -0.70 0.01 0.00 0.36 0.00 0.00 54.97 54.80 2edr s GLU 19 Cb -0.11 -2.83 0.01 0.00 0.26 0.00 0.00 34.13 31.46 2edr s GLU 19 CO 0.06 -0.17 0.07 0.45 -0.54 0.00 0.00 175.26 175.14 2edr n SER 20 N 4.62 2.25 -4.55 -1.70 2.88 0.14 -4.97 113.62 112.29 2edr n SER 20 Ca -0.19 -1.90 -0.30 0.00 -1.33 0.00 0.00 58.87 55.15 2edr n SER 20 Cb 0.51 0.08 -0.11 0.00 -0.75 0.00 0.00 64.21 63.94 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 -1.53 3.26 0.27 2.46 -1.09 -1.26 -0.95 121.20 122.36 2edr s ILE 21 Ca 0.06 -1.19 -0.30 0.00 -2.23 0.00 0.00 60.65 56.98 2edr s ILE 21 Cb -0.00 -2.48 -0.13 0.00 -1.58 0.00 0.00 42.46 38.27 2edr s ILE 21 CO 0.04 0.20 1.38 1.21 -1.23 0.00 0.00 174.94 176.53 2edr n GLU 22 N 1.01 2.07 0.00 2.79 2.13 0.37 -1.53 120.64 127.48 2edr n GLU 22 Ca -0.14 0.73 0.00 0.00 0.66 0.00 0.00 57.16 58.41 2edr n GLU 22 Cb 0.52 -2.37 0.00 0.00 0.27 0.00 0.00 31.44 29.86 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 1.83 2.06 2.20 8.31 0.00 -0.60 -4.41 105.19 114.57 2edr n GLY 23 Ca 0.10 -0.16 -0.17 0.00 0.00 0.00 0.00 46.02 45.78 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 -3.01 -3.83 4.61 0.00 -0.58 -3.07 120.51 114.63 2edr n ALA 24 Ca 0.00 -0.88 -0.35 0.00 0.00 0.00 0.00 53.44 52.21 2edr n ALA 24 Cb 0.00 -0.08 -0.12 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 -1.71 3.08 0.42 0.00 2.01 -1.26 -1.19 115.64 116.99 2edr s THR 25 Ca 0.38 -2.18 -0.26 0.00 0.31 0.00 0.00 61.69 59.95 2edr s THR 25 Cb -0.07 -3.13 -0.09 0.00 0.01 0.00 0.00 72.50 69.22 2edr s THR 25 CO 0.32 -0.68 1.38 0.00 -0.69 0.00 0.00 174.62 174.95 2edr s ALA 26 N 1.02 3.29 -0.21 7.40 0.00 0.08 -4.76 121.76 128.58 2edr s ALA 26 Ca 0.09 1.38 -0.04 0.00 0.00 0.00 0.00 51.96 53.39 2edr s ALA 26 Cb -0.22 -3.55 0.08 0.00 0.00 0.00 0.00 23.12 19.44 2edr s ALA 26 CO -0.05 -1.02 0.16 0.99 0.00 0.00 0.00 175.76 175.85 2edr s THR 27 N -1.21 -0.21 0.47 0.00 2.01 -1.26 -0.19 115.64 115.26 2edr s THR 27 Ca 0.58 -0.24 0.00 0.00 0.31 0.00 0.00 61.69 62.35 2edr s THR 27 Cb -0.42 -0.69 0.00 0.00 0.01 0.00 0.00 72.50 71.40 2edr s THR 27 CO 0.54 -0.32 0.70 -0.76 -0.69 0.00 0.00 174.62 174.09 2edr s LEU 28 N 2.23 3.56 -0.19 4.42 1.43 -0.33 -4.91 118.68 124.88 2edr s LEU 28 Ca 0.05 0.23 -0.18 0.00 -1.03 0.00 0.00 54.13 53.21 2edr s LEU 28 Cb -0.16 -3.11 0.05 0.00 0.03 0.00 0.00 46.19 43.00 2edr s LEU 28 CO -0.15 -0.80 0.51 -0.60 0.23 0.00 0.00 176.35 175.53 2edr s ARG 29 N -4.61 0.59 0.27 1.70 3.52 -1.26 -2.33 118.95 116.84 2edr s ARG 29 Ca 0.50 