#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 -0.37 0.07 1.61 1.04 -1.26 -5.07 113.70 109.71 2di8 s SER 2 Ca 0.00 0.71 -0.36 0.00 0.48 0.00 0.00 55.95 56.77 2di8 s SER 2 Cb 0.00 0.71 -0.19 0.00 0.10 0.00 0.00 66.02 66.64 2di8 s SER 2 CO 0.00 -0.14 1.58 0.28 0.98 0.00 0.00 173.24 175.95 2di8 h SER 3 N 3.92 -1.11 -5.06 7.02 0.02 -2.12 -3.47 113.55 112.74 2di8 h SER 3 Ca -0.27 0.05 0.03 0.00 -0.84 0.00 0.00 61.79 60.76 2di8 h SER 3 Cb 1.18 0.31 -0.07 0.00 0.14 0.00 0.00 62.40 63.96 2di8 h SER 3 CO 0.13 -0.73 0.14 -0.83 -1.14 0.00 0.00 176.83 174.40 2di8 s GLY 4 N -2.04 0.02 0.42 -3.77 0.00 -1.26 -5.15 107.32 95.54 2di8 s GLY 4 Ca -0.19 -0.39 -0.26 0.00 0.00 0.00 0.00 44.72 43.88 2di8 s GLY 4 CO 0.61 -0.21 1.38 -0.56 0.00 0.00 0.00 173.10 174.32 2di8 s SER 5 N -2.93 6.16 0.33 1.64 0.01 -1.26 -4.86 113.70 112.79 2di8 s SER 5 Ca 0.13 2.82 0.12 0.00 1.31 0.00 0.00 55.95 60.33 2di8 s SER 5 Cb -0.04 -2.65 1.06 0.00 0.21 0.00 0.00 66.02 64.60 2di8 s SER 5 CO 0.06 -0.97 1.52 -1.20 0.41 0.00 0.00 173.24 173.06 2di8 n SER 6 N 0.07 0.14 0.00 2.44 7.64 -1.26 -4.56 113.62 118.10 2di8 n SER 6 Ca 0.04 1.62 0.00 0.00 1.01 0.00 0.00 58.87 61.54 2di8 n SER 6 Cb 0.42 -0.70 0.00 0.00 -1.01 0.00 0.00 64.21 62.92 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 -1.35 -1.13 2.87 0.23 0.00 -1.26 -5.14 105.19 99.39 2di8 n GLY 7 Ca 0.31 0.58 -0.14 0.00 0.00 0.00 0.00 46.02 46.76 2di8 n GLY 7 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2di8 s ILE 8 N 0.00 0.12 0.28 -0.61 -1.09 -1.26 -4.62 121.20 114.02 2di8 s ILE 8 Ca 0.00 -0.01 0.09 0.00 -2.23 0.00 0.00 60.65 58.51 2di8 s ILE 8 Cb 0.00 -0.15 -0.05 0.00 -1.58 0.00 0.00 42.46 40.67 2di8 s ILE 8 CO 0.00 0.07 -0.13 -0.83 -1.23 0.00 0.00 174.94 172.82 2di8 s GLY 9 N 0.32 1.86 -0.14 6.18 0.00 -0.75 -4.30 107.32 110.48 2di8 s GLY 9 Ca -0.03 -1.89 -0.02 0.00 0.00 0.00 0.00 44.72 42.78 2di8 s GLY 9 CO -0.01 -1.91 -0.08 -0.35 0.00 0.00 0.00 173.10 170.76 2di8 s ASP 10 N -3.48 4.47 0.65 1.64 -1.08 -0.17 -4.76 116.67 113.94 2di8 s ASP 10 Ca 0.29 -0.21 0.43 0.00 -0.52 0.00 0.00 52.55 52.54 2di8 s ASP 10 Cb -0.00 -1.71 2.35 0.00 -1.46 0.00 0.00 42.92 42.10 2di8 s ASP 10 CO 0.13 0.17 2.32 0.00 0.52 0.00 0.00 175.17 178.31 2di8 h ALA 11 N 6.69 1.01 -0.53 3.66 0.00 -1.82 -1.60 119.26 126.66 2di8 h ALA 11 Ca -0.29 0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.50 2di8 h ALA 11 Cb 1.20 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.97 2di8 h ALA 11 CO 0.60 -0.01 -0.13 0.00 0.00 0.00 0.00 179.25 179.72 2di8 h ARG 12 N 0.00 1.02 0.00 0.00 3.08 -1.92 -2.81 114.38 113.75 2di8 h ARG 12 Ca 0.00 -0.39 -0.02 0.00 0.07 0.00 0.00 59.98 59.64 2di8 h ARG 12 Cb 0.01 -0.06 -0.00 0.00 0.08 0.00 0.00 29.97 30.00 2di8 h ARG 12 CO 0.00 1.08 -0.07 0.00 -1.07 0.00 0.00 179.97 179.90 2di8 h ARG 13 N 0.89 0.00 -6.61 0.04 -0.00 -1.64 -3.45 114.38 103.61 2di8 h ARG 13 Ca 0.13 0.00 -0.53 0.00 -0.50 0.00 0.00 59.98 59.09 2di8 h ARG 13 Cb 0.70 0.00 0.03 0.00 0.00 0.00 0.00 29.97 30.70 2di8 h ARG 13 CO 0.05 0.07 0.68 0.00 0.00 0.00 0.00 179.97 180.77 2di8 s ALA 14 N -3.29 3.55 0.33 0.04 0.00 -1.06 -4.39 121.76 116.94 2di8 s ALA 14 Ca 0.05 1.10 0.08 0.00 0.00 0.00 0.00 51.96 53.19 2di8 s ALA 14 Cb 0.06 -3.50 -0.04 0.00 0.00 0.00 0.00 23.12 19.64 2di8 s ALA 14 CO 0.65 -0.56 0.12 0.15 0.00 0.00 0.00 175.76 176.12 2di8 s LYS 15 N 0.47 2.37 -0.14 0.00 1.02 -0.18 -4.76 119.74 118.51 2di8 s LYS 15 Ca 0.60 -1.53 -0.05 0.00 0.02 0.00 0.00 55.97 55.01 2di8 s LYS 15 Cb -0.36 -2.17 0.07 0.00 -0.52 0.00 0.00 37.83 34.84 2di8 s LYS 15 CO 0.34 0.15 0.29 0.14 -0.92 0.00 0.00 175.35 175.35 2di8 s VAL 16 N -2.41 -0.39 -0.01 3.17 -7.23 -1.26 -0.35 120.40 111.93 2di8 s VAL 16 Ca 0.37 0.24 0.02 0.00 -1.81 0.00 0.00 61.98 60.80 2di8 s VAL 16 Cb -0.03 -0.47 -0.01 0.00 0.56 0.00 0.00 36.38 36.43 2di8 s VAL 16 CO 0.22 0.10 -0.08 -0.72 -0.31 0.00 0.00 175.10 174.31 2di8 s TYR 17 N 2.28 0.73 -3.96 2.82 1.13 -0.90 -5.01 117.35 114.43 2di8 s TYR 17 Ca -0.01 -0.14 0.00 0.00 -1.41 0.00 0.00 57.07 55.51 2di8 s TYR 17 Cb -0.12 -0.47 0.00 0.00 -1.10 0.00 0.00 41.96 40.27 2di8 s TYR 17 CO -0.09 -0.01 0.00 0.41 -2.51 0.00 0.00 175.55 173.34 2di8 n GLY 18 N 2.89 -1.50 0.02 5.49 0.00 -1.26 0.27 105.19 111.10 2di8 n GLY 18 Ca -0.13 -1.16 0.09 0.00 0.00 0.00 0.00 46.02 44.83 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 -0.09 0.66 -0.95 1.61 0.63 -1.18 -4.34 116.66 113.00 2di8 n ARG 19 Ca 0.00 -0.17 -0.20 0.00 -0.92 0.00 0.00 57.85 56.56 2di8 n ARG 19 Cb 0.00 -1.53 0.09 0.00 0.45 0.00 0.00 32.46 31.47 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 1.29 4.23 0.00 5.14 0.00 -1.21 -3.74 105.19 110.90 2di8 n GLY 20 Ca -0.06 -1.14 0.00 0.00 0.00 0.00 0.00 46.02 44.82 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 -0.40 0.03 0.00 0.99 4.77 -1.26 -4.85 117.00 116.27 2di8 n LEU 21 Ca 0.42 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.40 2di8 n LEU 21 Cb 0.98 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 42.07 2di8 n LEU 21 CO 0.48 0.00 0.00 -0.24 -1.33 0.00 0.00 177.39 176.30 2di8 n SER 22 N -1.45 0.00 -4.54 -1.43 2.88 -1.25 -4.44 113.62 103.38 2di8 n SER 22 Ca 0.00 0.00 -0.19 0.00 -1.33 0.00 0.00 58.87 57.35 2di8 n SER 22 Cb 0.31 -0.16 0.04 0.00 -0.75 0.00 0.00 64.21 63.66 2di8 n SER 22 CO 0.00 0.00 0.00 -1.84 -1.23 0.00 0.00 175.04 171.97 2di8 n GLU 23 N -2.05 0.70 0.00 -1.46 0.28 -1.25 -2.96 120.64 113.90 2di8 n GLU 23 Ca 0.00 -2.82 0.00 0.00 -0.16 0.00 0.00 57.16 54.18 2di8 n GLU 23 Cb 0.00 -0.03 0.00 0.00 1.43 0.00 0.00 31.44 32.84 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 -1.05 -0.56 3.17 -1.84 0.00 -1.21 -4.33 105.19 99.37 2di8 n GLY 24 Ca 0.09 -0.96 -0.12 0.00 0.00 0.00 0.00 46.02 45.03 2di8 n GLY 24 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2di8 s ARG 25 N -2.00 0.57 0.57 1.61 0.52 -1.26 -2.83 118.95 116.14 2di8 s ARG 25 Ca 0.00 -0.29 -0.19 0.00 -0.52 0.00 0.00 55.73 54.72 2di8 s ARG 25 Cb 0.00 0.25 -0.04 0.00 0.52 0.00 0.00 34.95 35.67 2di8 s ARG 25 CO 0.00 -0.15 1.22 0.95 0.02 0.00 0.00 175.30 177.34 2di8 s THR 26 N -1.35 2.64 -1.45 0.02 -4.23 -1.26 -2.89 115.64 107.11 2di8 s THR 26 Ca -0.14 0.41 -0.12 0.00 -1.18 0.00 0.00 61.69 60.66 2di8 s THR 26 Cb -0.06 -3.18 0.08 0.00 1.34 0.00 0.00 72.50 70.68 2di8 s THR 26 CO 0.03 -0.07 0.71 0.49 -0.54 0.00 0.00 174.62 175.24 2di8 n PHE 27 N -1.42 -1.98 -3.74 3.99 3.01 0.08 -4.95 117.46 112.46 2di8 n PHE 27 Ca 0.13 0.67 -0.23 0.00 1.01 0.00 0.00 57.45 59.02 2di8 n PHE 27 Cb 0.49 -3.44 -0.17 0.00 -0.01 0.00 0.00 39.48 36.35 2di8 n PHE 27 CO 0.00 0.00 0.00 -2.00 1.01 0.00 0.00 176.76 175.77 2di8 s GLU 28 N -6.32 0.46 -0.32 -1.08 2.12 -1.14 -5.02 118.70 107.41 2di8 s GLU 28 Ca 0.53 0.06 -0.27 0.00 0.36 0.00 0.00 54.97 55.64 2di8 s GLU 28 Cb -0.27 -1.14 -0.05 0.00 0.26 0.00 0.00 34.13 32.93 2di8 s GLU 28 CO 0.65 -0.39 2.25 1.41 -0.54 0.00 0.00 175.26 178.65 2di8 s MET 29 N 2.00 2.80 -0.41 4.30 -2.45 -1.26 -4.36 119.30 119.92 2di8 s MET 29 Ca 0.04 1.78 -0.11 0.00 -1.25 0.00 0.00 55.69 56.15 2di8 s MET 29 Cb -0.13 -4.43 0.05 0.00 1.25 0.00 0.00 34.83 31.57 2di8 s MET 29 CO -0.06 -2.49 0.26 -1.12 1.05 0.00 0.00 175.02 172.67 2di8 s SER 30 N 9.44 5.76 0.19 1.11 0.01 -0.44 -4.94 113.70 124.83 2di8 s SER 30 Ca 0.98 -1.25 0.09 0.00 1.31 0.00 0.00 55.95 57.08 2di8 s SER 30 Cb -0.27 -2.03 -0.04 0.00 0.21 0.00 0.00 66.02 63.88 2di8 s SER 30 CO 0.32 -0.49 -0.08 1.51 0.41 0.00 0.00 173.24 174.91 2di8 s ASP 31 N 1.93 4.33 0.03 2.44 1.47 -1.26 -2.80 116.67 122.81 2di8 s ASP 31 Ca 0.03 -0.57 -0.10 0.00 1.18 0.00 0.00 52.55 53.09 2di8 s ASP 31 Cb -0.21 -0.76 0.00 0.00 -0.34 0.00 0.00 42.92 41.61 2di8 s ASP 31 CO 0.05 0.09 0.20 0.72 0.68 0.00 0.00 175.17 176.91 2di8 s PHE 32 N -1.76 0.04 0.24 2.11 -0.12 -0.72 -3.12 117.98 114.64 2di8 s PHE 32 Ca 0.26 -0.23 -0.10 0.00 -0.05 0.00 0.00 56.93 56.81 2di8 s PHE 32 Cb -0.09 -0.02 -0.07 0.00 -0.63 0.00 0.00 43.02 42.21 2di8 s PHE 32 CO 0.16 -0.41 0.57 0.42 -0.05 0.00 0.00 175.22 175.91 2di8 s ILE 33 N -2.36 4.90 -0.23 -4.49 -1.09 0.14 -1.72 121.20 116.35 2di8 s ILE 33 Ca -0.07 0.54 0.01 0.00 -2.23 0.00 0.00 60.65 58.90 2di8 s ILE 33 Cb -0.02 -3.62 0.06 0.00 -1.58 0.00 0.00 42.46 37.29 2di8 s ILE 33 CO -0.03 -0.07 -0.06 -0.69 -1.23 0.00 0.00 174.94 172.86 2di8 s VAL 34 N -1.82 1.53 -0.63 2.92 1.01 -0.54 -2.11 120.40 120.76 2di8 s VAL 34 Ca 0.48 -1.16 -0.23 0.00 0.00 0.00 0.00 61.98 61.06 2di8 s VAL 34 Cb -0.11 -1.76 0.06 0.00 0.00 0.00 0.00 36.38 34.57 2di8 s VAL 34 CO 0.21 -0.05 0.98 -0.62 0.00 0.00 0.00 175.10 175.62 2di8 s ASP 35 N 1.41 6.23 -0.01 3.32 -1.08 0.53 -3.30 116.67 123.77 2di8 s ASP 35 Ca -0.05 -0.72 0.04 0.00 -0.52 0.00 0.00 52.55 51.31 2di8 s ASP 35 Cb -0.18 -2.44 -0.07 0.00 -1.46 0.00 0.00 42.92 38.77 2di8 s ASP 35 CO -0.07 -1.40 0.10 0.35 0.52 0.00 0.00 175.17 174.67 2di8 n THR 36 N 6.06 0.00 -0.24 1.71 -2.24 -1.26 -1.01 114.28 117.29 2di8 n THR 36 Ca -0.01 -0.11 0.04 0.00 -2.27 0.00 0.00 64.05 61.70 2di8 n THR 36 Cb 0.46 0.42 0.16 0.00 -2.10 0.00 0.00 70.33 69.28 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 0.00 0.28 0.00 -0.78 3.08 -1.86 0.33 114.38 115.42 2di8 h ARG 37 Ca 0.00 -0.02 -0.07 0.00 0.07 0.00 0.00 59.98 59.96 2di8 h ARG 37 Cb 0.19 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.17 2di8 h ARG 37 CO 0.00 0.18 -0.34 0.22 -1.07 0.00 0.00 179.97 178.97 2di8 h ASP 38 N 0.28 0.00 0.00 7.04 3.58 -1.90 -3.13 116.42 122.30 2di8 h ASP 38 Ca 0.39 0.00 -0.18 0.00 0.42 0.00 0.00 57.03 57.66 2di8 h ASP 38 Cb 0.64 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.69 2di8 h ASP 38 CO -0.47 0.34 -0.64 0.00 -2.88 0.00 0.00 179.24 175.59 2di8 h ALA 39 N 1.66 0.56 0.00 -0.78 0.00 -0.68 -3.46 119.26 116.57 2di8 h ALA 39 Ca -0.00 -0.55 0.00 0.00 0.00 0.00 0.00 54.91 54.35 2di8 h ALA 39 Cb 0.96 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.69 2di8 h ALA 39 CO 0.04 0.70 0.00 0.41 0.00 0.00 0.00 179.25 180.41 2di8 n GLY 40 N 0.43 0.46 3.13 0.00 0.00 0.16 -0.99 105.19 108.38 2di8 n GLY 40 Ca -0.04 -0.97 -0.10 0.00 0.00 0.00 0.00 46.02 44.90 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 0.11 0.00 1.61 6.14 -1.26 -4.59 117.35 119.36 2di8 s TYR 41 Ca 0.00 -0.32 0.00 0.00 0.64 0.00 0.00 57.07 57.39 2di8 s TYR 41 Cb 0.00 -0.08 0.00 0.00 0.42 0.00 0.00 41.96 42.30 2di8 s TYR 41 CO 0.00 -0.35 0.00 0.41 0.64 0.00 0.00 175.55 176.25 2di8 n GLY 42 N 0.99 1.50 3.75 8.97 0.00 -1.26 -1.82 105.19 117.32 2di8 n GLY 42 Ca -0.20 -1.40 -0.40 0.00 0.00 0.00 0.00 46.02 44.02 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 3.08 -0.17 -0.02 0.00 -1.26 -4.57 107.32 104.38 2di8 s GLY 43 Ca 0.00 0.67 -0.04 0.00 0.00 0.00 0.00 44.72 45.36 2di8 s GLY 43 CO 0.00 1.31 -0.04 -0.42 0.00 0.00 0.00 173.10 173.95 2di8 s ILE 44 N -0.93 3.74 -0.31 0.90 1.01 -1.26 -0.26 121.20 124.09 2di8 s ILE 44 Ca 0.43 -0.40 -0.05 0.00 0.00 0.00 0.00 60.65 60.63 2di8 s ILE 44 Cb -0.27 -2.65 0.03 0.00 0.01 0.00 0.00 42.46 39.58 2di8 s ILE 44 CO 0.33 0.47 0.06 -0.55 0.00 0.00 0.00 174.94 175.25 2di8 s SER 45 N 0.64 5.04 -0.20 3.58 0.15 -0.89 -4.96 113.70 117.07 2di8 s SER 45 Ca -0.03 -0.99 0.01 0.00 0.70 0.00 0.00 55.95 55.64 2di8 s SER 45 Cb -0.14 -1.82 0.02 0.00 -1.71 0.00 0.00 66.02 62.37 2di8 s SER 45 CO 0.02 -0.25 -0.17 -0.76 1.20 0.00 0.00 173.24 173.29 2di8 s LEU 46 N 1.40 2.42 -0.20 3.45 1.43 -1.24 -1.87 118.68 124.06 2di8 s LEU 46 Ca -0.01 -0.74 -0.06 0.00 -1.03 0.00 0.00 54.13 52.29 2di8 s LEU 46 Cb -0.18 -1.52 0.10 0.00 0.03 0.00 0.00 46.19 44.61 2di8 s LEU 46 CO 0.01 -0.03 0.41 0.00 0.23 0.00 0.00 176.35 176.96 2di8 s ALA 47 N 1.28 -1.13 -0.13 4.21 0.00 -1.10 -4.98 121.76 119.92 2di8 s ALA 47 Ca 0.03 1.40 -0.16 0.00 0.00 0.00 0.00 51.96 53.24 2di8 s ALA 47 Cb -0.14 -1.36 -0.04 0.00 0.00 0.00 0.00 23.12 21.57 2di8 s ALA 47 CO -0.11 -0.82 0.39 0.08 0.00 0.00 0.00 175.76 175.30 2di8 s VAL 48 N 2.60 5.24 -0.31 0.00 1.01 -1.26 -1.00 120.40 126.69 2di8 s VAL 48 Ca 0.00 0.76 0.02 0.00 0.00 0.00 0.00 61.98 62.76 2di8 s VAL 48 Cb -0.12 -3.72 0.09 0.00 0.00 0.00 0.00 36.38 32.62 2di8 s VAL 48 CO -0.13 0.37 0.03 -1.61 0.00 0.00 0.00 175.10 173.76 2di8 s GLU 49 N 0.46 1.40 0.00 2.72 8.01 -0.01 -4.72 118.70 126.57 2di8 s GLU 49 Ca 0.21 -1.48 0.00 0.00 0.01 0.00 0.00 54.97 53.71 2di8 s GLU 49 Cb -0.14 -2.79 0.00 0.00 -4.31 0.00 0.00 34.13 26.89 2di8 s GLU 49 CO 0.07 -0.85 0.00 0.41 0.01 0.00 0.00 175.26 174.90 2di8 n GLY 50 N 4.48 6.12 0.00 -1.39 0.00 -1.26 -1.07 105.19 112.07 2di8 n GLY 50 Ca -0.02 -1.64 0.08 0.00 0.00 0.00 0.00 46.02 44.43 2di8 n GLY 50 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2di8 n PRO 51 N 0.00 0.36 -3.95 1.61 -0.04 -1.26 -4.80 135.00 126.93 2di8 n PRO 51 Ca 0.00 0.07 -0.11 0.00 -0.04 0.00 0.00 63.50 63.41 2di8 n PRO 51 Cb 0.00 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 31.95 2di8 n PRO 51 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 2di8 s SER 52 N -2.26 0.40 -0.14 3.54 0.01 -1.26 -4.92 113.70 109.07 2di8 s SER 52 Ca 0.19 -1.26 -0.14 0.00 1.31 0.00 0.00 55.95 56.05 2di8 s SER 52 Cb 0.10 0.75 -0.05 0.00 0.21 0.00 0.00 66.02 67.03 2di8 s SER 52 CO 0.20 -1.47 0.32 -0.75 0.41 0.00 0.00 173.24 171.95 2di8 s LYS 53 N -2.82 4.20 -0.18 12.44 2.36 -1.26 -4.89 119.74 129.58 2di8 s LYS 53 Ca 0.22 0.16 0.00 0.00 -2.55 0.00 0.00 55.97 53.80 2di8 s LYS 53 Cb -0.03 -3.40 0.04 0.00 -1.05 0.00 0.00 37.83 33.40 2di8 s LYS 53 CO 0.15 0.29 -0.08 0.14 1.55 0.00 0.00 175.35 177.40 2di8 s VAL 54 N 0.30 1.37 -0.24 4.02 -7.23 -1.26 -4.78 120.40 112.58 2di8 s VAL 54 Ca 0.18 -0.84 -0.28 0.00 -1.81 0.00 0.00 61.98 59.24 2di8 s VAL 54 Cb -0.13 -1.51 -0.04 0.00 0.56 0.00 0.00 36.38 35.25 2di8 s VAL 54 CO 0.05 0.13 2.15 -1.81 -0.31 0.00 0.00 175.10 175.31 2di8 s ASP 55 N 1.51 5.51 -0.29 4.85 1.11 -1.26 -4.83 116.67 123.28 2di8 s ASP 55 Ca -0.01 1.77 -0.27 0.00 0.18 0.00 0.00 52.55 54.23 2di8 s ASP 55 Cb -0.16 -2.51 0.01 0.00 1.07 0.00 0.00 42.92 41.33 2di8 s ASP 55 CO -0.08 -1.93 0.94 -0.63 1.18 0.00 0.00 175.17 174.64 2di8 s ILE 56 N 8.13 4.68 -0.14 0.77 -1.09 -1.26 -4.41 121.20 127.88 2di8 s ILE 56 Ca 0.97 1.59 -0.03 0.00 -2.23 0.00 0.00 