#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2di8 s SER 2 N 0.00 3.92 -0.37 1.61 0.15 -1.26 -5.08 113.70 112.67 2di8 s SER 2 Ca 0.00 -1.91 -0.05 0.00 0.70 0.00 0.00 55.95 54.69 2di8 s SER 2 Cb 0.00 -0.91 0.07 0.00 -1.71 0.00 0.00 66.02 63.48 2di8 s SER 2 CO 0.00 -0.38 0.14 -0.55 1.20 0.00 0.00 173.24 173.66 2di8 s SER 3 N 1.28 5.26 0.00 5.45 0.15 -1.26 -4.77 113.70 119.81 2di8 s SER 3 Ca 0.12 -1.52 0.00 0.00 0.70 0.00 0.00 55.95 55.25 2di8 s SER 3 Cb -0.19 -1.84 0.00 0.00 -1.71 0.00 0.00 66.02 62.27 2di8 s SER 3 CO -0.18 -0.42 0.00 0.61 1.20 0.00 0.00 173.24 174.45 2di8 n GLY 4 N 4.72 -1.68 3.08 9.45 0.00 -1.26 -5.15 105.19 114.35 2di8 n GLY 4 Ca -0.09 0.59 -0.36 0.00 0.00 0.00 0.00 46.02 46.16 2di8 n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2di8 n SER 5 N 0.00 -4.04 -4.25 1.61 2.88 -1.26 -2.67 113.62 105.88 2di8 n SER 5 Ca 0.00 0.10 -0.33 0.00 -1.33 0.00 0.00 58.87 57.31 2di8 n SER 5 Cb 0.00 -0.74 -0.08 0.00 -0.75 0.00 0.00 64.21 62.64 2di8 n SER 5 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2di8 n SER 6 N 2.33 0.16 0.00 -3.46 7.64 -1.26 -4.76 113.62 114.27 2di8 n SER 6 Ca -0.01 -1.26 0.00 0.00 1.01 0.00 0.00 58.87 58.61 2di8 n SER 6 Cb 0.64 -1.56 0.00 0.00 -1.01 0.00 0.00 64.21 62.28 2di8 n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2di8 n GLY 7 N -2.48 -1.82 3.42 0.23 0.00 -1.09 -5.11 105.19 98.33 2di8 n GLY 7 Ca -0.29 0.77 -0.21 0.00 0.00 0.00 0.00 46.02 46.29 2di8 n GLY 7 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2di8 s ILE 8 N 0.00 1.62 0.10 -0.61 -4.36 -1.26 -4.51 121.20 112.18 2di8 s ILE 8 Ca 0.00 -2.12 -0.27 0.00 -0.26 0.00 0.00 60.65 58.00 2di8 s ILE 8 Cb 0.00 -2.43 0.09 0.00 1.25 0.00 0.00 42.46 41.37 2di8 s ILE 8 CO 0.00 -0.31 1.09 -0.83 0.24 0.00 0.00 174.94 175.13 2di8 s GLY 9 N -3.43 -0.24 -0.31 6.27 0.00 -0.53 -0.69 107.32 108.38 2di8 s GLY 9 Ca 0.29 0.25 -0.00 0.00 0.00 0.00 0.00 44.72 45.26 2di8 s GLY 9 CO 0.11 0.56 0.01 0.99 0.00 0.00 0.00 173.10 174.77 2di8 s ASP 10 N -3.05 4.83 0.26 1.64 1.11 -0.83 -4.92 116.67 115.72 2di8 s ASP 10 Ca 0.15 -1.51 -0.03 0.00 0.18 0.00 0.00 52.55 51.33 2di8 s ASP 10 Cb 0.01 -1.68 0.40 0.00 1.07 0.00 0.00 42.92 42.71 2di8 s ASP 10 CO 0.01 -0.30 1.86 0.00 1.18 0.00 0.00 175.17 177.91 2di8 h ALA 11 N 7.91 1.31 -0.39 5.23 0.00 -1.87 -0.24 119.26 131.21 2di8 h ALA 11 Ca -0.17 -0.00 0.11 0.00 0.00 0.00 0.00 54.91 54.84 2di8 h ALA 11 Cb 1.05 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.58 2di8 h ALA 11 CO 0.54 0.31 0.45 0.07 0.00 0.00 0.00 179.25 180.62 2di8 h ARG 12 N 1.03 0.00 0.01 0.00 0.11 -1.90 0.35 114.38 113.98 2di8 h ARG 12 Ca 0.42 0.00 -0.25 0.00 0.10 0.00 0.00 59.98 60.25 2di8 h ARG 12 Cb 0.24 0.00 -0.03 0.00 1.11 0.00 0.00 29.97 31.29 2di8 h ARG 12 CO -0.20 0.00 -1.28 0.00 0.10 0.00 0.00 179.97 178.59 2di8 h ARG 13 N 0.00 0.03 -6.57 0.08 2.47 -1.41 -3.44 114.38 105.53 2di8 h ARG 13 Ca 0.19 -0.04 -0.57 0.00 -1.26 0.00 0.00 59.98 58.30 2di8 h ARG 13 Cb 1.08 0.02 0.07 0.00 -1.65 0.00 0.00 29.97 29.48 2di8 h ARG 13 CO -0.00 0.85 0.80 0.00 0.56 0.00 0.00 179.97 182.18 2di8 n ALA 14 N -2.45 1.67 -2.69 0.04 0.00 0.12 -4.59 120.51 112.62 2di8 n ALA 14 Ca -0.07 0.43 -0.26 0.00 0.00 0.00 0.00 53.44 53.54 2di8 n ALA 14 Cb 0.99 -2.37 -0.07 0.00 0.00 0.00 0.00 19.45 17.99 2di8 n ALA 14 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2di8 s LYS 15 N 0.56 2.48 -0.06 0.00 -0.14 0.12 -4.77 119.74 117.93 2di8 s LYS 15 Ca 0.75 -1.12 -0.02 0.00 -1.36 0.00 0.00 55.97 54.21 2di8 s LYS 15 Cb -0.63 -2.38 0.04 0.00 -1.68 0.00 0.00 37.83 33.19 2di8 s LYS 15 CO 