#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d8i n SER 2 N 0.00 5.42 -2.53 1.61 7.64 -1.26 -4.83 113.62 119.66 2d8i n SER 2 Ca 0.00 -3.06 -0.23 0.00 1.01 0.00 0.00 58.87 56.59 2d8i n SER 2 Cb 0.00 -1.49 -0.11 0.00 -1.01 0.00 0.00 64.21 61.60 2d8i n SER 2 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2d8i n SER 3 N 3.88 6.66 -4.54 6.43 2.88 -1.26 -4.86 113.62 122.81 2d8i n SER 3 Ca 0.46 -2.51 -0.28 0.00 -1.33 0.00 0.00 58.87 55.20 2d8i n SER 3 Cb 0.35 -1.47 -0.09 0.00 -0.75 0.00 0.00 64.21 62.24 2d8i n SER 3 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2d8i s GLY 4 N 2.07 2.67 -0.12 0.46 0.00 -1.26 -5.08 107.32 106.06 2d8i s GLY 4 Ca 0.68 -1.27 -0.16 0.00 0.00 0.00 0.00 44.72 43.97 2d8i s GLY 4 CO -0.02 -2.03 0.41 0.23 0.00 0.00 0.00 173.10 171.69 2d8i h SER 5 N 1.66 0.00 -2.71 1.64 0.87 -2.05 -3.46 113.55 109.50 2d8i h SER 5 Ca -0.42 -0.54 -0.67 0.00 -1.23 0.00 0.00 61.79 58.94 2d8i h SER 5 Cb 1.28 0.00 -0.07 0.00 -0.44 0.00 0.00 62.40 63.17 2d8i h SER 5 CO 0.71 0.79 -0.49 -0.94 -0.53 0.00 0.00 176.83 176.37 2d8i s SER 6 N -5.93 6.31 0.00 6.23 1.04 -1.26 -5.08 113.70 115.00 2d8i s SER 6 Ca -0.11 0.43 0.00 0.00 0.48 0.00 0.00 55.95 56.75 2d8i s SER 6 Cb -0.01 -2.02 0.00 0.00 0.10 0.00 0.00 66.02 64.09 2d8i s SER 6 CO 0.38 0.38 0.00 0.61 0.98 0.00 0.00 173.24 175.59 2d8i n GLY 7 N 1.81 2.87 2.67 7.32 0.00 -1.26 -5.10 105.19 113.51 2d8i n GLY 7 Ca -0.18 -1.04 -0.20 0.00 0.00 0.00 0.00 46.02 44.60 2d8i n GLY 7 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2d8i n GLU 8 N 0.00 0.98 -1.48 1.61 1.02 -1.26 -5.00 120.64 116.52 2d8i n GLU 8 Ca 0.00 -2.51 -0.49 0.00 -0.02 0.00 0.00 57.16 54.14 2d8i n GLU 8 Cb 0.00 0.41 -0.03 0.00 -0.02 0.00 0.00 31.44 31.79 2d8i n GLU 8 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 2d8i n ILE 9 N -1.25 1.62 -4.27 -3.67 5.41 -1.26 -4.97 119.36 110.97 2d8i n ILE 9 Ca -0.06 -0.41 -0.24 0.00 1.00 0.00 0.00 62.75 63.05 2d8i n ILE 9 Cb 0.45 -0.33 -0.07 0.00 -0.71 0.00 0.00 39.64 38.97 2d8i n ILE 9 CO 0.00 0.00 0.00 -0.70 0.00 0.00 0.00 176.55 175.85 2d8i s GLU 10 N -0.93 2.32 0.46 0.38 2.12 -1.26 -4.99 118.70 116.80 2d8i s GLU 10 Ca 0.67 -1.32 0.35 0.00 0.36 0.00 0.00 54.97 55.02 2d8i s GLU 10 Cb -0.91 -2.22 1.52 0.00 0.26 0.00 0.00 34.13 32.79 2d8i s GLU 10 CO 0.56 0.39 1.59 0.82 -0.54 0.00 0.00 175.26 178.09 2d8i h ILE 11 N 2.08 0.04 -1.99 -3.70 5.03 -2.06 -3.40 117.51 113.50 2d8i h ILE 11 Ca -0.45 -0.01 -0.63 0.00 -0.12 0.00 0.00 64.86 63.65 2d8i h ILE 11 Cb 1.23 0.01 0.05 0.00 -3.03 0.00 0.00 36.82 35.09 2d8i h ILE 11 CO 0.59 0.00 0.65 0.00 -0.68 0.00 0.00 178.15 178.71 2d8i n PRO 13 N 3.08 -0.23 -0.87 0.00 -0.04 -1.26 -4.98 135.00 130.70 2d8i n PRO 13 Ca 0.18 0.00 -0.36 0.00 -0.04 0.00 0.00 63.50 63.28 2d8i n PRO 13 Cb 0.24 0.00 0.09 0.00 -0.04 0.00 0.00 33.50 33.79 2d8i n PRO 13 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2d8i n LYS 14 N -0.92 -0.55 -4.48 0.54 5.02 -1.26 -4.87 118.16 111.64 2d8i n LYS 14 Ca 0.00 -0.15 -0.24 0.00 -2.02 0.00 0.00 58.31 55.90 2d8i n LYS 14 Cb 0.00 -1.30 -0.10 0.00 -0.02 0.00 0.00 35.03 33.61 2d8i n LYS 14 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 2d8i s VAL 15 N -2.11 2.38 -0.18 -0.18 -7.23 0.69 -4.93 120.40 108.83 2d8i s VAL 15 Ca 0.45 -2.35 -0.06 0.00 -1.81 0.00 0.00 61.98 58.21 2d8i s VAL 15 Cb -0.03 -2.37 -0.03 0.00 0.56 0.00 0.00 36.38 34.50 2d8i s VAL 15 CO 0.69 -0.36 0.03 0.42 -0.31 0.00 0.00 175.10 175.56 2d8i s THR 16 N -2.56 4.38 0.04 5.32 -4.23 -1.26 -0.68 115.64 116.66 2d8i s THR 16 Ca 0.30 -0.18 0.08 0.00 -1.18 0.00 0.00 61.69 60.72 2d8i s THR 16 Cb -0.03 -2.97 -0.03 0.00 1.34 0.00 0.00 72.50 70.81 2d8i s THR 16 CO 0.15 0.45 -0.21 0.00 -0.54 0.00 0.00 174.62 174.47 2d8i s GLN 17 N 0.58 1.97 -0.27 3.99 -2.07 -0.51 -5.00 119.66 118.35 2d8i s GLN 17 Ca 0.01 -1.03 -0.10 0.00 -1.82 0.00 0.00 55.36 52.43 2d8i s GLN 17 Cb -0.13 -2.11 -0.04 0.00 -1.09 0.00 0.00 33.01 29.63 2d8i s GLN 17 CO 0.02 0.53 0.15 -1.54 -1.32 0.00 0.00 175.29 173.12 2d8i s SER 18 N -1.35 5.67 -0.47 12.60 1.04 -1.26 -2.76 113.70 127.17 2d8i s SER 18 Ca 0.13 -0.12 -0.12 0.00 0.48 0.00 0.00 55.95 56.32 2d8i s SER 18 Cb -0.10 -2.04 0.10 0.00 0.10 0.00 0.00 66.02 64.07 2d8i s SER 18 CO 0.04 -0.06 0.37 -0.63 0.98 0.00 0.00 173.24 173.94 2d8i s ILE 19 N 1.70 4.72 -0.57 -1.02 1.09 -0.85 -5.00 121.20 121.27 2d8i s ILE 19 Ca 0.07 -1.42 -0.20 0.00 -1.10 0.00 0.00 60.65 58.00 2d8i s ILE 19 Cb -0.16 -3.95 0.08 0.00 -1.06 0.00 0.00 42.46 37.37 2d8i s ILE 19 CO 0.08 -0.67 0.73 -1.38 -0.10 0.00 0.00 174.94 173.60 2d8i s HIS 20 N 1.51 2.95 -0.19 3.97 -3.43 -1.26 -2.61 115.29 116.23 2d8i s HIS 20 Ca 0.04 -0.71 -0.09 0.00 -0.80 0.00 0.00 55.06 53.50 2d8i s HIS 20 Cb -0.26 -3.92 -0.05 0.00 -1.43 0.00 0.00 32.58 26.93 2d8i s HIS 20 CO 0.03 -1.28 0.11 0.42 -2.00 0.00 0.00 174.74 172.03 2d8i s ILE 21 N 2.96 5.24 -0.01 -5.38 1.01 -0.61 -4.98 121.20 119.43 2d8i s ILE 21 Ca 0.15 0.13 0.05 0.00 0.00 0.00 0.00 60.65 60.99 2d8i s ILE 21 Cb -0.21 -3.38 -0.01 0.00 0.01 0.00 0.00 42.46 38.87 2d8i s ILE 21 CO 0.09 0.46 -0.18 -0.70 0.00 0.00 0.00 174.94 174.62 2d8i s GLU 22 N 0.26 1.42 0.14 2.79 2.12 -1.26 -0.89 118.70 123.28 2d8i s GLU 22 Ca 0.07 -0.64 0.10 0.00 0.36 0.00 0.00 54.97 54.85 2d8i s GLU 22 Cb -0.11 -1.38 -0.04 0.00 0.26 0.00 0.00 34.13 32.86 2d8i s GLU 22 CO -0.01 0.38 -0.22 0.15 -0.54 0.00 0.00 175.26 175.01 2d8i s LYS 23 N -0.46 1.30 -0.10 4.30 1.02 0.47 -4.94 119.74 121.33 2d8i s LYS 23 Ca 0.07 -1.34 -0.17 0.00 0.02 0.00 0.00 55.97 54.56 2d8i s LYS 23 Cb -0.07 -1.57 -0.28 0.00 -0.52 0.00 0.00 37.83 35.39 2d8i s LYS 23 CO -0.01 0.35 0.60 0.77 -0.92 0.00 0.00 175.35 176.14 2d8i h SER 24 N 3.65 0.39 -3.36 2.83 0.02 -1.91 -3.44 113.55 111.73 2d8i h SER 24 Ca -0.46 -0.86 -0.26 0.00 -0.84 0.00 0.00 61.79 59.36 2d8i h SER 24 Cb 1.19 -0.13 -0.33 0.00 0.14 0.00 0.00 62.40 63.27 2d8i h SER 24 CO 0.44 1.59 -0.62 -0.62 -1.14 0.00 0.00 176.83 176.48 2d8i s ASP 25 N -7.03 0.12 0.23 3.07 2.15 -1.26 -5.02 116.67 108.92 2d8i s ASP 25 Ca -0.19 0.28 0.15 0.00 0.43 0.00 0.00 52.55 53.22 2d8i s ASP 25 Cb 0.04 0.18 0.01 0.00 -0.30 0.00 0.00 42.92 42.84 2d8i s ASP 25 CO 0.77 -0.17 1.33 0.71 -0.17 0.00 0.00 175.17 177.64 2d8i h THR 26 N 6.16 0.87 -0.47 1.71 1.35 -1.91 -2.08 112.91 118.54 2d8i h THR 26 Ca -0.36 -2.28 -0.05 0.00 -0.55 0.00 0.00 66.41 63.17 2d8i h THR 26 Cb 1.13 2.39 -0.02 0.00 -1.73 0.00 0.00 68.15 69.92 2d8i h THR 26 CO 0.36 0.50 0.10 0.00 -0.25 0.00 0.00 175.52 176.22 2d8i h ALA 27 N 1.45 1.28 -0.83 6.62 0.00 -1.98 -3.39 119.26 122.41 2d8i h ALA 27 Ca -0.03 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.68 2d8i h ALA 27 Cb 1.45 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 19.04 2d8i h ALA 27 CO 0.07 0.50 0.00 0.00 0.00 0.00 0.00 179.25 179.82 2d8i n ALA 28 N -2.47 0.14 -2.68 0.00 0.00 -1.24 -4.95 120.51 109.31 2d8i n ALA 28 Ca 0.03 -0.17 -0.43 0.00 0.00 0.00 0.00 53.44 52.87 2d8i n ALA 28 Cb 0.22 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.65 2d8i n ALA 28 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2d8i s ASP 29 N -3.18 7.22 -0.03 0.00 1.11 -0.78 -5.04 116.67 115.97 2d8i s ASP 29 Ca 0.00 1.52 0.05 0.00 0.18 0.00 0.00 52.55 54.30 2d8i s ASP 29 Cb 0.00 -2.55 -0.01 0.00 1.07 0.00 0.00 42.92 41.43 2d8i s ASP 29 CO 0.00 -0.48 -0.19 0.28 1.18 0.00 0.00 175.17 175.96 2d8i s THR 30 N 2.19 1.56 0.27 -1.27 -1.32 -1.26 -3.90 115.64 111.91 2d8i s THR 30 Ca 0.48 -0.82 0.10 0.00 -1.21 0.00 0.00 61.69 60.25 2d8i s THR 30 Cb -0.18 -1.32 