0.71 -0.01 0.00 -0.13 0.00 0.00 55.73 56.80 2edr s ARG 29 Cb -0.10 0.29 -0.02 0.00 -1.56 0.00 0.00 34.95 33.55 2edr s ARG 29 CO 0.38 -0.07 0.30 0.00 -0.81 0.00 0.00 175.30 175.10 2edr s GLU 31 N -3.70 1.27 0.04 0.00 2.12 -1.18 -2.40 118.70 114.85 2edr s GLU 31 Ca 0.35 -1.45 0.01 0.00 0.36 0.00 0.00 54.97 54.24 2edr s GLU 31 Cb 0.03 -1.21 -0.03 0.00 0.26 0.00 0.00 34.13 33.18 2edr s GLU 31 CO 0.17 0.23 -0.06 -0.51 -0.54 0.00 0.00 175.26 174.55 2edr s LEU 32 N -2.88 2.28 0.62 2.70 1.43 0.80 -3.54 118.68 120.10 2edr s LEU 32 Ca 0.17 -0.59 0.28 0.00 -1.03 0.00 0.00 54.13 52.96 2edr s LEU 32 Cb -0.04 -0.07 1.48 0.00 0.03 0.00 0.00 46.19 47.59 2edr s LEU 32 CO 0.06 -0.27 1.87 -1.28 0.23 0.00 0.00 176.35 176.97 2edr h SER 33 N 4.35 0.00 -3.08 2.29 0.87 -0.41 -3.43 113.55 114.15 2edr h SER 33 Ca -0.35 0.00 0.15 0.00 -1.23 0.00 0.00 61.79 60.36 2edr h SER 33 Cb 1.20 0.00 -0.28 0.00 -0.44 0.00 0.00 62.40 62.88 2edr h SER 33 CO 0.44 0.00 0.72 -1.59 -0.53 0.00 0.00 176.83 175.87 2edr s LYS 34 N -4.43 0.29 -0.45 2.24 -2.85 -1.26 -4.93 119.74 108.35 2edr s LYS 34 Ca -0.04 0.20 -0.40 0.00 -1.00 0.00 0.00 55.97 54.73 2edr s LYS 34 Cb 0.13 0.14 -0.17 0.00 -2.06 0.00 0.00 37.83 35.86 2edr s LYS 34 CO 0.44 -0.06 1.83 0.00 0.10 0.00 0.00 175.35 177.66 2edr n ALA 35 N 1.28 -0.05 -3.23 0.59 0.00 -1.26 -4.60 120.51 113.24 2edr n ALA 35 Ca -0.08 0.22 -0.14 0.00 0.00 0.00 0.00 53.44 53.44 2edr n ALA 35 Cb 0.57 -1.83 -0.07 0.00 0.00 0.00 0.00 19.45 18.12 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 4.90 -1.03 0.30 0.00 0.00 -1.26 -4.84 121.76 119.83 2edr s ALA 36 Ca 1.05 0.44 -0.29 0.00 0.00 0.00 0.00 51.96 53.16 2edr s ALA 36 Cb -1.34 0.21 -0.10 0.00 0.00 0.00 0.00 23.12 21.90 2edr s ALA 36 CO 0.61 -0.38 1.23 -1.25 0.00 0.00 0.00 175.76 175.98 2edr s PRO 37 N -1.95 4.46 0.40 0.00 0.04 -1.26 -4.96 135.00 131.73 2edr s PRO 37 Ca -0.09 2.06 0.04 0.00 0.04 0.00 0.00 61.00 63.05 2edr s PRO 37 Cb -0.02 -3.12 -0.03 0.00 0.04 0.00 0.00 34.50 31.37 2edr s PRO 37 CO 0.01 -0.05 0.13 0.14 0.04 0.00 0.00 177.00 177.27 2edr s VAL 38 N -1.03 0.61 -0.25 -0.36 -7.23 -1.26 -4.60 120.40 106.27 2edr s VAL 38 Ca 0.48 -2.00 -0.02 0.00 -1.81 0.00 0.00 61.98 58.63 2edr s VAL 38 Cb -0.37 -2.39 0.12 0.00 0.56 0.00 0.00 36.38 34.31 2edr s VAL 38 CO 0.47 0.00 0.30 -0.70 -0.31 0.00 0.00 175.10 174.86 2edr s GLU 39 N -3.72 0.29 0.51 4.82 2.56 0.23 -4.95 118.70 118.45 2edr s GLU 39 Ca 0.25 0.12 -0.22 0.00 0.00 0.00 0.00 54.97 55.13 2edr s GLU 39 Cb 0.03 -0.77 -0.06 0.00 2.00 0.00 0.00 34.13 35.33 2edr s GLU 39 CO 0.15 -0.84 1.22 -1.58 -0.56 0.00 0.00 175.26 173.66 2edr s TRP 40 N 2.40 2.61 -0.07 5.30 0.52 -1.26 -2.00 118.94 126.43 2edr s TRP 40 Ca 0.09 1.49 -0.02 0.00 0.02 0.00 0.00 56.10 57.68 2edr s TRP 40 Cb -0.15 -3.51 0.03 0.00 -1.15 0.00 0.00 33.47 28.70 2edr s TRP 40 CO -0.23 -2.03 0.04 1.03 0.02 0.00 0.00 176.95 175.79 2edr s ARG 41 N -2.92 0.20 -0.84 4.98 0.52 0.23 -0.17 118.95 120.96 2edr s ARG 41 Ca 0.69 0.21 -0.17 0.00 -0.52 0.00 0.00 55.73 55.94 2edr s ARG 41 Cb -0.32 -0.87 0.16 0.00 0.52 0.00 0.00 34.95 34.45 2edr s ARG 41 CO 0.37 -0.37 0.91 0.21 0.02 0.00 0.00 175.30 176.45 2edr s LYS 42 N 2.09 3.52 -0.25 3.54 2.20 -1.15 -0.38 119.74 129.30 2edr s LYS 42 Ca 0.04 -1.99 -0.01 0.00 -0.36 0.00 0.00 55.97 53.66 2edr s LYS 42 Cb -0.13 -4.62 0.00 0.00 -1.51 0.00 0.00 37.83 31.58 2edr s LYS 42 CO -0.05 -1.54 0.01 0.41 -0.36 0.00 0.00 175.35 173.83 2edr n GLY 43 N 4.82 -3.62 2.91 5.54 0.00 -0.74 -3.24 105.19 110.86 2edr n GLY 43 Ca 0.15 0.46 -0.13 0.00 0.00 0.00 0.00 46.02 46.49 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 0.88 -2.64 -4.37 1.61 1.85 -1.26 -4.90 116.66 107.83 2edr n ARG 44 Ca -0.02 0.27 -0.19 0.00 -1.00 0.00 0.00 57.85 56.91 2edr n ARG 44 Cb 0.12 -4.85 -0.10 0.00 -1.05 0.00 0.00 32.46 26.58 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 -5.49 1.40 -0.18 2.89 2.12 -1.20 -5.14 118.70 113.10 2edr s GLU 45 Ca 0.18 -1.67 -0.01 0.00 0.36 0.00 0.00 54.97 53.83 2edr s GLU 45 Cb -0.10 -1.01 -0.00 0.00 0.26 0.00 0.00 34.13 33.27 2edr s GLU 45 CO 0.23 0.07 -0.11 0.45 -0.54 0.00 0.00 175.26 175.35 2edr s SER 46 N -3.35 3.86 0.11 -1.70 0.15 -1.26 -2.93 113.70 108.57 2edr s SER 46 Ca 0.26 -0.45 -0.02 0.00 0.70 0.00 0.00 55.95 56.44 2edr s SER 46 Cb 0.02 -1.62 -0.05 0.00 -1.71 0.00 0.00 66.02 62.66 2edr s SER 46 CO 0.09 0.04 0.29 -0.76 1.20 0.00 0.00 173.24 174.09 2edr s LEU 47 N 1.11 4.31 -0.03 3.45 1.02 0.77 -4.91 118.68 124.39 2edr s LEU 47 Ca 0.00 0.39 -0.20 0.00 0.02 0.00 0.00 54.13 54.35 2edr s LEU 47 Cb -0.14 -3.10 0.04 0.00 0.02 0.00 0.00 46.19 43.00 2edr s LEU 47 CO -0.03 0.10 0.43 -0.13 0.02 0.00 0.00 176.35 176.74 2edr s ARG 48 N -2.68 0.78 0.03 1.70 0.52 -1.26 -4.42 118.95 113.61 2edr s ARG 48 Ca 0.37 -0.01 -0.30 0.00 -0.52 0.00 0.00 55.73 55.27 2edr s ARG 48 Cb -0.12 0.36 -0.09 0.00 0.52 0.00 0.00 34.95 35.62 2edr s ARG 48 CO 0.27 -0.22 1.91 0.34 0.02 0.00 0.00 175.30 177.61 2edr s ASP 49 N -1.20 6.48 0.00 0.23 -1.08 -1.26 -4.79 116.67 