0.40 0.44 0.12 0.14 -0.76 0.00 0.00 175.35 175.70 2di8 s VAL 16 N -1.84 -0.14 0.01 3.17 -7.23 -1.26 0.18 120.40 113.29 2di8 s VAL 16 Ca 0.29 0.29 -0.03 0.00 -1.81 0.00 0.00 61.98 60.72 2di8 s VAL 16 Cb -0.09 -0.22 -0.01 0.00 0.56 0.00 0.00 36.38 36.62 2di8 s VAL 16 CO 0.20 0.12 0.03 -0.72 -0.31 0.00 0.00 175.10 174.42 2di8 s TYR 17 N 1.73 0.16 -1.18 2.82 -0.85 -1.01 -5.02 117.35 114.00 2di8 s TYR 17 Ca -0.02 -0.35 0.00 0.00 -0.52 0.00 0.00 57.07 56.18 2di8 s TYR 17 Cb -0.12 -0.13 0.00 0.00 0.38 0.00 0.00 41.96 42.09 2di8 s TYR 17 CO -0.05 -0.21 0.00 0.41 -1.52 0.00 0.00 175.55 174.18 2di8 n GLY 18 N 1.65 -0.56 0.00 5.49 0.00 -1.26 -0.38 105.19 110.13 2di8 n GLY 18 Ca -0.23 -0.45 0.00 0.00 0.00 0.00 0.00 46.02 45.34 2di8 n GLY 18 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2di8 n ARG 19 N 0.00 2.53 -0.33 1.61 0.63 -1.22 -4.73 116.66 115.15 2di8 n ARG 19 Ca 0.00 0.00 -0.03 0.00 -0.92 0.00 0.00 57.85 56.90 2di8 n ARG 19 Cb 0.00 -0.83 0.09 0.00 0.45 0.00 0.00 32.46 32.17 2di8 n ARG 19 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2di8 n GLY 20 N 2.06 2.39 0.02 5.14 0.00 -1.21 -3.31 105.19 110.28 2di8 n GLY 20 Ca 0.00 -0.31 -0.03 0.00 0.00 0.00 0.00 46.02 45.68 2di8 n GLY 20 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2di8 n LEU 21 N 0.09 1.36 -0.03 0.99 4.77 -1.26 -4.90 117.00 118.02 2di8 n LEU 21 Ca 0.14 -0.01 -0.03 0.00 -0.03 0.00 0.00 56.01 56.08 2di8 n LEU 21 Cb 0.71 -0.03 -0.01 0.00 -2.33 0.00 0.00 43.42 41.77 2di8 n LEU 21 CO 0.15 0.32 -0.21 -1.20 -1.33 0.00 0.00 177.39 175.11 2di8 n SER 22 N -2.38 0.61 -4.45 -1.43 7.64 -1.24 -4.45 113.62 107.92 2di8 n SER 22 Ca -0.08 0.10 -0.30 0.00 1.01 0.00 0.00 58.87 59.61 2di8 n SER 22 Cb 0.62 -0.57 -0.06 0.00 -1.01 0.00 0.00 64.21 63.18 2di8 n SER 22 CO 0.00 0.00 0.00 -1.84 -3.01 0.00 0.00 175.04 170.19 2di8 n GLU 23 N -3.12 0.86 -3.32 1.43 0.28 -1.21 -3.60 120.64 111.96 2di8 n GLU 23 Ca -0.04 -3.42 0.00 0.00 -0.16 0.00 0.00 57.16 53.54 2di8 n GLU 23 Cb 0.16 0.94 0.00 0.00 1.43 0.00 0.00 31.44 33.97 2di8 n GLU 23 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2di8 n GLY 24 N -0.61 -1.56 1.75 -1.84 0.00 -1.08 -4.14 105.19 97.72 2di8 n GLY 24 Ca -0.19 -1.06 -0.08 0.00 0.00 0.00 0.00 46.02 44.70 2di8 n GLY 24 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2di8 n ARG 25 N -0.22 0.36 -3.92 1.61 1.74 -1.26 -2.41 116.66 112.56 2di8 n ARG 25 Ca 0.00 -1.47 -0.31 0.00 -0.77 0.00 0.00 57.85 55.30 2di8 n ARG 25 Cb 0.00 1.41 -0.04 0.00 -1.02 0.00 0.00 32.46 32.80 2di8 n ARG 25 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 2di8 s THR 26 N -2.63 5.37 -1.37 0.55 -4.23 -1.06 -4.38 115.64 107.89 2di8 s THR 26 Ca 0.15 -0.37 -0.04 0.00 -1.18 0.00 0.00 61.69 60.25 2di8 s THR 26 Cb -0.00 -3.60 0.00 0.00 1.34 0.00 0.00 72.50 70.24 2di8 s THR 26 CO 0.11 0.17 0.56 0.49 -0.54 0.00 0.00 174.62 175.41 2di8 n PHE 27 N 0.40 -1.78 -3.75 3.99 3.01 0.10 -4.91 117.46 114.52 2di8 n PHE 27 Ca -0.06 0.48 -0.15 0.00 1.01 0.00 0.00 57.45 58.74 2di8 n PHE 27 Cb 0.51 -4.13 -0.15 0.00 -0.01 0.00 0.00 39.48 35.70 2di8 n PHE 27 CO 0.00 0.00 0.00 -1.83 1.01 0.00 0.00 176.76 175.94 2di8 s GLU 28 N -5.59 0.02 -0.40 -1.08 -1.05 -1.26 -5.01 118.70 104.33 2di8 s GLU 28 Ca 0.28 0.29 -0.27 0.00 -0.15 0.00 0.00 54.97 55.12 2di8 s GLU 28 Cb -0.12 -0.23 -0.04 0.00 -0.44 0.00 0.00 34.13 33.30 2di8 s GLU 28 CO 0.35 -0.18 2.02 1.41 0.95 0.00 0.00 175.26 179.81 2di8 s MET 29 N 1.21 2.89 -0.44 -4.83 -2.45 -1.26 -4.24 119.30 110.18 2di8 s MET 29 Ca -0.08 1.36 -0.10 0.00 -1.25 0.00 0.00 55.69 55.62 2di8 s MET 29 Cb -0.12 -4.35 