#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vch s GLU 2 N 0.00 4.48 0.09 0.03 2.02 -1.26 -5.06 118.70 119.00 1vch s GLU 2 Ca 0.00 2.00 0.02 0.00 0.02 0.00 0.00 54.97 57.01 1vch s GLU 2 Cb 0.00 -3.16 -0.04 0.00 0.10 0.00 0.00 34.13 31.04 1vch s GLU 2 CO 0.00 -0.04 -0.07 0.95 0.02 0.00 0.00 175.26 176.12 1vch s THR 3 N -0.80 0.68 -0.04 3.63 -4.23 -1.26 -4.03 115.64 109.58 1vch s THR 3 Ca 0.49 -1.73 0.02 0.00 -1.18 0.00 0.00 61.69 59.29 1vch s THR 3 Cb -0.35 -1.43 0.01 0.00 1.34 0.00 0.00 72.50 72.07 1vch s THR 3 CO 0.44 -0.75 -0.09 -0.47 -0.54 0.00 0.00 174.62 173.21 1vch s TYR 4 N -3.06 1.08 -0.26 3.99 5.04 0.94 -4.87 117.35 120.21 1vch s TYR 4 Ca 0.07 -0.31 -0.29 0.00 -2.44 0.00 0.00 57.07 54.09 1vch s TYR 4 Cb 0.01 -0.79 0.01 0.00 0.35 0.00 0.00 41.96 41.54 1vch s TYR 4 CO -0.03 -0.16 1.07 -1.25 -1.34 0.00 0.00 175.55 173.84 1vch s PRO 5 N 0.43 4.18 -0.02 4.97 0.04 -1.26 -1.84 135.00 141.49 1vch s PRO 5 Ca -0.08 1.27 0.05 0.00 0.04 0.00 0.00 61.00 62.29 1vch s PRO 5 Cb -0.12 -3.69 -0.03 0.00 0.04 0.00 0.00 34.50 30.71 1vch s PRO 5 CO 0.01 -0.74 -0.16 0.96 0.04 0.00 0.00 177.00 177.11 1vch s ILE 6 N 3.41 2.91 -0.01 0.56 -4.36 -0.46 -4.98 121.20 118.27 1vch s ILE 6 Ca 0.45 -0.88 0.03 0.00 -0.26 0.00 0.00 60.65 59.99 1vch s ILE 6 Cb -0.14 -2.15 -0.00 0.00 1.25 0.00 0.00 42.46 41.41 1vch s ILE 6 CO 0.10 0.52 -0.09 -0.89 0.24 0.00 0.00 174.94 174.83 1vch s THR 7 N -0.78 0.69 -0.07 8.37 2.01 -1.26 -1.36 115.64 123.24 1vch s THR 7 Ca 0.12 -0.36 -0.03 0.00 0.31 0.00 0.00 61.69 61.73 1vch s THR 7 Cb -0.11 -0.59 0.04 0.00 0.01 0.00 0.00 72.50 71.86 1vch s THR 7 CO 0.02 0.20 0.15 -0.69 -0.69 0.00 0.00 174.62 173.61 1vch s VAL 8 N -0.13 -0.09 -1.49 3.82 1.01 -0.79 -4.92 120.40 117.80 1vch s VAL 8 Ca 0.02 0.22 -0.00 0.00 0.00 0.00 0.00 61.98 62.21 1vch s VAL 8 Cb -0.04 -0.25 0.00 0.00 0.00 0.00 0.00 36.38 36.09 1vch s VAL 8 CO -0.00 0.09 0.18 0.61 0.00 0.00 0.00 175.10 175.98 1vch n GLY 9 N 4.43 -0.17 3.15 4.51 0.00 -1.26 -1.07 105.19 114.78 1vch n GLY 9 Ca -0.22 0.16 0.00 0.00 0.00 0.00 0.00 46.02 45.96 1vch n GLY 9 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1vch n GLY 10 N -2.32 2.92 3.63 -0.02 0.00 -1.26 -4.91 105.19 103.23 1vch n GLY 10 Ca -0.32 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.33 1vch n GLY 10 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1vch s VAL 11 N -2.42 5.33 -0.04 1.61 1.01 -0.24 -5.08 