0.30 0.00 -1.51 0.00 0.00 72.50 69.79 2d8i s THR 30 CO 0.16 0.44 1.25 -1.22 -2.21 0.00 0.00 174.62 173.05 2d8i n TYR 31 N 2.89 0.75 0.00 9.09 4.01 -1.26 -4.71 117.16 127.93 2d8i n TYR 31 Ca -0.17 0.94 0.00 0.00 -0.16 0.00 0.00 57.90 58.52 2d8i n TYR 31 Cb 0.53 -1.25 0.00 0.00 -0.31 0.00 0.00 39.34 38.31 2d8i n TYR 31 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2d8i n GLY 32 N -1.28 3.00 3.68 2.72 0.00 -1.26 -3.97 105.19 108.07 2d8i n GLY 32 Ca 0.25 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.93 2d8i n GLY 32 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2d8i s PHE 33 N -1.39 3.32 0.51 1.61 -0.12 -1.26 -4.11 117.98 116.55 2d8i s PHE 33 Ca 0.00 0.19 0.07 0.00 -0.05 0.00 0.00 56.93 57.14 2d8i s PHE 33 Cb 0.00 -2.11 0.03 0.00 -0.63 0.00 0.00 43.02 40.31 2d8i s PHE 33 CO 0.00 0.22 0.47 -1.12 -0.05 0.00 0.00 175.22 174.73 2d8i s SER 34 N 0.35 4.82 -0.04 1.98 0.01 -1.17 -4.98 113.70 114.67 2d8i s SER 34 Ca 0.05 -1.04 0.03 0.00 1.31 0.00 0.00 55.95 56.30 2d8i s SER 34 Cb -0.12 0.12 0.00 0.00 0.21 0.00 0.00 66.02 66.24 2d8i s SER 34 CO -0.01 -1.02 -0.11 -0.76 0.41 0.00 0.00 173.24 171.75 2d8i s LEU 35 N -4.31 1.76 -0.09 2.44 1.43 -1.26 -2.87 118.68 115.78 2d8i s LEU 35 Ca 0.43 -0.23 0.02 0.00 -1.03 0.00 0.00 54.13 53.31 2d8i s LEU 35 Cb -0.03 -0.67 -0.02 0.00 0.03 0.00 0.00 46.19 45.50 2d8i s LEU 35 CO 0.26 0.07 -0.13 -0.55 0.23 0.00 0.00 176.35 176.23 2d8i s SER 36 N 0.27 4.04 0.02 2.29 0.15 0.50 -4.88 113.70 116.09 2d8i s SER 36 Ca -0.05 -0.26 -0.18 0.00 0.70 0.00 0.00 55.95 56.16 2d8i s SER 36 Cb -0.11 -1.25 -0.06 0.00 -1.71 0.00 0.00 66.02 62.89 2d8i s SER 36 CO 0.01 0.25 0.50 -0.94 1.20 0.00 0.00 173.24 174.27 2d8i s SER 37 N -0.17 6.93 -0.05 5.45 1.04 -1.26 -0.70 113.70 124.94 2d8i s SER 37 Ca -0.00 1.11 -0.02 0.00 0.48 0.00 0.00 55.95 57.51 2d8i s SER 37 Cb -0.13 -2.31 0.04 0.00 0.10 0.00 0.00 66.02 63.71 2d8i s SER 37 CO 0.03 0.26 0.09 -0.69 0.98 0.00 0.00 173.24 173.91 2d8i s VAL 38 N -0.88 -0.15 -0.24 5.02 1.01 0.86 -4.98 120.40 121.04 2d8i s VAL 38 Ca 0.27 0.40 -0.18 0.00 0.00 0.00 0.00 61.98 62.47 2d8i s VAL 38 Cb -0.18 -0.19 -0.03 0.00 0.00 0.00 0.00 36.38 35.98 2d8i s VAL 38 CO 0.16 0.17 0.49 -0.70 0.00 0.00 0.00 175.10 175.22 2d8i s GLU 39 N 2.15 4.11 -0.27 2.72 2.12 -1.26 -1.31 118.70 126.94 2d8i s GLU 39 Ca 0.04 0.30 0.00 0.00 0.36 0.00 0.00 54.97 55.68 2d8i s GLU 39 Cb -0.12 -3.62 0.08 0.00 0.26 0.00 0.00 34.13 30.73 2d8i s GLU 39 CO -0.04 -0.26 0.03 -2.00 -0.54 0.00 0.00 175.26 172.45 2d8i s GLU 40 N 2.01 1.18 -1.19 4.30 2.12 0.58 -4.77 118.70 122.93 2d8i s GLU 40 Ca 0.21 -1.11 -0.04 0.00 0.36 0.00 0.00 54.97 54.38 2d8i s GLU 40 Cb -0.15 -2.44 0.00 0.00 0.26 0.00 0.00 34.13 31.80 2d8i s GLU 40 CO 0.09 -0.80 0.59 -3.47 -0.54 0.00 0.00 175.26 171.13 2d8i n ASP 41 N 4.70 -5.24 0.00 -1.70 -0.08 -1.26 -2.21 116.55 110.76 2d8i n ASP 41 Ca -0.05 -0.27 0.00 0.00 -1.51 0.00 0.00 54.79 52.95 2d8i n ASP 41 Cb 0.43 -4.03 0.00 0.00 2.34 0.00 0.00 41.12 39.86 2d8i n ASP 41 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2d8i n GLY 42 N -1.44 2.81 3.63 0.27 0.00 -1.26 -5.00 105.19 104.20 2d8i n GLY 42 Ca -0.07 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.52 2d8i n GLY 42 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2d8i s ILE 43 N -1.87 4.37 -0.21 -0.61 1.01 -0.94 -5.01 121.20 117.94 2d8i s ILE 43 Ca 0.00 1.55 -0.15 0.00 0.00 0.00 0.00 60.65 62.05 2d8i s ILE 43 Cb 0.00 -4.36 -0.04 0.00 0.01 0.00 0.00 42.46 38.06 2d8i s ILE 43 CO 0.00 -0.54 0.35 -0.60 0.00 0.00 0.00 174.94 174.14 2d8i s ARG 44 N 3.89 4.16 0.29 2.79 3.00 -1.26 -0.31 118.95 131.52 2d8i s ARG 44 Ca 0.49 0.10 0.03 0.00 -1.00 0.00 0.00 55.73 55.35 2d8i s ARG 44 Cb -0.13 -3.53 -0.06 0.00 0.00 0.00 0.00 34.95 