115.05 2edr s ASP 49 Ca -0.12 2.62 0.00 0.00 -0.52 0.00 0.00 52.55 54.53 2edr s ASP 49 Cb -0.04 -2.53 0.00 0.00 -1.46 0.00 0.00 42.92 38.89 2edr s ASP 49 CO 0.06 -1.03 0.00 0.61 0.52 0.00 0.00 175.17 175.33 2edr n GLY 50 N 4.45 4.76 0.00 2.66 0.00 -0.96 -5.02 105.19 111.08 2edr n GLY 50 Ca 0.19 -0.54 0.00 0.00 0.00 0.00 0.00 46.02 45.67 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 8.00 -1.26 -4.22 116.55 120.59 2edr n ASP 51 Ca 0.00 0.54 -0.17 0.00 0.71 0.00 0.00 54.79 55.87 2edr n ASP 51 Cb 0.00 -0.16 -0.06 0.00 -0.02 0.00 0.00 41.12 40.88 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 -1.68 0.37 -1.02 -1.24 5.12 -1.26 -4.95 116.66 112.00 2edr n ARG 52 Ca 0.00 0.15 -0.24 0.00 -1.93 0.00 0.00 57.85 55.83 2edr n ARG 52 Cb 0.00 -1.14 -0.12 0.00 -1.16 0.00 0.00 32.46 30.05 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 -3.64 0.27 -3.65 -1.55 8.25 -1.25 -4.83 115.22 108.82 2edr n HIS 53 Ca -0.33 0.19 -0.37 0.00 -0.26 0.00 0.00 57.72 56.95 2edr n HIS 53 Cb 0.75 -1.26 -0.11 0.00 1.12 0.00 0.00 29.99 30.49 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 4.41 5.92 -0.84 0.41 0.01 -0.96 -2.26 113.70 120.39 2edr s SER 54 Ca 0.92 0.00 0.01 0.00 1.31 0.00 0.00 55.95 58.19 2edr s SER 54 Cb -0.78 -2.08 0.24 0.00 0.21 0.00 0.00 66.02 63.61 2edr s SER 54 CO 0.35 -0.01 0.90 0.18 0.41 0.00 0.00 173.24 175.07 2edr n LEU 55 N 4.76 4.43 -4.93 2.44 7.99 -1.26 -0.95 117.00 129.48 2edr n LEU 55 Ca -0.15 -5.26 -0.25 0.00 -0.01 0.00 0.00 56.01 50.34 2edr n LEU 55 Cb 0.52 -0.97 0.03 0.00 -0.11 0.00 0.00 43.42 42.89 2edr n LEU 55 CO 0.33 1.77 0.46 0.00 -1.51 0.00 0.00 177.39 178.44 2edr s ARG 56 N -2.04 2.84 -0.01 3.23 1.70 -1.04 -4.90 118.95 118.74 2edr s ARG 56 Ca 0.32 -0.24 -0.10 0.00 -0.47 0.00 0.00 55.73 55.24 2edr s ARG 56 Cb 0.03 -2.36 0.01 0.00 -0.57 0.00 0.00 34.95 32.06 2edr s ARG 56 CO -0.05 -0.65 0.21 -0.65 -1.08 0.00 0.00 175.30 173.09 2edr s GLN 57 N -4.88 0.55 -0.49 3.89 -0.21 -1.26 -1.04 119.66 116.22 2edr s GLN 57 Ca 0.53 -0.28 0.04 0.00 0.02 0.00 0.00 55.36 55.67 2edr s GLN 57 Cb -0.10 0.24 0.17 0.00 1.00 0.00 0.00 33.01 34.31 2edr s GLN 57 CO 0.43 -0.14 0.37 0.34 -2.12 0.00 0.00 175.29 174.17 2edr s ASP 58 N -1.28 2.51 -0.08 5.90 2.15 0.68 -4.95 116.67 121.59 2edr s ASP 58 Ca -0.14 -3.21 -0.06 0.00 0.43 0.00 0.00 52.55 49.58 2edr s ASP 58 Cb -0.06 -0.78 0.02 0.00 -0.30 0.00 0.00 42.92 41.80 2edr s ASP 58 CO 0.03 -0.16 0.12 0.61 -0.17 0.00 0.00 175.17 175.59 2edr n GLY 59 N 2.71 -2.57 2.33 2.66 0.00 -1.26 -3.40 105.19 105.67 2edr n GLY 59 Ca 0.25 0.85 -0.15 0.00 0.00 0.00 0.00 46.02 46.97 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 2.14 -0.55 -3.19 4.61 0.00 -1.26 -4.78 120.51 117.48 2edr n ALA 60 Ca -0.20 0.17 -0.13 0.00 0.00 0.00 0.00 53.44 53.27 2edr n ALA 60 Cb 0.31 -1.67 -0.15 0.00 0.00 0.00 0.00 19.45 17.94 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 -2.59 -0.00 0.08 0.00 1.01 -1.22 -0.14 120.40 117.54 2edr s VAL 61 Ca 0.00 0.07 0.08 0.00 0.00 0.00 0.00 61.98 62.13 2edr s VAL 61 Cb 0.00 -0.05 -0.03 0.00 0.00 0.00 0.00 36.38 36.30 2edr s VAL 61 CO 0.00 0.04 -0.20 0.00 0.00 0.00 0.00 175.10 174.93 2edr s GLU 63 N -1.60 -0.02 -0.30 0.00 2.02 -0.20 -1.28 118.70 117.32 2edr s GLU 63 Ca 0.06 0.42 -0.10 0.00 0.02 0.00 0.00 54.97 55.37 2edr s GLU 63 Cb -0.09 -0.36 -0.03 0.00 0.10 0.00 0.00 34.13 33.75 2edr s GLU 63 CO 0.03 -0.29 0.16 -1.17 0.02 0.00 0.00 175.26 174.02 2edr s LEU 64 N 1.97 4.03 -0.18 1.80 2.96 -0.98 -2.49 118.68 125.79 2edr s LEU 64 Ca 0.01 -0.29 -0.08 0.00 -0.22 0.00 0.00 54.13 53.55 2edr s LEU 64 Cb -0.12 -2.05 -0.04 0.00 0.50 0.00 0.00 46.19 44.48 2edr s LEU 64 CO -0.04 -0.13 0.09 -1.58 -1.32 0.00 0.00 176.35 173.37 2edr s GLN 65 N 1.68 3.96 -0.21 1.98 0.74 -0.12 -1.19 119.66 126.49 2edr s GLN 65 Ca 0.06 -0.27 -0.02 0.00 0.05 0.00 0.00 55.36 55.18 2edr s GLN 65 Cb -0.16 -3.27 0.06 0.00 1.10 0.00 0.00 33.01 30.74 2edr s GLN 65 CO 0.08 0.36 0.02 0.42 -0.55 0.00 0.00 175.29 175.62 2edr s ILE 66 N 0.15 0.76 0.60 -2.34 1.01 0.74 -2.27 121.20 119.85 2edr s ILE 66 Ca 0.07 -0.74 -0.06 0.00 0.00 0.00 0.00 60.65 59.92 2edr s ILE 66 Cb -0.12 -1.23 0.02 0.00 0.01 0.00 0.00 42.46 41.14 2edr s ILE 66 CO -0.00 -0.21 0.90 0.00 0.00 0.00 0.00 174.94 175.64 2edr n GLY 68 N -2.61 -0.37 3.35 0.00 0.00 -1.21 -4.94 105.19 99.42 2edr n GLY 68 Ca 0.05 0.11 -0.33 0.00 0.00 0.00 0.00 46.02 45.86 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 -4.21 -1.26 -3.64 0.99 4.77 -0.33 -4.69 117.00 108.62 2edr n LEU 69 Ca -0.27 0.10 -0.06 0.00 -0.03 0.00 0.00 56.01 55.76 2edr n LEU 69 Cb 0.66 -1.09 -0.07 0.00 -2.33 0.00 0.00 43.42 40.60 2edr n LEU 69 CO 0.62 -3.38 0.48 0.00 -1.33 0.00 0.00 177.39 173.78 2edr s ALA 70 N -2.32 -2.01 0.48 -1.18 0.00 -1.26 -1.56 121.76 113.90 2edr s ALA 70 Ca 0.56 2.31 0.38 0.00 0.00 0.00 0.00 51.96 55.21 2edr s ALA 70 Cb -0.17 -1.51 1.57 0.00 0.00 0.00 0.00 23.12 23.01 2edr s ALA 70 CO 0.67 -0.36 1.56 0.28 0.00 0.00 0.00 175.76 177.91 2edr n VAL 71 N 3.92 -0.17 -0.07 0.00 