0.08 0.00 1.25 0.00 0.00 34.83 31.69 2di8 s MET 29 CO -0.04 -2.39 0.30 -1.12 1.05 0.00 0.00 175.02 172.81 2di8 s SER 30 N 8.20 5.73 0.32 1.11 0.01 -0.61 -4.94 113.70 123.53 2di8 s SER 30 Ca 0.85 -1.55 0.09 0.00 1.31 0.00 0.00 55.95 56.65 2di8 s SER 30 Cb -0.21 -2.02 -0.05 0.00 0.21 0.00 0.00 66.02 63.95 2di8 s SER 30 CO 0.29 -0.58 0.04 1.51 0.41 0.00 0.00 173.24 174.91 2di8 s ASP 31 N 2.30 4.36 0.00 2.44 -4.77 -1.26 -3.11 116.67 116.63 2di8 s ASP 31 Ca 0.04 -0.86 -0.17 0.00 -3.30 0.00 0.00 52.55 48.26 2di8 s ASP 31 Cb -0.24 -0.64 0.03 0.00 -1.09 0.00 0.00 42.92 40.98 2di8 s ASP 31 CO 0.02 -0.19 0.36 0.72 0.70 0.00 0.00 175.17 176.78 2di8 s PHE 32 N -2.45 -0.22 0.21 2.11 -0.12 -0.83 -3.34 117.98 113.34 2di8 s PHE 32 Ca 0.35 0.28 -0.10 0.00 -0.05 0.00 0.00 56.93 57.41 2di8 s PHE 32 Cb -0.02 0.14 -0.07 0.00 -0.63 0.00 0.00 43.02 42.44 2di8 s PHE 32 CO 0.20 -0.46 0.52 0.42 -0.05 0.00 0.00 175.22 175.86 2di8 s ILE 33 N -1.71 4.96 -0.31 -4.49 -1.09 0.49 -2.07 121.20 116.98 2di8 s ILE 33 Ca -0.11 0.46 0.02 0.00 -2.23 0.00 0.00 60.65 58.79 2di8 s ILE 33 Cb -0.03 -3.63 0.09 0.00 -1.58 0.00 0.00 42.46 37.31 2di8 s ILE 33 CO 0.02 -0.02 0.05 -0.69 -1.23 0.00 0.00 174.94 173.08 2di8 s VAL 34 N -1.75 1.61 -0.39 2.92 1.01 -1.00 -2.42 120.40 120.38 2di8 s VAL 34 Ca 0.45 -1.78 -0.28 0.00 0.00 0.00 0.00 61.98 60.37 2di8 s VAL 34 Cb -0.12 -2.14 0.02 0.00 0.00 0.00 0.00 36.38 34.15 2di8 s VAL 34 CO 0.21 -0.54 1.05 -0.62 0.00 0.00 0.00 175.10 175.20 2di8 s ASP 35 N 1.26 6.75 -0.10 3.32 2.15 0.13 -3.35 116.67 126.83 2di8 s ASP 35 Ca 0.08 0.69 0.19 0.00 0.43 0.00 0.00 52.55 53.94 2di8 s ASP 35 Cb -0.18 -2.52 0.43 0.00 -0.30 0.00 0.00 42.92 40.34 2di8 s ASP 35 CO -0.14 -1.01 1.19 0.35 -0.17 0.00 0.00 175.17 175.39 2di8 n THR 36 N 6.25 0.97 0.03 1.71 -2.24 -1.26 0.15 114.28 119.88 2di8 n THR 36 Ca 0.10 -2.01 -0.21 0.00 -2.27 0.00 0.00 64.05 59.67 2di8 n THR 36 Cb 0.48 0.46 -0.14 0.00 -2.10 0.00 0.00 70.33 69.03 2di8 n THR 36 CO 0.00 0.00 0.00 0.03 -0.57 0.00 0.00 175.07 174.53 2di8 h ARG 37 N 1.05 0.27 0.00 -0.78 3.08 -1.87 -3.12 114.38 113.01 2di8 h ARG 37 Ca -0.13 -0.46 -0.08 0.00 0.07 0.00 0.00 59.98 59.38 2di8 h ARG 37 Cb 1.51 0.17 -0.01 0.00 0.08 0.00 0.00 29.97 31.72 2di8 h ARG 37 CO 0.07 1.22 -0.38 -0.44 -1.07 0.00 0.00 179.97 179.37 2di8 h ASP 38 N -0.36 0.00 -0.07 7.04 3.32 -1.88 -3.19 116.42 121.29 2di8 h ASP 38 Ca -0.22 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 56.80 2di8 h ASP 38 Cb 1.69 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 41.24 2di8 h ASP 38 CO 0.11 0.38 -0.09 0.00 -1.72 0.00 0.00 179.24 177.91 2di8 h ALA 39 N 1.62 0.10 0.00 3.45 0.00 -1.79 -3.46 119.26 119.19 2di8 h ALA 39 Ca -0.00 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.60 2di8 h ALA 39 Cb 0.89 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.66 2di8 h ALA 39 CO 0.05 -0.06 0.00 0.41 0.00 0.00 0.00 179.25 179.65 2di8 n GLY 40 N 0.31 1.20 3.43 0.00 0.00 -1.18 -1.96 105.19 107.00 2di8 n GLY 40 Ca -0.08 -1.06 -0.21 0.00 0.00 0.00 0.00 46.02 44.68 2di8 n GLY 40 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2di8 s TYR 41 N 0.00 1.95 0.00 1.61 5.04 0.13 -4.80 117.35 121.28 2di8 s TYR 41 Ca 0.00 -0.76 0.00 0.00 -2.44 0.00 0.00 57.07 53.87 2di8 s TYR 41 Cb 0.00 -1.16 0.00 0.00 0.35 0.00 0.00 41.96 41.15 2di8 s TYR 41 CO 0.00 0.21 0.00 0.41 -1.34 0.00 0.00 175.55 174.83 2di8 n GLY 42 N -0.61 4.12 3.65 8.97 0.00 -1.26 -1.45 105.19 118.61 2di8 n GLY 42 Ca -0.05 -0.92 -0.43 0.00 0.00 0.00 0.00 46.02 44.63 2di8 n GLY 42 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2di8 