60.65 60.95 2di8 s ILE 56 Cb -0.31 -4.26 -0.03 0.00 -1.58 0.00 0.00 42.46 36.28 2di8 s ILE 56 CO 0.35 -0.29 -0.05 -1.10 -1.23 0.00 0.00 174.94 172.62 2di8 s GLN 57 N 3.22 3.57 0.11 2.79 -0.21 -0.36 -4.97 119.66 123.80 2di8 s GLN 57 Ca 0.39 -0.53 0.07 0.00 0.02 0.00 0.00 55.36 55.31 2di8 s GLN 57 Cb -0.14 -2.87 -0.04 0.00 1.00 0.00 0.00 33.01 30.97 2di8 s GLN 57 CO 0.11 0.29 -0.17 0.95 -2.12 0.00 0.00 175.29 174.35 2di8 s THR 58 N 0.23 1.46 -0.29 -0.19 -4.23 -1.26 -1.61 115.64 109.76 2di8 s THR 58 Ca -0.03 -1.59 -0.15 0.00 -1.18 0.00 0.00 61.69 58.74 2di8 s THR 58 Cb -0.14 -1.47 0.10 0.00 1.34 0.00 0.00 72.50 72.33 2di8 s THR 58 CO 0.03 -0.25 0.72 -0.70 -0.54 0.00 0.00 174.62 173.88 2di8 s GLU 59 N -2.23 0.64 0.07 3.99 2.12 -1.26 -5.05 118.70 116.98 2di8 s GLU 59 Ca 0.06 1.20 -0.31 0.00 0.36 0.00 0.00 54.97 56.29 2di8 s GLU 59 Cb -0.08 0.29 -0.09 0.00 0.26 0.00 0.00 34.13 34.51 2di8 s GLU 59 CO 0.04 -0.15 1.77 0.34 -0.54 0.00 0.00 175.26 176.72 2di8 s ASP 60 N 1.89 6.52 0.85 -1.70 -1.08 -1.26 -3.76 116.67 118.12 2di8 s ASP 60 Ca -0.09 2.59 -0.13 0.00 -0.52 0.00 0.00 52.55 54.41 2di8 s ASP 60 Cb -0.06 -2.56 0.11 0.00 -1.46 0.00 0.00 42.92 38.96 2di8 s ASP 60 CO -0.19 -0.96 1.22 -0.76 0.52 0.00 0.00 175.17 175.00 2di8 s LEU 61 N 3.10 2.57 0.26 -1.34 1.43 0.26 -4.96 118.68 120.00 2di8 s LEU 61 Ca 0.79 0.62 0.04 0.00 -1.03 0.00 0.00 54.13 54.55 2di8 s LEU 61 Cb -0.42 -2.98 0.34 0.00 0.03 0.00 0.00 46.19 43.15 2di8 s LEU 61 CO 0.35 -2.14 1.64 -0.33 0.23 0.00 0.00 176.35 176.09 2di8 h GLU 62 N -1.22 0.33 0.00 1.70 4.39 -1.94 -2.78 114.58 115.05 2di8 h GLU 62 Ca -0.45 -0.17 -0.05 0.00 0.34 0.00 0.00 59.36 59.02 2di8 h GLU 62 Cb 1.30 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.95 2di8 h GLU 62 CO 0.58 0.72 -0.23 -0.44 -1.16 0.00 0.00 179.01 178.48 2di8 h ASP 63 N 0.27 0.00 0.00 1.42 5.19 -2.02 -3.47 116.42 117.81 2di8 h ASP 63 Ca 0.02 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.43 2di8 h ASP 63 Cb 0.91 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.42 2di8 h ASP 63 CO 0.08 0.23 0.00 0.61 -3.12 0.00 0.00 179.24 177.03 2di8 n GLY 64 N 0.49 2.31 3.79 2.75 0.00 -1.05 -5.04 105.19 108.44 2di8 n GLY 64 Ca 0.01 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.74 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 -2.07 1.89 -0.07 2.61 -4.23 -1.26 -4.60 115.64 107.91 2di8 s THR 65 Ca 0.00 0.00 0.04 0.00 -1.18 0.00 0.00 61.69 60.55 2di8 s THR 65 Cb 0.00 -2.78 0.00 0.00 1.34 0.00 0.00 72.50 71.06 2di8 s THR 65 CO 0.00 0.00 -0.19 0.00 -0.54 0.00 0.00 174.62 173.89 2di8 s LYS 67 N 0.34 2.59 0.40 0.00 2.20 -1.25 -1.47 119.74 122.56 2di8 s LYS 67 Ca -0.13 -1.44 -0.24 0.00 -0.36 0.00 0.00 55.97 53.80 2di8 s LYS 67 Cb -0.16 -3.75 -0.09 0.00 -1.51 0.00 0.00 37.83 32.32 2di8 s LYS 67 CO 0.05 -0.93 1.04 0.08 -0.36 0.00 0.00 175.35 175.24 2di8 s VAL 68 N 1.42 3.75 -0.04 4.02 1.01 -0.70 -4.28 120.40 125.57 2di8 s VAL 68 Ca 0.03 1.32 -0.01 0.00 0.00 0.00 0.00 61.98 63.32 2di8 s VAL 68 Cb -0.23 -3.67 0.03 0.00 0.00 0.00 0.00 36.38 32.52 2di8 s VAL 68 CO 0.02 -0.01 0.08 -0.44 0.00 0.00 0.00 175.10 174.75 2di8 s SER 69 N -1.60 0.14 0.01 3.32 0.01 -0.63 -1.76 113.70 113.18 2di8 s SER 69 Ca 0.58 0.15 -0.03 0.00 1.31 0.00 0.00 55.95 57.96 2di8 s SER 69 Cb -0.21 0.03 -0.01 0.00 0.21 0.00 0.00 66.02 66.04 2di8 s SER 69 CO 0.27 -0.15 0.04 -0.72 0.41 0.00 0.00 173.24 173.09 2di8 s TYR 70 N 1.28 0.13 -0.35 2.43 -0.85 -1.12 -1.23 117.35 117.63 2di8 s TYR 70 Ca -0.07 -0.27 0.04 0.00 -0.52 0.00 0.00 