120.40 120.58 1vch s VAL 11 Ca 0.00 0.17 0.00 0.00 0.00 0.00 0.00 61.98 62.15 1vch s VAL 11 Cb 0.00 -3.51 -0.03 0.00 0.00 0.00 0.00 36.38 32.84 1vch s VAL 11 CO 0.00 0.31 -0.01 -0.89 0.00 0.00 0.00 175.10 174.51 1vch s THR 12 N 1.35 4.17 -0.04 3.92 2.01 -1.26 -1.88 115.64 123.92 1vch s THR 12 Ca 0.07 -0.44 0.01 0.00 0.31 0.00 0.00 61.69 61.65 1vch s THR 12 Cb -0.15 -2.80 0.02 0.00 0.01 0.00 0.00 72.50 69.58 1vch s THR 12 CO 0.07 0.50 -0.05 -0.13 -0.69 0.00 0.00 174.62 174.32 1vch s ARG 13 N -1.19 0.82 -0.52 4.92 1.81 -0.46 -5.00 118.95 119.32 1vch s ARG 13 Ca 0.16 -0.14 -0.17 0.00 -1.72 0.00 0.00 55.73 53.86 1vch s ARG 13 Cb -0.11 -0.81 0.08 0.00 -0.45 0.00 0.00 34.95 33.66 1vch s ARG 13 CO 0.06 -0.04 0.55 -1.01 -0.68 0.00 0.00 175.30 174.18 1vch s HIS 14 N 0.72 3.13 0.08 -0.53 3.76 -1.26 -1.36 115.29 119.84 1vch s HIS 14 Ca -0.10 -0.86 0.05 0.00 -0.15 0.00 0.00 55.06 53.99 1vch s HIS 14 Cb -0.13 -3.56 -0.04 0.00 1.11 0.00 0.00 32.58 29.96 1vch s HIS 14 CO 0.00 -1.01 -0.01 0.14 -0.85 0.00 0.00 174.74 173.02 1vch s VAL 15 N 2.17 3.98 1.07 -0.90 -7.23 -0.77 -4.78 120.40 113.94 1vch s VAL 15 Ca 0.09 -0.98 -0.13 0.00 -1.81 0.00 0.00 61.98 59.15 1vch s VAL 15 Cb -0.23 -2.89 0.23 0.00 0.56 0.00 0.00 36.38 34.05 1vch s VAL 15 CO 0.08 0.14 1.07 -2.16 -0.31 0.00 0.00 175.10 173.91 1vch s PRO 16 N -2.24 -0.17 0.10 4.82 0.04 -1.26 -0.04 135.00 136.25 1vch s PRO 16 Ca 0.25 0.60 0.08 0.00 0.04 0.00 0.00 61.00 61.96 1vch s PRO 16 Cb -0.12 -1.66 -0.04 0.00 0.04 0.00 0.00 34.50 32.72 1vch s PRO 16 CO 0.17 -3.16 -0.14 -0.51 0.04 0.00 0.00 177.00 173.41 1vch s LEU 17 N -6.77 2.88 0.13 -3.56 1.43 -1.26 -1.03 118.68 110.51 1vch s LEU 17 Ca 0.67 -0.45 0.09 0.00 -1.03 0.00 0.00 54.13 53.41 1vch s LEU 17 Cb -0.21 -1.69 -0.04 0.00 0.03 0.00 0.00 46.19 44.28 1vch s LEU 17 CO 0.60 0.19 -0.22 0.27 0.23 0.00 0.00 176.35 177.42 1vch s ILE 18 N -1.15 1.94 -0.80 -0.59 -4.36 -0.63 -4.90 121.20 110.71 1vch s ILE 18 Ca 0.19 -1.72 0.02 0.00 -0.26 0.00 0.00 60.65 58.88 1vch s ILE 18 Cb -0.11 -1.78 0.20 0.00 1.25 0.00 0.00 42.46 42.02 1vch s ILE 18 CO 0.11 -0.08 0.66 1.21 0.24 0.00 0.00 174.94 177.09 1vch n GLU 19 N 0.80 2.30 0.28 0.37 2.13 -1.26 -1.60 120.64 123.66 1vch n GLU 19 Ca -0.17 -4.50 0.19 0.00 0.66 0.00 0.00 57.16 53.33 1vch n GLU 19 Cb 0.54 -2.35 0.94 0.00 0.27 0.00 0.00 31.44 30.84 1vch n GLU 19 CO 0.00 0.00 0.00 -1.00 -0.41 0.00 0.00 177.13 175.72 1vch