s GLY 43 N 0.00 1.60 -0.14 -0.02 0.00 -1.26 -4.49 107.32 103.01 2di8 s GLY 43 Ca 0.00 0.31 -0.20 0.00 0.00 0.00 0.00 44.72 44.82 2di8 s GLY 43 CO 0.00 2.44 0.59 -0.42 0.00 0.00 0.00 173.10 175.71 2di8 s ILE 44 N 3.61 5.09 -0.29 0.90 1.01 -1.26 -1.88 121.20 128.38 2di8 s ILE 44 Ca 0.52 1.15 -0.02 0.00 0.00 0.00 0.00 60.65 62.31 2di8 s ILE 44 Cb -0.19 -3.92 0.05 0.00 0.01 0.00 0.00 42.46 38.41 2di8 s ILE 44 CO 0.14 0.23 -0.02 -0.44 0.00 0.00 0.00 174.94 174.85 2di8 s SER 45 N 0.90 4.77 -0.19 3.58 0.01 -0.91 -4.97 113.70 116.89 2di8 s SER 45 Ca 0.30 -1.21 -0.05 0.00 1.31 0.00 0.00 55.95 56.30 2di8 s SER 45 Cb -0.16 -1.70 -0.03 0.00 0.21 0.00 0.00 66.02 64.35 2di8 s SER 45 CO 0.12 -0.23 0.00 -0.76 0.41 0.00 0.00 173.24 172.78 2di8 s LEU 46 N 1.26 3.34 -0.18 2.44 1.43 -1.26 -2.44 118.68 123.27 2di8 s LEU 46 Ca -0.05 -0.15 -0.04 0.00 -1.03 0.00 0.00 54.13 52.86 2di8 s LEU 46 Cb -0.19 -1.84 0.09 0.00 0.03 0.00 0.00 46.19 44.28 2di8 s LEU 46 CO -0.02 0.10 0.28 0.00 0.23 0.00 0.00 176.35 176.94 2di8 s ALA 47 N 0.81 -0.59 -0.35 4.21 0.00 -1.11 -5.00 121.76 119.73 2di8 s ALA 47 Ca 0.01 0.74 -0.13 0.00 0.00 0.00 0.00 51.96 52.57 2di8 s ALA 47 Cb -0.14 -1.25 -0.01 0.00 0.00 0.00 0.00 23.12 21.72 2di8 s ALA 47 CO 0.02 -0.95 0.25 0.08 0.00 0.00 0.00 175.76 175.16 2di8 s VAL 48 N 2.42 5.26 -0.33 0.00 1.01 -1.26 -1.14 120.40 126.36 2di8 s VAL 48 Ca 0.05 -0.31 -0.05 0.00 0.00 0.00 0.00 61.98 61.67 2di8 s VAL 48 Cb -0.14 -3.75 0.05 0.00 0.00 0.00 0.00 36.38 32.54 2di8 s VAL 48 CO -0.11 -0.07 0.09 -1.61 0.00 0.00 0.00 175.10 173.40 2di8 s GLU 49 N 1.71 2.54 0.00 2.72 2.02 -0.20 -4.86 118.70 122.64 2di8 s GLU 49 Ca 0.06 -1.24 0.00 0.00 0.02 0.00 0.00 54.97 53.80 2di8 s GLU 49 Cb -0.18 -3.40 0.00 0.00 0.10 0.00 0.00 34.13 30.65 2di8 s GLU 49 CO 0.10 -0.68 0.00 0.41 0.02 0.00 0.00 175.26 175.11 2di8 n GLY 50 N 4.75 4.53 0.21 -1.39 0.00 -1.26 -0.24 105.19 111.80 2di8 n GLY 50 Ca -0.12 -1.76 0.15 0.00 0.00 0.00 0.00 46.02 44.28 2di8 n GLY 50 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2di8 h PRO 51 N 0.00 0.00 -4.48 1.61 0.13 -1.87 -3.45 132.00 123.94 2di8 h PRO 51 Ca 0.00 0.00 -0.27 0.00 -0.87 0.00 0.00 66.00 64.86 2di8 h PRO 51 Cb 0.00 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 31.00 2di8 h PRO 51 CO 0.00 0.00 -0.48 -1.54 -0.23 0.00 0.00 178.00 175.75 2di8 s SER 52 N -4.96 0.53 -0.17 1.44 1.04 -1.26 -5.03 113.70 105.29 2di8 s SER 52 Ca 0.02 -1.42 -0.25 0.00 0.48 0.00 0.00 55.95 54.79 2di8 s SER 52 Cb 0.09 0.48 -0.02 0.00 0.10 0.00 0.00 66.02 66.67 2di8 s SER 52 CO 0.46 -0.98 0.80 -0.75 0.98 0.00 0.00 173.24 173.76 2di8 s LYS 53 N -3.87 4.30 -0.20 4.02 2.20 -1.26 -4.99 119.74 119.93 2di8 s LYS 53 Ca 0.36 0.96 0.01 0.00 -0.36 0.00 0.00 55.97 56.95 2di8 s LYS 53 Cb 0.04 -3.57 0.03 0.00 -1.51 0.00 0.00 37.83 32.83 2di8 s LYS 53 CO 0.16 -0.29 -0.16 0.14 -0.36 0.00 0.00 175.35 174.84 2di8 s VAL 54 N 2.04 1.99 0.38 4.02 -7.23 -1.26 -4.80 120.40 115.54 2di8 s VAL 54 Ca 0.37 -1.13 -0.27 0.00 -1.81 0.00 0.00 61.98 59.15 2di8 s VAL 54 Cb -0.17 -1.93 -0.11 0.00 0.56 0.00 0.00 36.38 34.74 2di8 s VAL 54 CO 0.13 0.32 1.27 0.47 -0.31 0.00 0.00 175.10 176.97 2di8 n ASP 55 N 4.59 2.59 -4.04 4.85 8.00 -1.26 -4.85 116.55 126.42 2di8 n ASP 55 Ca -0.18 1.15 -0.31 0.00 0.71 0.00 0.00 54.79 56.16 2di8 n ASP 55 Cb 0.47 -1.49 -0.16 0.00 -0.02 0.00 0.00 41.12 39.93 2di8 n ASP 55 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2di8 s ILE 56 N -1.15 1.80 -0.19 0.53 1.01 -1.26 -3.88 121.20 118.06 2di8 s ILE 56 Ca 0.58 -1.05 -0.03 0.00 0.00 0.00 0.00 60.65 60.16 2di8 s ILE 