57.07 56.25 2di8 s TYR 70 Cb -0.12 -0.10 0.10 0.00 0.38 0.00 0.00 41.96 42.21 2di8 s TYR 70 CO -0.04 -0.19 0.07 0.12 -1.52 0.00 0.00 175.55 173.98 2di8 s PHE 71 N -1.16 3.62 0.59 -3.49 5.36 -1.26 -1.33 117.98 120.31 2di8 s PHE 71 Ca -0.13 -2.96 -0.18 0.00 -0.96 0.00 0.00 56.93 52.71 2di8 s PHE 71 Cb -0.07 -2.86 -0.04 0.00 -0.34 0.00 0.00 43.02 39.71 2di8 s PHE 71 CO 0.00 -0.93 1.12 -1.25 -1.46 0.00 0.00 175.22 172.70 2di8 s PRO 72 N 0.85 3.14 0.00 10.12 0.04 -1.26 -4.70 135.00 143.19 2di8 s PRO 72 Ca 0.11 1.52 0.00 0.00 0.04 0.00 0.00 61.00 62.68 2di8 s PRO 72 Cb -0.19 -1.98 0.00 0.00 0.04 0.00 0.00 34.50 32.36 2di8 s PRO 72 CO -0.08 -1.01 0.00 0.25 0.04 0.00 0.00 177.00 176.20 2di8 n THR 73 N -1.74 0.00 -4.94 1.26 -2.24 -1.26 -0.74 114.28 104.61 2di8 n THR 73 Ca 0.11 0.00 -0.28 0.00 -2.27 0.00 0.00 64.05 61.61 2di8 n THR 73 Cb 0.51 -0.71 -0.16 0.00 -2.10 0.00 0.00 70.33 67.86 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 -1.81 1.62 0.69 2.28 1.01 -1.26 -4.70 120.40 118.24 2di8 s VAL 74 Ca 0.00 -0.80 -0.14 0.00 0.00 0.00 0.00 61.98 61.05 2di8 s VAL 74 Cb 0.00 -1.40 0.02 0.00 0.00 0.00 0.00 36.38 34.99 2di8 s VAL 74 CO 0.00 0.46 1.10 -2.16 0.00 0.00 0.00 175.10 174.51 2di8 s PRO 75 N 0.22 2.63 0.00 2.72 0.04 -1.26 -4.67 135.00 134.67 2di8 s PRO 75 Ca -0.10 1.32 0.00 0.00 0.04 0.00 0.00 61.00 62.26 2di8 s PRO 75 Cb -0.14 -1.93 0.00 0.00 0.04 0.00 0.00 34.50 32.46 2di8 s PRO 75 CO 0.04 -1.38 0.00 0.41 0.04 0.00 0.00 177.00 176.12 2di8 n GLY 76 N -0.73 0.03 2.99 0.56 0.00 -1.25 -4.77 105.19 102.03 2di8 n GLY 76 Ca 0.10 -0.65 -0.31 0.00 0.00 0.00 0.00 46.02 45.16 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 -1.04 1.72 -0.33 1.61 1.01 -1.26 -2.32 120.40 119.78 2di8 s VAL 77 Ca 0.00 -1.21 -0.12 0.00 0.00 0.00 0.00 61.98 60.64 2di8 s VAL 77 Cb 0.00 -1.86 -0.02 0.00 0.00 0.00 0.00 36.38 34.49 2di8 s VAL 77 CO 0.00 0.04 0.23 -0.31 0.00 0.00 0.00 175.10 175.06 2di8 s TYR 78 N 1.33 3.23 -0.55 5.22 2.02 -0.70 -4.17 117.35 123.72 2di8 s TYR 78 Ca -0.04 -0.16 -0.23 0.00 -0.37 0.00 0.00 57.07 56.27 2di8 s TYR 78 Cb -0.18 -2.45 0.05 0.00 -0.40 0.00 0.00 41.96 38.98 2di8 s TYR 78 CO -0.07 -0.32 0.86 0.42 -1.57 0.00 0.00 175.55 174.87 2di8 s ILE 79 N 1.73 4.51 -0.66 2.71 -1.09 -0.23 -1.38 121.20 126.78 2di8 s ILE 79 Ca 0.06 -0.00 -0.24 0.00 -2.23 0.00 0.00 60.65 58.24 2di8 s ILE 79 Cb -0.17 -4.49 0.06 0.00 -1.58 0.00 0.00 42.46 36.27 2di8 s ILE 79 CO 0.10 -1.07 1.03 -0.69 -1.23 0.00 0.00 174.94 173.08 2di8 s VAL 80 N 3.60 4.21 -0.81 2.92 1.01 0.62 -0.83 120.40 131.13 2di8 s VAL 80 Ca 0.25 -0.09 -0.26 0.00 0.00 0.00 0.00 61.98 61.89 2di8 s VAL 80 Cb -0.15 -4.71 0.02 0.00 0.00 0.00 0.00 36.38 31.54 2di8 s VAL 80 CO 0.16 -1.48 1.48 -0.94 0.00 0.00 0.00 175.10 174.33 2di8 s SER 81 N 3.55 6.02 -0.34 3.32 1.04 -0.17 -2.36 113.70 124.75 2di8 s SER 81 Ca 0.26 -0.63 -0.11 0.00 0.48 0.00 0.00 55.95 55.95 2di8 s SER 81 Cb -0.14 -2.56 0.00 0.00 0.10 0.00 0.00 66.02 63.42 2di8 s SER 81 CO 0.13 -1.92 0.19 -0.89 0.98 0.00 0.00 173.24 171.73 2di8 s THR 82 N 6.47 4.73 0.12 2.02 2.01 -1.25 -2.70 115.64 127.04 2di8 s THR 82 Ca 0.47 -0.54 0.08 0.00 0.31 0.00 0.00 61.69 62.00 2di8 s THR 82 Cb -0.06 -3.50 -0.04 0.00 0.01 0.00 0.00 72.50 68.91 2di8 s THR 82 CO 0.07 -0.06 -0.18 -0.54 -0.69 0.00 0.00 174.62 173.22 2di8 s LYS 83 N 1.61 1.11 -0.22 4.92 1.02 -0.78 -2.49 119.74 124.90 2di8 s LYS 83 Ca 0.04 -1.22 -0.03 0.00 0.02 0.00 0.00 55.97 54.78 2di8 s LYS 83 Cb -0.18 -1.22 0.11 0.00 -0.52 0.00 0.00 37.83 36.01 2di8 s