h PRO 20 N 5.58 0.00 -3.40 5.31 0.13 -1.96 -3.41 132.00 134.24 1vch h PRO 20 Ca 0.16 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 65.10 1vch h PRO 20 Cb 0.77 0.00 -0.26 0.00 0.13 0.00 0.00 31.00 31.64 1vch h PRO 20 CO 0.80 0.00 -0.54 -0.51 -0.23 0.00 0.00 178.00 177.52 1vch s LEU 21 N -5.73 1.46 -0.02 1.56 1.43 -1.25 -5.09 118.68 111.04 1vch s LEU 21 Ca -0.02 0.22 -0.37 0.00 -1.03 0.00 0.00 54.13 52.93 1vch s LEU 21 Cb 0.11 0.52 -0.15 0.00 0.03 0.00 0.00 46.19 46.69 1vch s LEU 21 CO 0.40 -0.09 1.59 -0.81 0.23 0.00 0.00 176.35 177.66 1vch n PRO 22 N 2.79 1.53 -1.30 1.29 -0.04 -1.26 -1.07 135.00 136.94 1vch n PRO 22 Ca -0.14 0.56 -0.10 0.00 -0.04 0.00 0.00 63.50 63.77 1vch n PRO 22 Cb 0.59 -2.27 -0.04 0.00 -0.04 0.00 0.00 33.50 31.73 1vch n PRO 22 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1vch n GLY 23 N 3.47 1.12 2.62 0.55 0.00 -1.26 -4.94 105.19 106.75 1vch n GLY 23 Ca 0.21 -0.24 -0.28 0.00 0.00 0.00 0.00 46.02 45.71 1vch n GLY 23 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1vch s ARG 24 N -2.71 1.41 0.30 1.61 1.81 -0.23 -4.95 118.95 116.19 1vch s ARG 24 Ca 0.00 -2.37 -0.08 0.00 -1.72 0.00 0.00 55.73 51.57 1vch s ARG 24 Cb 0.00 -2.21 -0.06 0.00 -0.45 0.00 0.00 34.95 32.23 1vch s ARG 24 CO 0.00 -1.29 0.61 1.03 -0.68 0.00 0.00 175.30 174.97 1vch s ARG 25 N -0.21 3.71 0.03 3.54 0.52 -1.04 -3.95 118.95 121.55 1vch s ARG 25 Ca 0.25 0.19 0.00 0.00 -0.52 0.00 0.00 55.73 55.66 1vch s ARG 25 Cb -0.08 -2.58 -0.02 0.00 0.52 0.00 0.00 34.95 32.79 1vch s ARG 25 CO -0.12 0.18 -0.04 0.96 0.02 0.00 0.00 175.30 176.30 1vch s ILE 26 N -2.09 0.18 0.40 1.52 -4.36 -0.63 0.10 121.20 116.32 1vch s ILE 26 Ca 0.47 -1.06 -0.26 0.00 -0.26 0.00 0.00 60.65 59.54 1vch s ILE 26 Cb -0.11 -0.48 -0.09 0.00 1.25 0.00 0.00 42.46 43.04 1vch s ILE 26 CO 0.28 -0.56 1.24 -2.84 0.24 0.00 0.00 174.94 173.30 1vch s PRO 27 N -1.82 4.04 -0.39 0.37 0.02 -1.26 -1.61 135.00 134.36 1vch s PRO 27 Ca -0.12 2.01 -0.25 0.00 0.02 0.00 0.00 61.00 62.66 1vch s PRO 27 Cb -0.07 -2.75 0.02 0.00 0.02 0.00 0.00 34.50 31.71 1vch s PRO 27 CO -0.02 -0.38 0.90 -1.17 -0.33 0.00 0.00 177.00 176.00 1vch s LEU 28 N -2.39 4.03 -0.25 -5.54 2.96 -0.20 -4.84 118.68 112.45 1vch s LEU 28 Ca 0.56 0.44 -0.17 0.00 -0.22 0.00 0.00 54.13 54.74 1vch s LEU 28 Cb -0.35 -3.20 -0.03 0.00 0.50 0.00 0.00 46.19 43.11 1vch s LEU 28 CO 0.44 -0.87 0.46 -0.69 -1.32 0.00 0.00 176.35 174.37 1vch