56 Cb -0.54 -1.81 -0.01 0.00 0.01 0.00 0.00 42.46 40.11 2di8 s ILE 56 CO 0.60 0.25 -0.07 -1.10 0.00 0.00 0.00 174.94 174.62 2di8 s GLN 57 N 1.34 3.39 0.28 2.79 -0.21 -0.41 -4.95 119.66 121.88 2di8 s GLN 57 Ca -0.00 -0.64 0.09 0.00 0.02 0.00 0.00 55.36 54.83 2di8 s GLN 57 Cb -0.16 -2.88 -0.04 0.00 1.00 0.00 0.00 33.01 30.93 2di8 s GLN 57 CO -0.09 -0.05 0.02 0.95 -2.12 0.00 0.00 175.29 174.00 2di8 s THR 58 N 1.06 3.41 0.16 -0.19 -4.23 -1.26 -2.04 115.64 112.55 2di8 s THR 58 Ca 0.00 -1.88 -0.18 0.00 -1.18 0.00 0.00 61.69 58.46 2di8 s THR 58 Cb -0.15 -2.88 0.04 0.00 1.34 0.00 0.00 72.50 70.86 2di8 s THR 58 CO -0.01 -0.35 0.49 -0.70 -0.54 0.00 0.00 174.62 173.51 2di8 s GLU 59 N -3.70 1.22 -0.29 3.99 2.56 -1.25 -5.02 118.70 116.21 2di8 s GLU 59 Ca 0.32 -0.70 -0.06 0.00 0.00 0.00 0.00 54.97 54.52 2di8 s GLU 59 Cb -0.06 0.51 0.01 0.00 2.00 0.00 0.00 34.13 36.60 2di8 s GLU 59 CO 0.20 -0.51 0.07 0.34 -0.56 0.00 0.00 175.26 174.81 2di8 s ASP 60 N -2.81 5.08 0.82 -1.70 2.15 -1.26 -3.73 116.67 115.22 2di8 s ASP 60 Ca 0.05 -0.74 -0.06 0.00 0.43 0.00 0.00 52.55 52.22 2di8 s ASP 60 Cb 0.00 -1.87 0.15 0.00 -0.30 0.00 0.00 42.92 40.90 2di8 s ASP 60 CO -0.09 -0.19 0.93 0.18 -0.17 0.00 0.00 175.17 175.82 2di8 n LEU 61 N 4.85 0.00 0.05 -1.34 4.77 -1.16 -5.01 117.00 119.15 2di8 n LEU 61 Ca -0.15 -1.46 -0.09 0.00 -0.03 0.00 0.00 56.01 54.29 2di8 n LEU 61 Cb 0.48 -0.66 -0.13 0.00 -2.33 0.00 0.00 43.42 40.78 2di8 n LEU 61 CO 0.31 -1.06 -0.06 1.05 -1.33 0.00 0.00 177.39 176.30 2di8 h GLU 62 N 0.00 0.05 0.00 3.23 -0.00 -1.99 -3.26 114.58 112.61 2di8 h GLU 62 Ca -0.30 -0.08 -0.01 0.00 -0.00 0.00 0.00 59.36 58.96 2di8 h GLU 62 Cb 0.97 0.03 -0.00 0.00 -0.00 0.00 0.00 28.75 29.75 2di8 h GLU 62 CO 0.27 0.92 -0.07 0.38 -0.00 0.00 0.00 179.01 180.51 2di8 h ASP 63 N 0.01 0.00 0.00 3.06 3.04 -2.04 -3.46 116.42 117.04 2di8 h ASP 63 Ca -0.10 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.69 2di8 h ASP 63 Cb 1.86 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 40.15 2di8 h ASP 63 CO 0.13 0.07 0.00 0.61 -2.04 0.00 0.00 179.24 178.01 2di8 n GLY 64 N -0.58 1.14 3.81 7.15 0.00 -1.23 -4.97 105.19 110.51 2di8 n GLY 64 Ca -0.01 -0.07 -0.26 0.00 0.00 0.00 0.00 46.02 45.68 2di8 n GLY 64 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2di8 s THR 65 N -2.00 1.89 -0.15 2.61 -4.23 -1.26 -4.66 115.64 107.83 2di8 s THR 65 Ca 0.00 -1.65 0.01 0.00 -1.18 0.00 0.00 61.69 58.87 2di8 s THR 65 Cb 0.00 -2.53 0.02 0.00 1.34 0.00 0.00 72.50 71.33 2di8 s THR 65 CO 0.00 0.00 -0.17 0.00 -0.54 0.00 0.00 174.62 173.91 2di8 s LYS 67 N 1.25 2.99 0.25 0.00 2.20 -1.24 -2.37 119.74 122.81 2di8 s LYS 67 Ca 0.02 -1.05 -0.20 0.00 -0.36 0.00 0.00 55.97 54.38 2di8 s LYS 67 Cb -0.14 -4.01 -0.09 0.00 -1.51 0.00 0.00 37.83 32.09 2di8 s LYS 67 CO -0.09 -0.83 0.75 0.08 -0.36 0.00 0.00 175.35 174.90 2di8 s VAL 68 N 1.75 4.55 -0.03 4.02 1.01 -0.88 -3.91 120.40 126.90 2di8 s VAL 68 Ca 0.06 1.29 -0.01 0.00 0.00 0.00 0.00 61.98 63.32 2di8 s VAL 68 Cb -0.20 -3.83 0.02 0.00 0.00 0.00 0.00 36.38 32.37 2di8 s VAL 68 CO 0.10 0.14 0.06 -0.44 0.00 0.00 0.00 175.10 174.96 2di8 s SER 69 N -1.74 -0.01 0.01 3.32 0.01 -0.87 -1.96 113.70 112.47 2di8 s SER 69 Ca 0.45 0.11 -0.10 0.00 1.31 0.00 0.00 55.95 57.73 2di8 s SER 69 Cb -0.16 0.04 0.01 0.00 0.21 0.00 0.00 66.02 66.12 2di8 s SER 69 CO 0.21 -0.10 0.20 -0.72 0.41 0.00 0.00 173.24 173.24 2di8 s TYR 70 N 0.77 -0.01 -0.33 2.43 -0.85 -1.18 -1.28 117.35 116.89 2di8 s TYR 70 Ca -0.06 -0.08 0.04 0.00 -0.52 0.00 0.00 57.07 56.44 2di8 s TYR 70 Cb -0.09 -0.01 0.10 0.00 0.38 0.00 0.00 41.96 