LYS 83 CO 0.07 0.27 0.26 0.12 -0.92 0.00 0.00 175.35 175.14 2di8 s PHE 84 N -1.59 -0.38 -0.85 3.18 5.36 0.44 -2.09 117.98 122.05 2di8 s PHE 84 Ca 0.08 0.25 -0.03 0.00 -0.96 0.00 0.00 56.93 56.27 2di8 s PHE 84 Cb -0.08 -0.32 0.00 0.00 -0.34 0.00 0.00 43.02 42.28 2di8 s PHE 84 CO 0.04 -0.67 0.73 0.00 -1.46 0.00 0.00 175.22 173.87 2di8 n ALA 85 N 5.32 -1.13 -3.35 11.12 0.00 0.65 -3.20 120.51 129.92 2di8 n ALA 85 Ca -0.05 0.11 -0.18 0.00 0.00 0.00 0.00 53.44 53.33 2di8 n ALA 85 Cb 0.49 -2.78 0.08 0.00 0.00 0.00 0.00 19.45 17.23 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 -2.00 -3.68 -3.62 0.00 8.00 -1.26 -4.94 116.55 109.05 2di8 n ASP 86 Ca -0.10 -0.52 -0.02 0.00 0.71 0.00 0.00 54.79 54.87 2di8 n ASP 86 Cb 0.58 -4.55 -0.05 0.00 -0.02 0.00 0.00 41.12 37.08 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 -5.61 0.56 0.22 -1.24 2.02 -1.20 -5.08 118.70 108.38 2di8 s GLU 87 Ca 0.22 1.28 -0.30 0.00 0.02 0.00 0.00 54.97 56.20 2di8 s GLU 87 Cb -0.10 0.63 -0.09 0.00 0.10 0.00 0.00 34.13 34.68 2di8 s GLU 87 CO 0.64 -0.17 1.14 -1.01 0.02 0.00 0.00 175.26 175.88 2di8 s HIS 88 N 2.51 3.52 0.91 1.61 3.76 -1.26 -0.42 115.29 125.92 2di8 s HIS 88 Ca -0.07 1.58 -0.13 0.00 -0.15 0.00 0.00 55.06 56.30 2di8 s HIS 88 Cb -0.09 -3.34 0.05 0.00 1.11 0.00 0.00 32.58 30.31 2di8 s HIS 88 CO -0.19 -0.80 0.62 1.33 -0.85 0.00 0.00 174.74 174.85 2di8 n VAL 89 N 1.90 0.37 -2.06 -0.90 0.24 -1.04 -4.77 118.33 112.08 2di8 n VAL 89 Ca 0.02 -0.18 -0.27 0.00 -2.04 0.00 0.00 64.34 61.86 2di8 n VAL 89 Cb 0.45 -0.75 -0.05 0.00 -1.47 0.00 0.00 33.84 32.02 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 -3.76 2.53 0.00 7.34 0.04 -1.26 -2.16 135.00 137.74 2di8 s PRO 90 Ca 0.61 -0.66 0.00 0.00 0.04 0.00 0.00 61.00 60.99 2di8 s PRO 90 Cb -0.24 -5.14 0.00 0.00 0.04 0.00 0.00 34.50 29.16 2di8 s PRO 90 CO 0.63 -3.63 0.00 0.41 0.04 0.00 0.00 177.00 174.45 2di8 n GLY 91 N 6.42 -0.54 3.89 0.56 0.00 -1.26 -5.13 105.19 109.12 2di8 n GLY 91 Ca 0.42 0.00 -0.29 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 6.12 0.44 1.61 0.01 -0.92 -4.26 113.70 116.70 2di8 s SER 92 Ca 0.00 1.16 -0.24 0.00 1.31 0.00 0.00 55.95 58.18 2di8 s SER 92 Cb 0.00 -2.28 -0.08 0.00 0.21 0.00 0.00 66.02 63.88 2di8 s SER 92 CO 0.00 -0.82 1.17 -2.16 0.41 0.00 0.00 173.24 171.84 2di8 s PRO 93 N -5.02 3.84 -0.39 12.44 0.04 -1.26 -4.98 135.00 139.67 2di8 s PRO 93 Ca 0.52 1.81 -0.29 0.00 0.04 0.00 0.00 61.00 63.09 2di8 s PRO 93 Cb -0.11 -2.49 0.02 0.00 0.04 0.00 0.00 34.50 31.96 2di8 s PRO 93 CO 0.50 -0.49 1.23 -0.06 0.04 0.00 0.00 177.00 178.21 2di8 s PHE 94 N -1.50 2.75 -0.38 0.56 0.40 -1.00 -4.88 117.98 113.94 2di8 s PHE 94 Ca 0.62 0.83 -0.20 0.00 -0.60 0.00 0.00 56.93 57.58 2di8 s PHE 94 Cb -0.30 -4.14 0.01 0.00 0.51 0.00 0.00 43.02 39.10 2di8 s PHE 94 CO 0.36 -1.44 0.61 0.99 0.70 0.00 0.00 175.22 176.44 2di8 s THR 95 N 4.51 4.90 -0.30 0.64 2.01 -1.26 -0.27 115.64 125.86 2di8 s THR 95 Ca 0.52 0.37 -0.08 0.00 0.31 0.00 0.00 61.69 62.82 2di8 s THR 95 Cb -0.12 -4.10 0.00 0.00 0.01 0.00 0.00 72.50 68.30 2di8 s THR 95 CO 0.27 -0.39 0.10 -0.69 -0.69 0.00 0.00 174.62 173.22 2di8 s VAL 96 N 2.68 4.15 -0.25 3.82 1.01 -0.48 -4.77 120.40 126.55 2di8 s VAL 96 Ca 0.22 -0.58 -0.22 0.00 0.00 0.00 0.00 61.98 61.40 2di8 s VAL 96 Cb -0.15 -3.12 -0.01 0.00 0.00 0.00 0.00 36.38 33.10 2di8 s VAL 96 CO 0.16 0.10 0.71 -0.54 0.00 0.00 0.00 175.10 175.53 2di8 s LYS 97 N 1.54 4.12 -0.11 2.72 1.02 -1.16 -1.73 119.74 126.15 2di8 s LYS 97 Ca 0.03 0.70 -0.13 0.00 0.02 0.00 0.00 55.97 