31.23 2d8i s ARG 44 CO 0.19 -0.00 0.05 1.03 0.00 0.00 0.00 175.30 176.58 2d8i s ARG 45 N 1.20 1.54 0.24 5.12 0.52 -0.43 -3.94 118.95 123.20 2d8i s ARG 45 Ca 0.17 -1.83 0.11 0.00 -0.52 0.00 0.00 55.73 53.65 2d8i s ARG 45 Cb -0.14 -0.69 -0.05 0.00 0.52 0.00 0.00 34.95 34.59 2d8i s ARG 45 CO 0.07 -0.19 -0.17 -0.51 0.02 0.00 0.00 175.30 174.52 2d8i s LEU 46 N -3.41 2.67 -0.01 2.53 2.01 -1.26 -0.10 118.68 121.11 2d8i s LEU 46 Ca 0.35 -0.88 -0.08 0.00 0.01 0.00 0.00 54.13 53.53 2d8i s LEU 46 Cb 0.08 -1.27 0.01 0.00 0.01 0.00 0.00 46.19 45.02 2d8i s LEU 46 CO 0.14 0.07 0.17 -0.31 1.01 0.00 0.00 176.35 177.42 2d8i s TYR 47 N -2.14 -0.03 -0.89 0.29 2.02 0.13 -3.15 117.35 113.57 2d8i s TYR 47 Ca 0.27 0.02 -0.25 0.00 -0.37 0.00 0.00 57.07 56.74 2d8i s TYR 47 Cb -0.06 -0.01 0.03 0.00 -0.40 0.00 0.00 41.96 41.52 2d8i s TYR 47 CO 0.14 -0.27 1.45 0.08 -1.57 0.00 0.00 175.55 175.38 2d8i s VAL 48 N -1.15 3.78 0.12 0.71 1.01 -0.91 -0.37 120.40 123.59 2d8i s VAL 48 Ca -0.12 -0.27 -0.28 0.00 0.00 0.00 0.00 61.98 61.31 2d8i s VAL 48 Cb -0.06 -4.87 -0.08 0.00 0.00 0.00 0.00 36.38 31.36 2d8i s VAL 48 CO 0.02 -1.78 1.61 -1.13 0.00 0.00 0.00 175.10 173.82 2d8i h ASN 49 N 10.26 -0.97 -5.61 3.32 -0.73 -1.88 0.11 115.58 120.07 2d8i h ASN 49 Ca -0.00 0.11 -0.26 0.00 1.87 0.00 0.00 56.30 58.02 2d8i h ASN 49 Cb 1.03 0.37 -0.15 0.00 0.27 0.00 0.00 38.32 39.85 2d8i h ASN 49 CO 1.35 -0.42 -0.60 -0.55 -0.37 0.00 0.00 177.43 176.85 2d8i s SER 50 N -4.77 0.30 -0.00 1.15 0.15 -1.26 -4.60 113.70 104.66 2d8i s SER 50 Ca -0.16 -1.42 -0.12 0.00 0.70 0.00 0.00 55.95 54.95 2d8i s SER 50 Cb 0.08 0.40 0.02 0.00 -1.71 0.00 0.00 66.02 64.81 2d8i s SER 50 CO 0.64 -0.87 0.25 -0.69 1.20 0.00 0.00 173.24 173.78 2d8i s VAL 51 N -4.09 0.07 -0.18 4.45 1.01 -1.26 -3.05 120.40 117.36 2d8i s VAL 51 Ca 0.39 -0.57 -0.29 0.00 0.00 0.00 0.00 61.98 61.50 2d8i s VAL 51 Cb 0.06 -0.59 -0.03 0.00 0.00 0.00 0.00 36.38 35.82 2d8i s VAL 51 CO 0.13 -0.32 1.57 -0.75 0.00 0.00 0.00 175.10 175.74 2d8i s LYS 52 N -1.47 3.95 0.36 2.72 2.20 -1.25 -4.84 119.74 121.40 2d8i s LYS 52 Ca -0.13 1.78 0.07 0.00 -0.36 0.00 0.00 55.97 57.33 2d8i s LYS 52 Cb -0.06 -3.98 0.78 0.00 -1.51 0.00 0.00 37.83 33.06 2d8i s LYS 52 CO 0.03 -1.10 1.91 1.05 -0.36 0.00 0.00 175.35 176.88 2d8i h GLU 53 N 10.07 0.71 -2.21 4.03 9.09 -1.95 -3.04 114.58 131.27 2d8i h GLU 53 Ca -0.34 -0.04 -0.57 0.00 0.05 0.00 0.00 59.36 58.46 2d8i h GLU 53 Cb 1.15 -0.16 -0.42 0.00 -1.65 0.00 0.00 28.75 27.68 2d8i h GLU 53 CO 0.99 0.47 -0.75 -2.37 0.05 0.00 0.00 179.01 177.39 2d8i n THR 54 N -4.51 2.23 -2.59 -1.06 5.66 -1.26 -4.92 114.28 107.83 2d8i n THR 54 Ca 0.14 -5.29 0.00 0.00 -3.05 0.00 0.00 64.05 55.85 2d8i n THR 54 Cb 0.35 -1.33 0.00 0.00 -1.55 0.00 0.00 70.33 67.79 2d8i n THR 54 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2d8i n GLY 55 N 0.09 5.81 0.07 1.09 0.00 -1.15 -5.10 105.19 106.01 2d8i n GLY 55 Ca 0.29 -1.54 -0.08 0.00 0.00 0.00 0.00 46.02 44.70 2d8i n GLY 55 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2d8i h LEU 56 N 0.00 0.00 0.00 0.99 3.38 -1.86 -3.34 115.31 114.48 2d8i h LEU 56 Ca 0.00 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.83 2d8i h LEU 56 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 2d8i h LEU 56 CO 0.00 0.87 0.00 0.00 0.09 0.00 0.00 178.44 179.40 2d8i n ALA 57 N -3.44 0.00 -0.36 1.53 0.00 -1.26 -0.62 120.51 116.36 2d8i n ALA 57 Ca -0.11 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.28 2d8i n ALA 57 Cb 0.32 0.40 -0.01 0.00 0.00 0.00 0.00 19.45 20.15 2d8i n ALA 57 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2d8i h SER 58 N 0.00 -1.66 -0.19 0.00 0.87 -1.76 -0.20 113.55 110.60 2d8i h SER 58 Ca 0.00 0.31 0.04 0.00 -1.23 0.00 0.00 61.79 60.90 2d8i h SER 58 Cb 