s VAL 29 N 3.46 5.12 -0.13 1.68 1.01 -1.26 -4.70 120.40 125.58 1vch s VAL 29 Ca 0.36 0.77 -0.03 0.00 0.00 0.00 0.00 61.98 63.08 1vch s VAL 29 Cb -0.12 -3.78 0.05 0.00 0.00 0.00 0.00 36.38 32.53 1vch s VAL 29 CO 0.20 0.13 0.07 -0.70 0.00 0.00 0.00 175.10 174.80 1vch s GLU 30 N 2.07 0.15 0.10 2.72 2.56 -1.26 -4.99 118.70 120.05 1vch s GLU 30 Ca 0.19 0.03 0.18 0.00 0.00 0.00 0.00 54.97 55.37 1vch s GLU 30 Cb -0.16 -1.40 -0.10 0.00 2.00 0.00 0.00 34.13 34.47 1vch s GLU 30 CO 0.09 -0.53 0.89 0.74 -0.56 0.00 0.00 175.26 175.89 1vch h PHE 31 N 8.39 0.00 -2.37 5.30 0.04 -1.93 -3.45 116.94 122.92 1vch h PHE 31 Ca -0.15 0.00 -0.58 0.00 2.80 0.00 0.00 57.97 60.04 1vch h PHE 31 Cb 1.13 0.00 0.06 0.00 2.20 0.00 0.00 35.95 39.35 1vch h PHE 31 CO 0.30 0.46 0.79 1.28 -0.60 0.00 0.00 178.31 180.53 1vch n LEU 32 N -2.86 3.17 0.00 1.54 4.77 -1.26 -1.34 117.00 121.02 1vch n LEU 32 Ca -0.07 1.09 0.00 0.00 -0.03 0.00 0.00 56.01 57.00 1vch n LEU 32 Cb 0.78 -1.44 0.00 0.00 -2.33 0.00 0.00 43.42 40.43 1vch n LEU 32 CO 0.42 -0.28 0.00 0.61 -1.33 0.00 0.00 177.39 176.81 1vch n GLY 33 N 3.24 1.09 2.77 -0.72 0.00 -1.26 -4.99 105.19 105.33 1vch n GLY 33 Ca 0.16 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.90 1vch n GLY 33 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1vch n ASP 34 N 0.00 2.37 -0.20 1.61 -0.08 -0.45 -4.98 116.55 114.82 1vch n ASP 34 Ca 0.00 -3.06 0.01 0.00 -1.51 0.00 0.00 54.79 50.23 1vch n ASP 34 Cb 0.00 -0.71 0.12 0.00 2.34 0.00 0.00 41.12 42.86 1vch n ASP 34 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 1vch h PRO 35 N 5.34 0.29 -0.60 -0.67 0.11 -1.94 -0.54 132.00 133.99 1vch h PRO 35 Ca 0.17 -0.02 -0.02 0.00 0.11 0.00 0.00 66.00 66.24 1vch h PRO 35 Cb 0.78 -0.07 -0.03 0.00 0.11 0.00 0.00 31.00 31.79 1vch h PRO 35 CO 0.66 0.19 0.28 1.49 -0.21 0.00 0.00 178.00 180.41 1vch h GLU 36 N 0.30 0.87 -0.23 1.05 4.81 -1.96 0.43 114.58 119.86 1vch h GLU 36 Ca 0.32 -0.13 -0.17 0.00 -0.13 0.00 0.00 59.36 59.25 1vch h GLU 36 Cb 0.47 -0.15 -0.00 0.00 0.63 0.00 0.00 28.75 29.69 1vch h GLU 36 CO -0.38 0.71 -0.56 0.35 -0.73 0.00 0.00 179.01 178.39 1vch h PHE 37 N 0.82 0.89 -0.62 0.92 3.57 -1.89 -2.48 116.94 118.15 1vch h PHE 37 Ca 0.21 -0.32 -0.04 0.00 3.53 0.00 0.00 57.97 61.35 1vch h PHE 37 Cb 0.13 -0.17 -0.03 0.00 2.79 0.00 0.00 35.95 38.68 1vch h PHE 37 CO 0.00 1.10 0.24 1.15 -2.23 0.00 0.00 178.31 178.57 1vch h THR 38 N 0.54 1.24 -0.53 4.41 2.02 -0.88 -1.93 112.91 117.77 1vch h THR 38 Ca 0.01 -0.76 -0.02 0.00 0.77 0.00 0.00 66.41 66.42 1vch h THR 38 Cb 1.14 0.56 -0.02 0.00 -1.74 0.00 0.00 68.15 68.08 1vch h THR 38 CO 0.11 0.29 0.26 -0.09 0.37 0.00 0.00 175.52 176.47 1vch h ARG 39 N 0.88 0.76 -0.66 6.66 9.65 -0.82 0.12 114.38 130.97 1vch h ARG 39 Ca 0.21 -0.11 -0.01 0.00 -1.10 0.00 0.00 59.98 58.97 1vch h ARG 39 Cb 0.23 -0.14 -0.03 0.00 -1.39 0.00 0.00 29.97 28.63 1vch h ARG 39 CO -0.01 0.62 0.36 0.00 2.80 0.00 0.00 179.97 183.73 1vch h ALA 40 N 1.10 0.85 -0.29 2.80 0.00 -1.25 0.12 119.26 122.60 1vch h ALA 40 Ca 0.18 -0.11 -0.07 0.00 0.00 0.00 0.00 54.91 54.91 1vch h ALA 40 Cb 0.10 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 1vch h ALA 40 CO -0.02 0.37 -0.09 0.00 0.00 0.00 0.00 179.25 179.50 1vch h ALA 41 N 1.18 0.40 -0.69 0.00 0.00 -1.03 -1.70 119.26 117.41 1vch h ALA 41 Ca 0.23 -0.30 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 1vch h ALA 41 Cb 0.05 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 1vch h ALA 41 CO -0.04 0.24 0.31 0.00 0.00 0.00 0.00 179.25 179.77 1vch h ALA 42 N 0.77 1.25 0.00 0.00 0.00 -0.53 -1.83 119.26 118.92 1vch h ALA 42 Ca 0.07 -0.15 -0.10 0.00 0.00 0.00 0.00 54.91 54.73 1vch h ALA 42 Cb 0.59 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 1vch h ALA 42 CO 0.03 0.57 -0.47 0.93 0.00 0.00 0.00 179.25 180.32 1vch h GLU 43 N 0.99 0.00 -0.04 0.00 4.39 -0.82 -1.69 114.58 117.42 1vch h GLU 43 Ca 0.24 0.00 -0.18 0.00 0.34 0.00 0.00 59.36 59.76 1vch h GLU 43 Cb 0.13 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.77 1vch h GLU 43 CO -0.03 0.47 -0.77 0.00 -1.16 0.00 0.00 179.01 177.52 1vch h ALA 44 N 1.53 0.62 0.03 3.43 0.00 -0.66 -3.23 119.26 120.98 1vch h ALA 44 Ca -0.00 -0.64 -0.22 0.00 0.00 0.00 0.00 54.91 54.05 1vch h ALA 44 Cb 0.93 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.63 1vch h ALA 44 CO 0.06 0.82 -1.00 -0.07 0.00 0.00 0.00 179.25 179.05 1vch h LEU 45 N 0.18 0.14 -0.77 0.00 3.38 -1.21 -3.37 115.31 113.66 1vch h LEU 45 Ca -0.03 -0.14 0.17 0.00 0.09 0.00 0.00 57.88 57.97 1vch h LEU 45 Cb 1.34 -0.04 -0.14 0.00 0.09 0.00 0.00 40.66 41.91 1vch h LEU 45 CO 0.12 1.05 -0.09 -0.09 0.09 0.00 0.00 178.44 179.53 1vch h ARG 46 N 0.04 0.04 0.00 1.13 2.43 -1.32 0.21 114.38 116.91 1vch h ARG 46 Ca -0.04 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.12 1vch h ARG 46 Cb 1.72 