0.31 -1.26 0.19 118.33 121.25 2edr n VAL 71 Ca -0.19 1.70 -0.15 0.00 -0.01 0.00 0.00 64.34 65.69 2edr n VAL 71 Cb 0.58 -2.80 -0.05 0.00 -0.91 0.00 0.00 33.84 30.65 2edr n VAL 71 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2edr h ALA 72 N 1.40 0.38 -1.03 3.52 0.00 -1.96 -3.10 119.26 118.47 2edr h ALA 72 Ca 0.90 -0.50 0.27 0.00 0.00 0.00 0.00 54.91 55.59 2edr h ALA 72 Cb 3.14 -0.06 -0.07 0.00 0.00 0.00 0.00 17.79 20.80 2edr h ALA 72 CO -0.32 0.56 0.70 -0.44 0.00 0.00 0.00 179.25 179.75 2edr h ASP 73 N 0.50 0.27 -3.06 0.00 3.32 0.18 -3.42 116.42 114.20 2edr h ASP 73 Ca 0.00 0.05 -0.58 0.00 0.02 0.00 0.00 57.03 56.52 2edr h ASP 73 Cb 1.12 0.00 0.15 0.00 0.22 0.00 0.00 39.33 40.82 2edr h ASP 73 CO 0.11 0.06 -0.09 0.00 -1.72 0.00 0.00 179.24 177.61 2edr n ALA 74 N -2.58 -0.45 0.00 3.45 0.00 -1.15 -4.79 120.51 114.99 2edr n ALA 74 Ca 0.23 0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.76 2edr n ALA 74 Cb 0.95 -1.97 0.00 0.00 0.00 0.00 0.00 19.45 18.43 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 1.47 -1.21 3.15 0.00 0.00 -1.08 -5.02 105.19 102.51 2edr n GLY 75 Ca 0.11 0.63 0.04 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 0.00 0.51 0.55 1.61 2.12 -1.26 -3.19 118.70 119.04 2edr s GLU 76 Ca 0.00 0.84 -0.03 0.00 0.36 0.00 0.00 54.97 56.15 2edr s GLU 76 Cb 0.00 0.46 0.02 0.00 0.26 0.00 0.00 34.13 34.87 2edr s GLU 76 CO 0.00 -0.61 0.82 0.71 -0.54 0.00 0.00 175.26 175.63 2edr s TYR 77 N 2.87 3.13 -0.15 5.30 1.51 -1.12 -1.80 117.35 127.09 2edr s TYR 77 Ca 0.17 0.36 -0.14 0.00 -1.01 0.00 0.00 57.07 56.45 2edr s TYR 77 Cb -0.13 -2.66 0.04 0.00 -0.11 0.00 0.00 41.96 39.10 2edr s TYR 77 CO -0.20 -0.75 0.40 -1.12 -1.11 0.00 0.00 175.55 172.76 2edr s SER 78 N -4.32 -0.41 -0.30 2.29 0.01 0.49 -1.32 113.70 110.14 2edr s SER 78 Ca 0.53 0.80 -0.06 0.00 1.31 0.00 0.00 55.95 58.53 2edr s SER 78 Cb -0.10 0.81 0.02 0.00 0.21 0.00 0.00 66.02 66.95 2edr s SER 78 CO 0.41 -0.14 0.06 0.00 0.41 0.00 0.00 173.24 173.99 2edr s VAL 80 N 1.45 5.12 -0.07 0.00 1.01 -0.85 -2.36 120.40 124.70 2edr s VAL 80 Ca 0.01 0.07 -0.01 0.00 0.00 0.00 0.00 61.98 62.05 2edr s VAL 80 Cb -0.18 -3.25 -0.04 0.00 0.00 0.00 0.00 36.38 32.91 2edr s VAL 80 CO 0.01 0.55 -0.07 0.00 0.00 0.00 0.00 175.10 175.59 2edr n GLY 82 N 2.97 -1.90 0.04 0.00 0.00 -1.26 -4.75 105.19 100.29 2edr n GLY 82 Ca -0.13 0.60 -0.04 0.00 0.00 0.00 0.00 46.02 46.46 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 -2.25 2.16 -4.20 1.61 1.02 -1.26 -5.03 120.64 112.70 