42.35 2di8 s TYR 70 CO -0.03 -0.36 0.04 0.12 -1.52 0.00 0.00 175.55 173.80 2di8 s PHE 71 N -1.78 3.71 0.40 -3.49 5.36 -1.25 -1.57 117.98 119.35 2di8 s PHE 71 Ca -0.11 -2.94 -0.25 0.00 -0.96 0.00 0.00 56.93 52.66 2di8 s PHE 71 Cb -0.05 -2.84 -0.08 0.00 -0.34 0.00 0.00 43.02 39.71 2di8 s PHE 71 CO 0.00 -0.94 1.19 -1.25 -1.46 0.00 0.00 175.22 172.76 2di8 s PRO 72 N 0.92 4.05 0.00 10.12 0.04 -1.26 -4.57 135.00 144.30 2di8 s PRO 72 Ca 0.09 1.89 0.00 0.00 0.04 0.00 0.00 61.00 63.03 2di8 s PRO 72 Cb -0.19 -2.70 0.00 0.00 0.04 0.00 0.00 34.50 31.65 2di8 s PRO 72 CO -0.08 -0.34 0.00 0.25 0.04 0.00 0.00 177.00 176.87 2di8 n THR 73 N 0.10 0.00 -4.80 1.26 -2.24 -1.26 0.01 114.28 107.35 2di8 n THR 73 Ca 0.04 0.00 -0.31 0.00 -2.27 0.00 0.00 64.05 61.51 2di8 n THR 73 Cb 0.46 -0.54 -0.17 0.00 -2.10 0.00 0.00 70.33 67.98 2di8 n THR 73 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2di8 s VAL 74 N -1.99 1.87 0.26 2.28 1.01 -1.26 -4.78 120.40 117.79 2di8 s VAL 74 Ca 0.00 -0.88 -0.29 0.00 0.00 0.00 0.00 61.98 60.80 2di8 s VAL 74 Cb 0.00 -1.65 -0.09 0.00 0.00 0.00 0.00 36.38 34.64 2di8 s VAL 74 CO 0.00 0.51 1.26 -2.16 0.00 0.00 0.00 175.10 174.71 2di8 s PRO 75 N 0.69 4.43 0.00 2.72 0.04 -1.26 -4.75 135.00 136.87 2di8 s PRO 75 Ca -0.11 2.05 0.00 0.00 0.04 0.00 0.00 61.00 62.98 2di8 s PRO 75 Cb -0.16 -3.15 0.00 0.00 0.04 0.00 0.00 34.50 31.22 2di8 s PRO 75 CO 0.02 -0.13 0.00 0.41 0.04 0.00 0.00 177.00 177.34 2di8 n GLY 76 N 1.58 -0.70 3.14 0.56 0.00 -1.05 -4.93 105.19 103.80 2di8 n GLY 76 Ca 0.02 -0.39 -0.35 0.00 0.00 0.00 0.00 46.02 45.31 2di8 n GLY 76 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2di8 s VAL 77 N -4.00 2.93 -0.13 1.61 1.01 -1.26 -2.11 120.40 118.45 2di8 s VAL 77 Ca 0.00 -1.60 -0.15 0.00 0.00 0.00 0.00 61.98 60.23 2di8 s VAL 77 Cb 0.00 -2.78 -0.05 0.00 0.00 0.00 0.00 36.38 33.55 2di8 s VAL 77 CO 0.00 -0.24 0.37 -0.31 0.00 0.00 0.00 175.10 174.91 2di8 s TYR 78 N 1.20 3.50 -0.42 5.22 1.51 -1.01 -4.48 117.35 122.88 2di8 s TYR 78 Ca -0.02 0.73 -0.14 0.00 -1.01 0.00 0.00 57.07 56.63 2di8 s TYR 78 Cb -0.20 -2.41 0.04 0.00 -0.11 0.00 0.00 41.96 39.28 2di8 s TYR 78 CO -0.02 0.25 0.30 0.42 -1.11 0.00 0.00 175.55 175.39 2di8 s ILE 79 N 0.38 5.08 -0.55 2.71 -1.09 0.67 -1.71 121.20 126.69 2di8 s ILE 79 Ca 0.20 -0.82 -0.20 0.00 -2.23 0.00 0.00 60.65 57.61 2di8 s ILE 79 Cb -0.14 -3.89 0.07 0.00 -1.58 0.00 0.00 42.46 36.92 2di8 s ILE 79 CO 0.07 -0.37 0.70 -0.69 -1.23 0.00 0.00 174.94 173.42 2di8 s VAL 80 N 1.64 4.78 -0.61 2.92 1.01 -0.43 -1.03 120.40 128.68 2di8 s VAL 80 Ca 0.04 -0.58 -0.25 0.00 0.00 0.00 0.00 61.98 61.19 2di8 s VAL 80 Cb -0.20 -4.40 0.04 0.00 0.00 0.00 0.00 36.38 31.82 2di8 s VAL 80 CO 0.08 -0.98 1.05 -0.44 0.00 0.00 0.00 175.10 174.81 2di8 s SER 81 N 3.07 6.28 -0.38 3.32 0.01 -0.29 -2.14 113.70 123.57 2di8 s SER 81 Ca 0.16 -0.45 -0.09 0.00 1.31 0.00 0.00 55.95 56.87 2di8 s SER 81 Cb -0.20 -2.47 0.05 0.00 0.21 0.00 0.00 66.02 63.60 2di8 s SER 81 CO 0.11 -1.43 0.20 -0.89 0.41 0.00 0.00 173.24 171.63 2di8 s THR 82 N 4.45 4.25 0.15 1.44 2.01 -1.26 -2.74 115.64 123.94 2di8 s THR 82 Ca 0.31 -1.11 0.10 0.00 0.31 0.00 0.00 61.69 61.30 2di8 s THR 82 Cb -0.12 -3.46 -0.04 0.00 0.01 0.00 0.00 72.50 68.89 2di8 s THR 82 CO 0.17 -0.31 -0.19 -0.54 -0.69 0.00 0.00 174.62 173.06 2di8 s LYS 83 N 1.47 1.73 -0.24 4.92 1.02 -1.02 -1.66 119.74 125.96 2di8 s LYS 83 Ca 0.01 -1.29 -0.03 0.00 0.02 0.00 0.00 55.97 54.69 2di8 s LYS 83 Cb -0.20 -2.04 0.11 0.00 -0.52 0.00 0.00 37.83 35.18 2di8 s LYS 83 CO 0.04 0.45 0.26 0.12 -0.92 0.00 0.00 175.35 175.30 2di8 s PHE 84 N -1.34 -0.35 -0.72 3.18 5.36 -0.02 -2.13 117.98 121.94 2di8 s PHE 84 Ca 0.19 0.05 -0.00 0.00 -0.96 0.00 0.00 56.93 56.21 2di8 s PHE 84 Cb -0.10 -0.40 0.00 0.00 -0.34 0.00 0.00 43.02 42.18 2di8 s PHE 84 CO 0.10 -0.75 0.61 0.00 -1.46 0.00 0.00 175.22 173.72 2di8 n ALA 85 N 5.32 -1.18 -3.63 11.12 0.00 -0.79 -3.25 120.51 128.10 2di8 n ALA 85 Ca -0.04 -0.01 -0.24 0.00 0.00 0.00 0.00 53.44 53.15 2di8 n ALA 85 Cb 0.48 -1.79 0.07 0.00 0.00 0.00 0.00 19.45 18.21 2di8 n ALA 85 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2di8 n ASP 86 N -2.19 -5.21 -3.49 0.00 8.00 -1.26 -4.93 116.55 107.46 2di8 n ASP 86 Ca -0.16 -0.61 -0.02 0.00 0.71 0.00 0.00 54.79 54.71 2di8 n ASP 86 Cb 0.60 -4.81 -0.05 0.00 -0.02 0.00 0.00 41.12 36.84 2di8 n ASP 86 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 2di8 s GLU 87 N -6.21 0.50 0.19 -1.24 2.02 -1.20 -5.12 118.70 107.64 2di8 s GLU 87 Ca 0.48 1.17 -0.31 0.00 0.02 0.00 0.00 54.97 56.34 2di8 s GLU 87 Cb -0.22 0.56 -0.09 0.00 0.10 0.00 0.00 34.13 34.48 2di8 s GLU 87 CO 0.75 -0.36 1.45 -1.01 0.02 0.00 0.00 175.26 176.11 2di8 s HIS 88 N 2.80 3.11 0.80 1.61 3.76 -1.26 -0.84 115.29 125.27 2di8 s HIS 88 Ca 0.04 0.92 -0.16 0.00 -0.15 0.00 0.00 55.06 55.70 2di8 s HIS 88 Cb -0.13 -3.79 -0.09 0.00 1.11 0.00 0.00 32.58 29.68 2di8 s HIS 88 CO -0.18 -2.72 -0.07 1.33 -0.85 0.00 0.00 174.74 172.25 2di8 n VAL 89 N 3.18 0.53 -2.06 -0.90 0.24 -0.66 -4.73 118.33 113.94 2di8 n VAL 89 Ca 0.10 -0.42 -0.27 0.00 -2.04 0.00 0.00 64.34 61.70 2di8 n VAL 89 Cb 0.40 -0.32 -0.06 0.00 -1.47 0.00 0.00 33.84 32.40 2di8 n VAL 89 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 2di8 s PRO 90 N -2.27 2.52 0.00 7.34 0.04 -1.26 -2.09 135.00 139.28 2di8 s PRO 90 Ca 0.54 -0.73 0.00 0.00 0.04 0.00 0.00 61.00 60.85 2di8 s PRO 90 Cb -0.30 -5.15 0.00 0.00 0.04 0.00 0.00 34.50 29.08 2di8 s PRO 90 CO 0.69 -3.69 0.00 0.41 0.04 0.00 0.00 177.00 174.45 2di8 n GLY 91 N 6.32 -0.84 3.88 0.56 0.00 -1.26 -5.11 105.19 108.74 2di8 n GLY 91 Ca 0.43 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.15 2di8 n GLY 91 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2di8 s SER 92 N -0.00 5.95 1.11 1.61 0.01 -0.89 -4.54 113.70 116.95 2di8 s SER 92 Ca 0.00 1.20 -0.16 0.00 1.31 0.00 0.00 55.95 58.30 2di8 s SER 92 Cb 0.00 -2.21 0.24 0.00 0.21 0.00 0.00 66.02 64.26 2di8 s SER 92 CO 0.00 -0.98 1.10 -2.16 0.41 0.00 0.00 173.24 171.61 2di8 s PRO 93 N -5.16 -0.48 -0.39 12.44 0.04 -1.26 -4.99 135.00 135.20 2di8 s PRO 93 Ca 0.55 0.20 -0.10 0.00 0.04 0.00 0.00 61.00 61.69 2di8 s PRO 93 Cb -0.11 -1.66 0.05 0.00 0.04 0.00 0.00 34.50 32.83 2di8 s PRO 93 CO 0.51 -3.27 0.22 -0.06 0.04 0.00 0.00 177.00 174.45 2di8 s PHE 94 N -2.99 3.29 -0.49 0.56 0.40 -0.91 -4.97 117.98 112.87 2di8 s PHE 94 Ca 0.68 -1.30 -0.24 0.00 -0.60 0.00 0.00 56.93 55.48 2di8 s PHE 94 Cb -0.14 -2.68 0.03 0.00 0.51 0.00 0.00 43.02 40.74 2di8 s PHE 94 CO 0.57 -0.76 0.86 0.99 0.70 0.00 0.00 175.22 177.58 2di8 s THR 95 N 1.47 4.53 -0.29 0.64 2.01 -1.26 -1.31 115.64 121.43 2di8 s THR 95 Ca 0.02 0.39 -0.11 0.00 0.31 0.00 0.00 61.69 62.30 2di8 s THR 95 Cb -0.21 -4.43 -0.04 0.00 0.01 0.00 0.00 72.50 67.84 2di8 s THR 95 CO 0.04 -0.89 0.18 -0.69 -0.69 0.00 0.00 174.62 172.56 2di8 s VAL 96 N 3.60 5.07 -0.50 3.82 1.01 -0.70 -4.80 120.40 127.90 2di8 s VAL 96 Ca 0.31 -0.02 -0.24 0.00 0.00 0.00 0.00 61.98 62.02 2di8 s VAL 96 Cb -0.12 -3.46 0.03 0.00 0.00 0.00 0.00 36.38 32.83 2di8 s VAL 96 CO 0.22 0.19 0.90 -0.54 0.00 0.00 0.00 175.10 175.87 2di8 s LYS 97 N 1.71 3.41 -0.28 2.72 1.02 -1.24 -2.39 119.74 124.70 2di8 s LYS 97 Ca 0.06 -0.11 -0.13 0.00 0.02 0.00 0.00 55.97 55.82 2di8 s LYS 97 Cb -0.16 -3.99 -0.04 0.00 -0.52 0.00 0.00 37.83 33.11 2di8 s LYS 97 CO 0.09 -1.32 0.26 0.42 -0.92 0.00 0.00 175.35 173.89 2di8 s ILE 98 N 3.71 5.26 -0.11 2.17 -1.09 -0.90 -2.63 121.20 127.62 2di8 s ILE 98 Ca 0.32 0.30 -0.19 0.00 -2.23 0.00 0.00 60.65 58.85 2di8 s ILE 98 Cb -0.12 -3.60 -0.04 0.00 -1.58 0.00 0.00 42.46 37.12 2di8 s ILE 98 CO 0.22 0.20 0.52 -0.44 -1.23 0.00 0.00 174.94 174.22 2di8 s SER 99 N 1.72 6.75 -1.32 3.58 0.01 -1.01 -2.53 113.70 120.89 2di8 s SER 99 Ca 0.10 0.89 -0.08 0.00 1.31 0.00 0.00 55.95 58.17 2di8 s SER 99 Cb -0.16 -2.31 0.13 0.00 0.21 0.00 0.00 66.02 63.89 2di8 s SER 99 CO 0.11 -0.02 2.14 0.61 0.41 0.00 0.00 173.24 176.48 2di8 n GLY 100 N 3.23 4.89 3.12 3.44 0.00 -1.26 -2.56 105.19 116.04 2di8 n GLY 100 Ca -0.06 -2.02 -0.22 0.00 0.00 0.00 0.00 46.02 43.72 2di8 n GLY 100 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2di8 s GLU 101 N 0.07 1.09 0.00 1.61 2.02 -1.26 -5.02 118.70 117.21 2di8 s GLU 101 Ca 0.47 -0.57 0.00 0.00 0.02 0.00 0.00 54.97 54.89 2di8 s GLU 101 Cb 0.13 -1.07 0.00 0.00 0.10 0.00 0.00 34.13 33.30 2di8 s GLU 101 CO -0.04 0.29 0.00 0.41 0.02 0.00 0.00 175.26 175.94 2di8 n GLY 102 N 2.53 -2.86 3.37 -1.39 0.00 -1.26 -4.74 105.19 100.84 2di8 n GLY 102 Ca -0.15 -0.44 -0.19 0.00 0.00 0.00 0.00 46.02 45.24 2di8 n GLY 102 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2di8 s ARG 103 N 0.00 1.40 0.59 1.61 3.52 -1.26 -5.05 118.95 119.76 2di8 s ARG 103 Ca 0.00 -1.65 -0.18 0.00 -0.13 0.00 0.00 55.73 53.77 2di8 s ARG 103 Cb 0.00 -1.11 -0.11 0.00 -1.56 0.00 0.00 34.95 32.16 2di8 s ARG 103 CO 0.00 0.13 0.12 1.33 -0.81 0.00 0.00 175.30 176.07 2di8 n VAL 104 N -0.44 0.95 -1.50 7.11 0.24 -1.26 -4.75 118.33 118.68 2di8 n VAL 104 Ca -0.07 -0.49 -0.48 0.00 -2.04 0.00 0.00 64.34 61.26 2di8 n VAL 104 Cb 0.61 -0.31 -0.03 0.00 -1.47 0.00 0.00 33.84 32.64 2di8 n VAL 104 CO 0.00 0.00 0.00 2.29 -2.14 0.00 0.00 176.83 176.98 2di8 n LYS 105 N 0.79 0.59 -4.17 7.34 -0.00 -1.26 -4.97 118.16 116.48 2di8 n LYS 105 Ca 0.09 0.21 -0.24 0.00 -0.00 0.00 0.00 58.31 58.37 2di8 n LYS 105 Cb 0.48 -1.46 -0.07 0.00 -0.00 0.00 0.00 35.03 33.98 2di8 n LYS 105 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.40 175.86 2di8 s SER 106 N -0.57 4.48 -0.48 -5.58 1.04 -1.26 -5.11 113.70 106.22 2di8 s SER 106 Ca 0.67 -0.91 0.07 0.00 0.48 0.00 0.00 55.95 56.27 2di8 s SER 106 Cb -0.89 -0.61 0.19 0.00 0.10 0.00 0.00 66.02 64.80 2di8 s SER 106 CO 0.56 -0.34 0.69 -0.83 0.98 0.00 0.00 173.24 174.30 2di8 s GLY 107 N -3.83 -1.26 -0.02 7.32 0.00 -1.26 -5.03 107.32 103.24 2di8 s GLY 107 Ca 0.38 -0.16 -0.25 0.00 0.00 0.00 0.00 44.72 44.68 2di8 s GLY 107 CO 0.22 3.66 1.23 -0.56 0.00 0.00 0.00 173.10 177.65 2di8 h PRO 108 N 5.80 -0.05 -6.44 2.90 0.13 -2.05 -3.44 132.00 128.85 2di8 h PRO 108 Ca 0.06 0.00 -0.54 0.00 -0.87 0.00 0.00 66.00 64.65 2di8 h PRO 108 Cb 1.14 0.01 -0.03 0.00 0.13 0.00 0.00 31.00 32.25 2di8 h PRO 108 CO 0.05 0.42 -0.04 0.45 -0.23 0.00 0.00 178.00 178.64 2di8 s SER 109 N -5.62 6.80 -0.19 1.44 0.15 -1.26 -5.08 113.70 109.95 2di8 s SER 109 Ca -0.15 1.12 0.01 0.00 0.70 0.00 0.00 55.95 57.62 2di8 s SER 109 Cb 0.02 -2.30 0.03 0.00 -1.71 0.00 0.00 66.02 62.05 2di8 s SER 109 CO 0.65 0.01 -0.14 -0.44 1.20 0.00 0.00 173.24 174.51 2di8 s SER 110 N -1.94 3.29 0.00 5.45 0.01 -1.26 -5.23 113.70 114.02 2di8 s SER 110 Ca 0.43 -0.79 0.00 0.00 1.31 0.00 0.00 55.95 56.90 2di8 s SER 110 Cb -0.14 -1.34 0.00 0.00 0.21 0.00 0.00 66.02 64.75 2di8 s SER 110 CO 0.20 -0.09 0.00 0.61 0.41 0.00 0.00 173.24 174.37