56.59 2di8 s LYS 97 Cb -0.17 -3.65 -0.05 0.00 -0.52 0.00 0.00 37.83 33.44 2di8 s LYS 97 CO 0.03 -0.47 0.30 0.42 -0.92 0.00 0.00 175.35 174.71 2di8 s ILE 98 N 2.66 5.27 0.00 2.17 -1.09 -0.98 -3.30 121.20 125.93 2di8 s ILE 98 Ca 0.30 0.56 -0.01 0.00 -2.23 0.00 0.00 60.65 59.27 2di8 s ILE 98 Cb -0.15 -3.61 -0.01 0.00 -1.58 0.00 0.00 42.46 37.11 2di8 s ILE 98 CO 0.08 0.48 0.79 0.28 -1.23 0.00 0.00 174.94 175.34 2di8 h SER 99 N 5.87 -0.03 0.00 3.58 0.02 -1.87 -3.30 113.55 117.82 2di8 h SER 99 Ca -0.46 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.49 2di8 h SER 99 Cb 1.19 0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.74 2di8 h SER 99 CO 0.69 -0.02 0.00 0.61 -1.14 0.00 0.00 176.83 176.97 2di8 n GLY 100 N -0.34 2.23 3.84 -3.77 0.00 -1.26 -4.81 105.19 101.09 2di8 n GLY 100 Ca -0.00 -0.67 -0.32 0.00 0.00 0.00 0.00 46.02 45.03 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 0.00 3.99 0.00 1.61 2.02 -1.26 -4.64 118.70 120.42 2di8 s GLU 101 Ca 0.00 0.84 0.00 0.00 0.02 0.00 0.00 54.97 55.83 2di8 s GLU 101 Cb 0.00 -2.25 0.00 0.00 0.10 0.00 0.00 34.13 31.98 2di8 s GLU 101 CO 0.00 -0.08 0.00 0.41 0.02 0.00 0.00 175.26 175.61 2di8 n GLY 102 N -1.06 -0.84 2.85 -1.39 0.00 -1.26 -5.04 105.19 98.44 2di8 n GLY 102 Ca 0.05 -0.66 -0.29 0.00 0.00 0.00 0.00 46.02 45.12 2di8 n GLY 102 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2di8 s ARG 103 N -0.19 1.18 0.36 1.61 3.00 -1.26 -5.02 118.95 118.63 2di8 s ARG 103 Ca 0.00 -0.75 -0.28 0.00 0.00 0.00 0.00 55.73 54.70 2di8 s ARG 103 Cb 0.00 -2.37 -0.11 0.00 0.00 0.00 0.00 34.95 32.47 2di8 s ARG 103 CO 0.00 -0.63 1.50 0.54 0.00 0.00 0.00 175.30 176.71 2di8 s VAL 104 N 1.60 2.07 -0.21 3.52 0.11 -1.26 -4.96 120.40 121.27 2di8 s VAL 104 Ca -0.03 0.07 -0.21 0.00 -2.93 0.00 0.00 61.98 58.87 2di8 s VAL 104 Cb -0.18 -3.05 -0.02 0.00 -1.53 0.00 0.00 36.38 31.60 2di8 s VAL 104 CO -0.07 0.02 0.67 -1.59 -3.33 0.00 0.00 175.10 170.79 2di8 s LYS 105 N -1.88 4.19 -0.28 1.54 -2.85 -1.26 -5.03 119.74 114.18 2di8 s LYS 105 Ca 0.54 0.67 -0.22 0.00 -1.00 0.00 0.00 55.97 55.96 2di8 s LYS 105 Cb -0.46 -3.60 0.11 0.00 -2.06 0.00 0.00 37.83 31.82 2di8 s LYS 105 CO 0.61 -0.31 0.90 0.45 0.10 0.00 0.00 175.35 177.10 2di8 s SER 106 N 1.27 -0.60 0.00 0.03 0.15 -1.26 -5.14 113.70 108.15 2di8 s SER 106 Ca 0.30 1.07 0.00 0.00 0.70 0.00 0.00 55.95 58.02 2di8 s SER 106 Cb -0.16 1.15 0.00 0.00 -1.71 0.00 0.00 66.02 65.30 2di8 s SER 106 CO 0.10 -0.18 0.00 0.61 1.20 0.00 0.00 173.24 174.97 2di8 n GLY 107 N 2.98 -1.15 3.64 9.45 0.00 -1.26 -5.13 105.19 113.72 2di8 n GLY 107 Ca -0.15 0.92 -0.43 0.00 0.00 0.00 0.00 46.02 46.36 2di8 n GLY 107 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2di8 s PRO 108 N 0.00 3.99 0.83 1.61 0.04 -1.26 -5.01 135.00 135.20 2di8 s PRO 108 Ca 0.00 1.83 -0.07 0.00 0.04 0.00 0.00 61.00 62.80 2di8 s PRO 108 Cb 0.00 -3.97 0.16 0.00 0.04 0.00 0.00 34.50 30.73 2di8 s PRO 108 CO 0.00 -1.05 1.15 -1.12 0.04 0.00 0.00 177.00 176.02 2di8 s SER 109 N 3.57 3.76 0.35 6.66 0.01 -1.26 -5.12 113.70 121.66 2di8 s SER 109 Ca 0.69 -0.11 0.05 0.00 1.31 0.00 0.00 55.95 57.89 2di8 s SER 109 Cb -0.27 -0.10 -0.03 0.00 0.21 0.00 0.00 66.02 65.83 2di8 s SER 109 CO 0.27 -2.28 0.19 -0.44 0.41 0.00 0.00 173.24 171.39 2di8 s SER 110 N -4.82 1.96 0.00 2.44 0.01 -1.26 -5.36 113.70 106.67 2di8 s SER 110 Ca 0.70 -1.66 0.00 0.00 1.31 0.00 0.00 55.95 56.30 2di8 s SER 110 Cb -0.04 0.49 0.00 0.00 0.21 0.00 0.00 66.02 66.68 2di8 s SER 110 CO 0.48 -0.96 0.00 0.61 0.41 0.00 0.00 173.24 173.78