0.00 0.80 -0.07 0.00 -0.44 0.00 0.00 62.40 62.69 2d8i h SER 58 CO 0.00 -0.28 -0.52 0.11 -0.53 0.00 0.00 176.83 175.61 2d8i h LYS 59 N -0.04 -0.51 -0.52 2.24 1.57 -1.12 -2.42 116.57 115.78 2d8i h LYS 59 Ca 0.26 0.03 0.06 0.00 -1.87 0.00 0.00 60.65 59.14 2d8i h LYS 59 Cb 0.54 0.12 -0.09 0.00 0.08 0.00 0.00 32.23 32.87 2d8i h LYS 59 CO -0.92 -0.34 -0.53 0.87 -0.57 0.00 0.00 179.45 177.95 2d8i h LYS 60 N -0.53 -0.30 0.00 3.15 1.79 0.89 -3.45 116.57 118.12 2d8i h LYS 60 Ca 0.05 0.02 0.00 0.00 -2.18 0.00 0.00 60.65 58.54 2d8i h LYS 60 Cb 0.66 0.07 0.00 0.00 -1.58 0.00 0.00 32.23 31.38 2d8i h LYS 60 CO -0.47 -0.20 0.00 0.41 -1.08 0.00 0.00 179.45 178.11 2d8i n GLY 61 N -1.37 0.09 3.24 3.86 0.00 -0.65 -5.11 105.19 105.26 2d8i n GLY 61 Ca -0.02 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.66 2d8i n GLY 61 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2d8i n LEU 62 N 0.00 -2.46 -3.59 0.99 4.77 -1.09 -4.91 117.00 110.70 2d8i n LEU 62 Ca 0.00 0.20 -0.09 0.00 -0.03 0.00 0.00 56.01 56.09 2d8i n LEU 62 Cb 0.00 -0.99 -0.05 0.00 -2.33 0.00 0.00 43.42 40.05 2d8i n LEU 62 CO 0.00 -4.23 0.84 -0.75 -1.33 0.00 0.00 177.39 171.93 2d8i s LYS 63 N -3.00 0.49 -0.30 3.23 2.47 -1.26 -4.23 119.74 117.14 2d8i s LYS 63 Ca 0.50 0.15 -0.34 0.00 -1.56 0.00 0.00 55.97 54.73 2d8i s LYS 63 Cb -0.17 0.23 -0.10 0.00 -1.46 0.00 0.00 37.83 36.34 2d8i s LYS 63 CO 0.72 -0.15 2.17 0.00 0.16 0.00 0.00 175.35 178.26 2d8i n ALA 64 N 0.81 1.22 0.00 3.13 0.00 -1.26 -0.75 120.51 123.67 2d8i n ALA 64 Ca -0.09 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.27 2d8i n ALA 64 Cb 0.58 -2.63 0.00 0.00 0.00 0.00 0.00 19.45 17.40 2d8i n ALA 64 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2d8i n GLY 65 N 6.20 2.18 3.60 0.00 0.00 0.37 -5.00 105.19 112.54 2d8i n GLY 65 Ca 0.37 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.95 2d8i n GLY 65 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2d8i n ASP 66 N 0.00 1.42 -4.54 1.61 9.92 0.07 -4.59 116.55 120.44 2d8i n ASP 66 Ca 0.00 1.17 -0.41 0.00 -0.53 0.00 0.00 54.79 55.02 2d8i n ASP 66 Cb 0.00 -1.31 -0.10 0.00 -0.64 0.00 0.00 41.12 39.07 2d8i n ASP 66 CO 0.00 0.00 0.00 -0.70 0.13 0.00 0.00 177.20 176.63 2d8i s GLU 67 N -1.62 3.54 0.14 -1.24 2.56 -1.26 -2.14 118.70 118.68 2d8i s GLU 67 Ca 0.59 -0.50 -0.30 0.00 0.00 0.00 0.00 54.97 54.75 2d8i s GLU 67 Cb -0.67 -3.80 -0.07 0.00 2.00 0.00 0.00 34.13 31.58 2d8i s GLU 67 CO 0.60 -0.49 0.97 0.42 -0.56 0.00 0.00 175.26 176.20 2d8i s ILE 68 N 1.90 4.34 -0.19 -3.70 -1.09 -1.19 -4.31 121.20 116.97 2d8i s ILE 68 Ca 0.10 2.03 -0.05 0.00 -2.23 0.00 0.00 60.65 60.50 2d8i s ILE 68 Cb -0.17 -4.29 -0.10 0.00 -1.58 0.00 0.00 42.46 36.32 2d8i s ILE 68 CO 0.11 0.35 -0.21 0.18 -1.23 0.00 0.00 174.94 174.15 2d8i n LEU 69 N 2.47 2.08 -3.94 2.97 4.77 0.36 -4.48 117.00 121.24 2d8i n LEU 69 Ca 0.01 0.09 -0.08 0.00 -0.03 0.00 0.00 56.01 56.00 2d8i n LEU 69 Cb 0.48 -0.59 -0.08 0.00 -2.33 0.00 0.00 43.42 40.90 2d8i n LEU 69 CO 0.51 0.58 -0.20 -1.61 -1.33 0.00 0.00 177.39 175.34 2d8i s GLU 70 N -2.35 0.72 -0.22 3.23 8.01 -1.24 -3.51 118.70 123.34 2d8i s GLU 70 Ca -0.26 -1.00 -0.04 0.00 0.01 0.00 0.00 54.97 53.69 2d8i s GLU 70 Cb 0.08 0.28 0.08 0.00 -4.31 0.00 0.00 34.13 30.26 2d8i s GLU 70 CO 0.37 -0.20 0.10 0.42 0.01 0.00 0.00 175.26 175.96 2d8i s ILE 71 N -3.64 0.05 -1.39 -1.63 1.01 0.07 -1.99 121.20 113.68 2d8i s ILE 71 Ca 0.04 -0.50 -0.10 0.00 0.00 0.00 0.00 60.65 60.09 2d8i s ILE 71 Cb 0.05 -0.84 0.03 0.00 0.01 0.00 0.00 42.46 41.70 2d8i s ILE 71 CO -0.09 -0.46 1.14 0.59 0.00 0.00 0.00 174.94 176.12 2d8i n ASN 72 N 5.22 -5.96 -1.55 3.58 4.13 0.02 -2.03 115.26 118.67 2d8i n ASN 72 Ca -0.07 -0.59 -0.09 0.00 1.68 0.00 0.00 54.58 55.51 2d8i n ASN 72 Cb 0.46 -4.80 