2edr n GLU 83 Ca 0.00 -0.01 -0.22 0.00 -0.02 0.00 0.00 57.16 56.90 2edr n GLU 83 Cb 0.00 -1.26 -0.06 0.00 -0.02 0.00 0.00 31.44 30.10 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 -2.29 2.57 -0.26 3.49 1.03 -1.26 -5.14 118.70 116.85 2edr s GLU 84 Ca -0.05 -1.27 -0.19 0.00 0.03 0.00 0.00 54.97 53.49 2edr s GLU 84 Cb 0.03 -2.34 0.07 0.00 -0.80 0.00 0.00 34.13 31.10 2edr s GLU 84 CO 0.41 0.36 0.66 0.50 -1.33 0.00 0.00 175.26 175.86 2edr s ARG 85 N -3.76 0.71 0.51 -4.83 3.52 -1.26 -3.01 118.95 110.83 2edr s ARG 85 Ca 0.33 1.05 0.06 0.00 -0.13 0.00 0.00 55.73 57.04 2edr s ARG 85 Cb -0.07 0.24 0.06 0.00 -1.56 0.00 0.00 34.95 33.62 2edr s ARG 85 CO 0.22 -0.12 0.53 -2.37 -0.81 0.00 0.00 175.30 172.75 2edr n THR 86 N 3.57 0.00 -3.75 4.11 5.66 -0.99 -4.91 114.28 117.97 2edr n THR 86 Ca -0.17 -1.89 -0.11 0.00 -3.05 0.00 0.00 64.05 58.83 2edr n THR 86 Cb 0.57 -0.28 -0.07 0.00 -1.55 0.00 0.00 70.33 69.00 2edr n THR 86 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 2edr s SER 87 N -4.09 -0.11 -0.25 1.09 1.04 -1.26 -1.92 113.70 108.21 2edr s SER 87 Ca 0.40 -0.30 -0.02 0.00 0.48 0.00 0.00 55.95 56.51 2edr s SER 87 Cb -0.03 0.38 0.13 0.00 0.10 0.00 0.00 66.02 66.60 2edr s SER 87 CO 0.26 -0.69 0.36 0.00 0.98 0.00 0.00 173.24 174.15 2edr s ALA 88 N -3.05 -0.98 -0.21 5.32 0.00 -0.43 -4.50 121.76 117.91 2edr s ALA 88 Ca -0.02 0.69 -0.28 0.00 0.00 0.00 0.00 51.96 52.35 2edr s ALA 88 Cb 0.01 -1.69 -0.06 0.00 0.00 0.00 0.00 23.12 21.38 2edr s ALA 88 CO -0.06 -1.34 2.21 2.41 0.00 0.00 0.00 175.76 178.98 2edr n THR 89 N 5.36 0.36 -3.08 0.00 -1.04 -1.26 -2.81 114.28 111.80 2edr n THR 89 Ca -0.03 -0.44 -0.39 0.00 -2.04 0.00 0.00 64.05 61.14 2edr n THR 89 Cb 0.50 -2.52 -0.05 0.00 -1.82 0.00 0.00 70.33 66.44 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 8.11 4.37 -0.14 -4.42 2.96 -1.19 -3.39 118.68 124.98 2edr s LEU 90 Ca 1.01 1.23 0.01 0.00 -0.22 0.00 0.00 54.13 56.15 2edr s LEU 90 Cb -0.36 -3.06 -0.00 0.00 0.50 0.00 0.00 46.19 43.26 2edr s LEU 90 CO 0.36 -0.03 -0.16 -0.89 -1.32 0.00 0.00 176.35 174.32 2edr s THR 91 N 0.35 2.68 -0.00 3.68 2.01 -0.28 -2.62 115.64 121.46 2edr s THR 91 Ca 0.36 -0.78 0.03 0.00 0.31 0.00 0.00 61.69 61.61 2edr s THR 91 Cb -0.18 -2.12 -0.03 0.00 0.01 0.00 0.00 72.50 70.17 2edr s THR 91 CO 0.19 0.52 -0.05 -0.69 -0.69 0.00 0.00 174.62 173.90 2edr s VAL 92 N 0.65 3.81 0.41 3.82 1.01 -1.26 0.23 120.40 129.07 2edr s VAL 92 Ca -0.08 -0.70 0.07 0.00 0.00 0.00 0.00 61.98 61.27 2edr s VAL 92 Cb -0.16 -2.66 -0.05 0.00 0.00 0.00 0.00 36.38 33.50 2edr s VAL 92 CO 0.02 0.40 0.16 -0.54 0.00 0.00 0.00 175.10 175.15 2edr s LYS 93 N -1.42 2.20 -0.21 2.72 -0.14 -0.12 -4.85 119.74 117.91 2edr s LYS 93 Ca 0.17 -1.88 -0.15 0.00 -1.36 0.00 0.00 55.97 52.76 2edr s LYS 93 Cb -0.11 -1.95 -0.04 0.00 -1.68 0.00 0.00 37.83 34.05 2edr s LYS 93 CO 0.08 -0.11 0.38 0.00 -0.76 0.00 0.00 175.35 174.94 2edr s ALA 94 N -2.61 3.56 0.37 5.17 0.00 -1.26 0.14 121.76 127.13 2edr s ALA 94 Ca 0.40 -0.59 -0.25 0.00 0.00 0.00 0.00 51.96 51.52 2edr s ALA 94 Cb 0.04 -2.63 -0.09 0.00 0.00 0.00 0.00 23.12 20.45 2edr s ALA 94 CO 0.22 -0.35 1.07 -0.48 0.00 0.00 0.00 175.76 176.23 2edr s LEU 95 N 1.41 4.23 -0.85 0.00 0.05 -1.26 -4.80 118.68 117.46 2edr s LEU 95 Ca 0.18 2.12 -0.25 0.00 0.05 0.00 0.00 54.13 56.23 2edr s LEU 95 Cb -0.15 -4.05 -0.04 0.00 -2.05 0.00 0.00 46.19 39.90 2edr s LEU 95 CO 0.08 -0.44 1.93 -2.16 -0.55 0.00 0.00 176.35 175.21 2edr s PRO 96 N -2.24 2.57 -0.26 1.48 0.04 -1.26 -4.95 135.00 130.38 2edr s PRO 96 Ca 0.55 -0.14 -0.25 0.00 0.04 0.00 0.00 61.00 61.21 2edr s PRO 96 Cb -0.25 -4.95 -0.00 0.00 0.04 0.00 0.00 34.50 29.34 2edr s PRO 96 CO 0.32 -3.26 0.84 0.45 0.04 0.00 0.00 177.00 175.38 2edr s SER 97 N 8.03 6.81 0.57 6.66 0.15 -1.26 -4.89 113.70 129.78 2edr s SER 97 Ca 0.69 0.98 0.00 0.00 0.70 0.00 0.00 55.95 58.33 2edr s SER 97 Cb -0.08 -2.44 0.00 0.00 -1.71 0.00 0.00 66.02 61.80 2edr s SER 97 CO 0.03 -0.55 0.00 0.61 1.20 0.00 0.00 173.24 174.53 2edr n GLY 98 N 3.82 -3.11 3.71 9.45 0.00 -1.26 -4.76 105.19 113.04 2edr n GLY 98 Ca 0.06 -1.07 -0.42 0.00 0.00 0.00 0.00 46.02 44.59 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 -3.89 4.31 -0.27 1.61 0.04 -1.26 -5.01 135.00 130.52 2edr s PRO 99 Ca 0.00 2.03 -0.18 0.00 0.04 0.00 0.00 61.00 62.89 2edr s PRO 99 Cb 0.00 -3.37 0.08 0.00 0.04 0.00 0.00 34.50 31.25 2edr s PRO 99 CO 0.00 -0.48 0.68 0.45 0.04 0.00 0.00 177.00 177.70 2edr s SER 100 N 1.40 -0.88 0.62 6.66 0.15 -1.26 -5.02 113.70 115.37 2edr s SER 100 Ca 0.64 1.47 0.32 0.00 0.70 0.00 0.00 55.95 59.08 2edr s SER 100 Cb -0.35 1.38 1.76 0.00 -1.71 0.00 0.00 66.02 67.10 2edr s SER 100 CO 0.29 -0.24 2.08 0.77 1.20 0.00 0.00 173.24 177.34 2edr h SER 101 N 6.48 0.00 -0.02 5.45 4.64 -2.01 -3.52 113.55 124.56 2edr h SER 101 Ca -0.30 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.02 2edr h SER 101 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 2edr h SER 101 CO 0.14 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.71