0.02 0.00 -1.54 0.00 0.00 39.78 33.92 2d8i n ASN 72 CO 0.00 0.00 0.00 -3.20 0.28 0.00 0.00 177.26 174.34 2d8i n ASN 73 N -2.98 -3.56 -3.92 6.41 4.05 -1.26 -5.04 115.26 108.95 2d8i n ASN 73 Ca 0.01 -0.17 -0.16 0.00 0.45 0.00 0.00 54.58 54.71 2d8i n ASN 73 Cb 0.56 -2.26 -0.15 0.00 1.23 0.00 0.00 39.78 39.16 2d8i n ASN 73 CO 0.00 0.00 0.00 -0.13 -3.05 0.00 0.00 177.26 174.08 2d8i s ARG 74 N -5.29 0.37 -0.02 1.20 1.81 -0.86 -5.12 118.95 111.03 2d8i s ARG 74 Ca 0.18 -0.12 -0.30 0.00 -1.72 0.00 0.00 55.73 53.77 2d8i s ARG 74 Cb -0.08 -0.38 -0.05 0.00 -0.45 0.00 0.00 34.95 33.99 2d8i s ARG 74 CO 0.23 0.05 1.35 0.00 -0.68 0.00 0.00 175.30 176.25 2d8i s ALA 75 N 0.10 3.57 0.55 2.13 0.00 -1.26 -0.75 121.76 126.09 2d8i s ALA 75 Ca -0.01 0.79 0.29 0.00 0.00 0.00 0.00 51.96 53.04 2d8i s ALA 75 Cb -0.04 -3.58 1.46 0.00 0.00 0.00 0.00 23.12 20.95 2d8i s ALA 75 CO -0.00 -0.91 1.93 0.00 0.00 0.00 0.00 175.76 176.78 2d8i h ALA 76 N 7.82 2.58 -0.05 0.00 0.00 -1.91 0.31 119.26 128.01 2d8i h ALA 76 Ca -0.36 -0.02 -0.16 0.00 0.00 0.00 0.00 54.91 54.36 2d8i h ALA 76 Cb 1.17 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 19.00 2d8i h ALA 76 CO 0.90 -0.86 -0.69 -0.44 0.00 0.00 0.00 179.25 178.17 2d8i h ASP 77 N 0.00 0.28 1.83 0.00 5.19 -1.89 -3.05 116.42 118.79 2d8i h ASP 77 Ca 0.32 -0.18 -0.03 0.00 -0.62 0.00 0.00 57.03 56.51 2d8i h ASP 77 Cb 1.34 -0.08 -0.00 0.00 0.18 0.00 0.00 39.33 40.76 2d8i h ASP 77 CO -0.00 0.88 -0.15 0.00 -3.12 0.00 0.00 179.24 176.85 2d8i h ALA 78 N 1.11 0.90 -2.61 3.45 0.00 -0.78 -3.45 119.26 117.89 2d8i h ALA 78 Ca -0.02 -0.14 -0.55 0.00 0.00 0.00 0.00 54.91 54.20 2d8i h ALA 78 Cb 1.23 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.95 2d8i h ALA 78 CO 0.11 0.19 0.17 -0.51 0.00 0.00 0.00 179.25 179.21 2d8i s LEU 79 N -6.29 4.34 0.43 0.00 1.43 -0.54 -5.02 118.68 113.03 2d8i s LEU 79 Ca 0.06 1.33 0.07 0.00 -1.03 0.00 0.00 54.13 54.56 2d8i s LEU 79 Cb 0.06 -3.23 -0.04 0.00 0.03 0.00 0.00 46.19 43.01 2d8i s LEU 79 CO 0.69 -0.15 0.22 0.54 0.23 0.00 0.00 176.35 177.87 2d8i s ASN 80 N 0.84 4.51 0.22 2.29 2.20 -1.26 -4.89 114.94 118.85 2d8i s ASN 80 Ca 0.42 -1.07 -0.17 0.00 -0.94 0.00 0.00 52.86 51.10 2d8i s ASN 80 Cb -0.19 -0.39 0.23 0.00 -2.00 0.00 0.00 41.25 38.90 2d8i s ASN 80 CO 0.21 -0.61 1.51 -1.54 -2.94 0.00 0.00 177.10 173.73 2d8i n SER 81 N -1.32 -0.64 -0.00 3.54 3.41 -1.26 -0.38 113.62 116.98 2d8i n SER 81 Ca -0.01 1.69 -0.00 0.00 -0.26 0.00 0.00 58.87 60.29 2d8i n SER 81 Cb 0.64 -0.38 -0.00 0.00 -0.26 0.00 0.00 64.21 64.21 2d8i n SER 81 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 2d8i h SER 82 N 0.00 -0.02 -0.38 4.04 0.02 -1.99 0.23 113.55 115.45 2d8i h SER 82 Ca 0.33 0.00 0.07 0.00 -0.84 0.00 0.00 61.79 61.36 2d8i h SER 82 Cb 0.58 0.01 -0.09 0.00 0.14 0.00 0.00 62.40 63.03 2d8i h SER 82 CO -0.96 -0.01 -0.36 0.24 -1.14 0.00 0.00 176.83 174.60 2d8i h MET 83 N -0.01 -0.28 -0.71 3.45 2.86 -1.70 -0.70 114.93 117.84 2d8i h MET 83 Ca 0.00 0.02 0.15 0.00 -2.06 0.00 0.00 59.70 57.81 2d8i h MET 83 Cb 0.01 0.06 -0.13 0.00 0.06 0.00 0.00 31.60 31.60 2d8i h MET 83 CO -0.01 -0.19 -0.07 -0.07 1.06 0.00 0.00 176.91 177.64 2d8i h LEU 84 N -0.29 -0.47 -0.32 1.22 3.38 -0.38 0.30 115.31 118.75 2d8i h LEU 84 Ca 0.16 0.20 0.05 0.00 0.09 0.00 0.00 57.88 58.37 2d8i h LEU 84 Cb 0.56 0.37 -0.04 0.00 0.09 0.00 0.00 40.66 41.64 2d8i h LEU 84 CO -0.54 -0.19 0.07 0.11 0.09 0.00 0.00 178.44 177.97 2d8i h LYS 85 N 0.06 0.18 -0.03 1.13 1.57 0.92 0.55 116.57 120.95 2d8i h LYS 85 Ca 0.37 -0.01 -0.05 0.00 -1.87 0.00 0.00 60.65 59.08 2d8i h LYS 85 Cb 0.61 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.87 2d8i h LYS 85 CO -0.67 0.12 -0.24 0.22 -0.57 0.00 0.00 179.45 178.30 2d8i h ASP 86 N 0.18 0.04 0.47 0.86 1.82 -0.08 -1.30 116.42 118.42 2d8i h ASP 86 Ca 0.15 -0.01 -0.16 0.00 -0.39 0.00 0.00 57.03 56.62 2d8i h ASP 86 Cb 0.16 -0.01 -0.01 0.00 0.68 0.00 0.00 39.33 40.15 2d8i h ASP 86 CO -0.19 0.29 -0.70 -0.26 -1.61 0.00 0.00 179.24 176.77 2d8i h PHE 87 N 0.04 0.26 0.00 0.28 -1.00 0.66 -3.03 116.94 114.15 2d8i h PHE 87 Ca 0.01 -0.11 0.00 0.00 2.81 0.00 0.00 57.97 60.67 2d8i h PHE 87 Cb 0.45 -0.04 0.00 0.00 3.61 0.00 0.00 35.95 39.97 2d8i h PHE 87 CO 0.00 0.83 -0.26 -0.07 -1.61 0.00 0.00 178.31 177.20 2d8i h LEU 88 N 0.13 0.00 0.00 1.54 3.38 -0.43 -3.18 115.31 116.75 2d8i h LEU 88 Ca -0.02 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.92 2d8i h LEU 88 Cb 1.24 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.99 2d8i h LEU 88 CO 0.10 0.02 0.00 -0.24 0.09 0.00 0.00 178.44 178.41 2d8i n SER 89 N -2.66 0.00 -4.89 -0.43 2.88 -0.54 -4.78 113.62 103.20 2d8i n SER 89 Ca 0.04 -0.19 -0.33 0.00 -1.33 0.00 0.00 58.87 57.06 2d8i n SER 89 Cb 0.49 -0.25 -0.05 0.00 -0.75 0.00 0.00 64.21 63.65 2d8i n SER 89 CO 0.00 0.00 0.00 -1.10 -1.23 0.00 0.00 175.04 172.71 2d8i s GLN 90 N -2.50 3.65 0.51 -1.46 -1.52 -1.20 -4.97 119.66 112.16 2d8i s GLN 90 Ca 0.27 -0.02 0.30 0.00 -1.95 0.00 0.00 55.36 53.96 2d8i s GLN 90 Cb 0.18 -2.95 1.24 0.00 -0.22 0.00 0.00 33.01 31.26 2d8i s GLN 90 CO 0.39 0.54 1.95 -1.00 -0.25 0.00 0.00 175.29 176.92 2d8i h PRO 91 N 3.36 0.00 -6.78 2.91 0.13 -1.86 -3.44 132.00 126.33 2d8i h PRO 91 Ca -0.48 0.00 -0.69 0.00 -0.87 0.00 0.00 66.00 63.96 2d8i h PRO 91 Cb 1.18 0.00 -0.24 0.00 0.13 0.00 0.00 31.00 32.07 2d8i h PRO 91 CO 0.69 0.10 -0.87 0.45 -0.23 0.00 0.00 178.00 178.15 2d8i s SER 92 N -5.92 3.30 0.00 1.44 0.15 -1.26 0.18 113.70 111.59 2d8i s SER 92 Ca 0.00 -0.62 -0.25 0.00 0.70 0.00 0.00 55.95 55.78 2d8i s SER 92 Cb 0.10 -0.31 0.06 0.00 -1.71 0.00 0.00 66.02 64.16 2d8i s SER 92 CO 0.58 0.23 0.57 -0.76 1.20 0.00 0.00 173.24 175.06 2d8i s LEU 93 N -1.55 -0.25 -0.27 3.45 1.43 -0.07 -4.99 118.68 116.43 2d8i s LEU 93 Ca 0.13 0.41 -0.00 0.00 -1.03 0.00 0.00 54.13 53.64 2d8i s LEU 93 Cb -0.10 2.23 0.08 0.00 0.03 0.00 0.00 46.19 48.44 2d8i s LEU 93 CO 0.04 -0.65 0.04 -0.83 0.23 0.00 0.00 176.35 175.18 2d8i s GLY 94 N -1.57 1.19 0.31 -3.19 0.00 -1.26 -1.58 107.32 101.22 2d8i s GLY 94 Ca -0.09 -1.55 0.05 0.00 0.00 0.00 0.00 44.72 43.13 2d8i s GLY 94 CO 0.04 1.30 0.45 1.08 0.00 0.00 0.00 173.10 175.97 2d8i s LEU 95 N 1.50 4.10 -0.22 0.66 1.43 -1.07 -0.80 118.68 124.28 2d8i s LEU 95 Ca 0.04 0.05 -0.02 0.00 -1.03 0.00 0.00 54.13 53.17 2d8i s LEU 95 Cb -0.18 -2.91 0.07 0.00 0.03 0.00 0.00 46.19 43.20 2d8i s LEU 95 CO -0.15 -0.28 0.05 -0.22 0.23 0.00 0.00 176.35 175.98 2d8i s LEU 96 N -4.14 1.35 0.28 1.79 2.96 -0.84 -2.00 118.68 118.07 2d8i s LEU 96 Ca 0.40 -0.99 0.10 0.00 -0.22 0.00 0.00 54.13 53.42 2d8i s LEU 96 Cb -0.09 -0.64 -0.05 0.00 0.50 0.00 0.00 46.19 45.91 2d8i s LEU 96 CO 0.31 -0.33 -0.08 0.68 -1.32 0.00 0.00 176.35 175.62 2d8i s VAL 97 N 1.82 2.97 -0.14 1.68 -7.23 -1.11 -0.48 120.40 117.90 2d8i s VAL 97 Ca 0.01 -2.12 -0.03 0.00 -1.81 0.00 0.00 61.98 58.03 2d8i s VAL 97 Cb -0.17 -2.63 -0.03 0.00 0.56 0.00 0.00 36.38 34.12 2d8i s VAL 97 CO -0.12 -0.36 -0.03 -0.60 -0.31 0.00 0.00 175.10 173.67 2d8i s ARG 98 N -3.61 3.53 0.26 4.82 3.52 -1.26 -1.42 118.95 124.79 2d8i s ARG 98 Ca 0.31 -0.50 0.02 0.00 -0.13 0.00 0.00 55.73 55.43 2d8i s ARG 98 Cb -0.05 -2.88 -0.05 0.00 -1.56 0.00 0.00 34.95 30.40 2d8i s ARG 98 CO 0.18 0.33 0.08 -0.08 -0.81 0.00 0.00 175.30 175.00 2d8i s THR 99 N 0.12 0.68 -0.04 4.11 -1.32 0.15 -4.93 115.64 114.40 2d8i s THR 99 Ca -0.01 -2.00 -0.19 0.00 -1.21 0.00 0.00 61.69 58.28 2d8i s THR 99 Cb -0.13 -2.62 -0.05 0.00 -1.51 0.00 0.00 72.50 68.18 2d8i s THR 99 CO 0.03 -0.04 0.54 -0.31 -2.21 0.00 0.00 174.62 172.63 2d8i s TYR 100 N -3.67 3.63 0.38 9.09 2.02 -1.26 -0.23 117.35 127.31 2d8i s TYR 100 Ca 0.37 1.08 -0.26 0.00 -0.37 0.00 0.00 57.07 57.88 2d8i s TYR 100 Cb 0.08 -2.56 -0.09 0.00 -0.40 0.00 0.00 41.96 38.99 2d8i s TYR 100 CO 0.13 0.32 1.20 -1.25 -1.57 0.00 0.00 175.55 174.38 2d8i s PRO 101 N 0.00 4.16 0.37 -1.71 0.04 -1.26 -4.94 135.00 131.67 2d8i s PRO 101 Ca 0.29 1.94 0.05 0.00 0.04 0.00 0.00 61.00 63.31 2d8i s PRO 101 Cb -0.17 -2.81 -0.03 0.00 0.04 0.00 0.00 34.50 31.53 2d8i s PRO 101 CO 0.15 -0.26 0.18 -1.83 0.04 0.00 0.00 177.00 175.27 2d8i s GLU 102 N -2.11 1.83 -0.09 4.56 1.03 -1.26 -4.98 118.70 117.68 2d8i s GLU 102 Ca 0.54 -2.09 -0.01 0.00 0.03 0.00 0.00 54.97 53.43 2d8i s GLU 102 Cb -0.33 -0.27 0.01 0.00 -0.80 0.00 0.00 34.13 32.74 2d8i s GLU 102 CO 0.43 -0.52 2.28 -0.11 -1.33 0.00 0.00 175.26 176.00 2d8i n LEU 103 N -0.78 5.65 -3.30 1.83 7.94 -1.26 -4.51 117.00 122.56 2d8i n LEU 103 Ca -0.01 -2.80 -0.27 0.00 -1.11 0.00 0.00 56.01 51.81 2d8i n LEU 103 Cb 0.64 -1.16 -0.07 0.00 0.53 0.00 0.00 43.42 43.36 2d8i n LEU 103 CO 0.34 1.19 0.09 1.21 -1.11 0.00 0.00 177.39 179.12 2d8i n GLU 104 N 1.35 2.68 -4.42 1.96 2.13 -1.26 -5.04 120.64 118.03 2d8i n GLU 104 Ca 0.15 -4.70 -0.24 0.00 0.66 0.00 0.00 57.16 53.03 2d8i n GLU 104 Cb 0.58 -2.24 -0.13 0.00 0.27 0.00 0.00 31.44 29.92 2d8i n GLU 104 CO 0.00 0.00 0.00 -1.21 -0.41 0.00 0.00 177.13 175.51 2d8i s GLU 105 N -2.70 1.19 0.00 5.31 0.41 -1.26 -4.93 118.70 116.72 2d8i s GLU 105 Ca 0.42 -1.04 0.00 0.00 -0.41 0.00 0.00 54.97 53.94 2d8i s GLU 105 Cb 0.18 -1.37 0.00 0.00 -1.78 0.00 0.00 34.13 31.16 2d8i s GLU 105 CO -0.04 0.33 0.00 0.41 -0.49 0.00 0.00 175.26 175.47 2d8i n GLY 106 N 1.44 0.47 3.69 -1.39 0.00 -1.26 -4.71 105.19 103.43 2d8i n GLY 106 Ca -0.19 0.54 -0.42 0.00 0.00 0.00 0.00 46.02 45.95 2d8i n GLY 106 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2d8i s VAL 107 N 0.00 4.56 -0.20 1.61 -7.23 -1.26 -5.03 120.40 112.86 2d8i s VAL 107 Ca 0.00 1.85 -0.11 0.00 -1.81 0.00 0.00 61.98 61.90 2d8i s VAL 107 Cb 0.00 -4.19 -0.05 0.00 0.56 0.00 0.00 36.38 32.70 2d8i s VAL 107 CO 0.00 0.03 0.19 -1.61 -0.31 0.00 0.00 175.10 173.40 2d8i s GLU 108 N 1.89 4.18 -1.32 4.82 0.41 -1.26 -4.88 118.70 122.53 2d8i s GLU 108 Ca 0.52 -0.13 -0.16 0.00 -0.41 0.00 0.00 54.97 54.79 2d8i s GLU 108 Cb -0.22 -3.46 0.01 0.00 -1.78 0.00 0.00 34.13 28.68 2d8i s GLU 108 CO 0.21 0.20 2.11 0.43 -0.49 0.00 0.00 175.26 177.72 2d8i n SER 109 N 3.80 3.78 0.00 -0.19 7.64 -1.26 -4.62 113.62 122.77 2d8i n SER 109 Ca -0.14 -2.82 0.00 0.00 1.01 0.00 0.00 58.87 56.92 2d8i n SER 109 Cb 0.52 -1.59 0.00 0.00 -1.01 0.00 0.00 64.21 62.13 2d8i n SER 109 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2d8i n GLY 110 N 4.39 1.50 3.77 0.23 0.00 -1.26 -5.16 105.19 108.66 2d8i n GLY 110 Ca 0.51 0.34 -0.31 0.00 0.00 0.00 0.00 46.02 46.56 2d8i n GLY 110 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2d8i s PRO 111 N 3.08 2.38 0.16 1.61 0.04 -1.26 -5.07 135.00 135.94 2d8i s PRO 111 Ca 0.00 1.22 0.10 0.00 0.04 0.00 0.00 61.00 62.36 2d8i s PRO 111 Cb 0.00 -1.91 -0.04 0.00 0.04 0.00 0.00 34.50 32.59 2d8i s PRO 111 CO 0.00 -1.55 -0.22 0.45 0.04 0.00 0.00 177.00 175.72 2d8i s SER 112 N -3.20 3.05 0.25 6.66 0.15 -1.26 -4.92 113.70 114.44 2d8i s SER 112 Ca 0.63 -0.83 0.11 0.00 0.70 0.00 0.00 55.95 56.56 2d8i s SER 112 Cb -0.18 -0.20 -0.05 0.00 -1.71 0.00 0.00 66.02 63.88 2d8i s SER 112 CO 0.53 0.07 -0.15 -0.94 1.20 0.00 0.00 173.24 173.95 2d8i s SER 113 N -2.50 3.88 0.00 5.45 1.04 -1.26 -5.27 113.70 115.04 2d8i s SER 113 Ca 0.16 -0.86 0.00 0.00 0.48 0.00 0.00 55.95 55.73 2d8i s SER 113 Cb -0.08 -0.47 0.00 0.00 0.10 0.00 0.00 66.02 65.57 2d8i s SER 113 CO 0.08 0.05 0.00 0.61 0.98 0.00 0.00 173.24 174.95