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 31.26 1vch h ARG 46 CO 0.14 0.03 0.00 -2.30 -1.51 0.00 0.00 179.97 176.33 1vch n PRO 47 N -5.43 0.17 0.00 0.20 -0.02 -1.26 -1.85 135.00 126.82 1vch n PRO 47 Ca 0.12 0.55 0.12 0.00 -2.02 0.00 0.00 63.50 62.27 1vch n PRO 47 Cb 0.45 -1.94 0.26 0.00 -0.02 0.00 0.00 33.50 32.25 1vch n PRO 47 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1vch n LEU 48 N -2.28 0.49 -4.69 2.45 4.77 0.73 -4.87 117.00 113.61 1vch n LEU 48 Ca 0.00 0.02 -0.42 0.00 -0.03 0.00 0.00 56.01 55.58 1vch n LEU 48 Cb 0.12 -0.25 -0.03 0.00 -2.33 0.00 0.00 43.42 40.94 1vch n LEU 48 CO 0.14 0.11 0.92 -0.69 -1.33 0.00 0.00 177.39 176.55 1vch s VAL 49 N -3.01 4.38 0.38 4.08 1.01 -0.77 -4.99 120.40 121.47 1vch s VAL 49 Ca 0.11 1.69 -0.28 0.00 0.00 0.00 0.00 61.98 63.50 1vch s VAL 49 Cb 0.17 -4.09 -0.11 0.00 0.00 0.00 0.00 36.38 32.36 1vch s VAL 49 CO 0.70 -0.00 1.48 -2.84 0.00 0.00 0.00 175.10 174.43 1vch s PRO 50 N 2.20 4.12 0.65 2.72 0.02 -1.26 -4.86 135.00 138.58 1vch s PRO 50 Ca 0.54 2.55 0.43 0.00 0.02 0.00 0.00 61.00 64.54 1vch s PRO 50 Cb -0.23 -2.97 2.22 0.00 0.02 0.00 0.00 34.50 33.54 1vch s PRO 50 CO 0.21 -0.52 2.30 -0.22 -0.33 0.00 0.00 177.00 178.44 1vch h LYS 51 N 3.01 0.00 0.00 5.54 3.64 -1.97 -1.16 116.57 125.63 1vch h LYS 51 Ca -0.51 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.87 1vch h LYS 51 Cb 1.24 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.06 1vch h LYS 51 CO 0.64 0.00 -0.19 1.05 -2.27 0.00 0.00 179.45 178.68 1vch h GLU 52 N 0.00 0.00 -6.33 1.90 4.11 -2.00 -3.47 114.58 108.80 1vch h GLU 52 Ca -0.00 0.00 -0.63 0.00 0.07 0.00 0.00 59.36 58.80 1vch h GLU 52 Cb 0.10 0.00 0.10 0.00 0.50 0.00 0.00 28.75 29.45 1vch h GLU 52 CO 0.00 0.00 0.03 0.00 0.07 0.00 0.00 179.01 179.11 1vch n ALA 53 N -1.83 -0.99 0.00 1.06 0.00 -0.44 -4.77 120.51 113.54 1vch n ALA 53 Ca 0.05 0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.91 1vch n ALA 53 Cb 0.44 -1.93 0.00 0.00 0.00 0.00 0.00 19.45 17.96 1vch n ALA 53 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1vch n GLU 54 N 1.08 0.08 -3.55 0.00 1.02 -0.23 -4.98 120.64 114.05 1vch n GLU 54 Ca 0.13 0.00 -0.16 0.00 -0.02 0.00 0.00 57.16 57.11 1vch n GLU 54 Cb 0.28 -0.99 -0.06 0.00 -0.02 0.00 0.00 31.44 30.64 1vch n GLU 54 CO 0.00 0.00 0.00 -1.50 1.18 0.00 0.00 177.13 176.81 1vch s ILE 55 N -1.97 0.00 0.15 -3.67 2.07 -1.07 -4.40 121.20 112.31 1vch s ILE 55 Ca 0.00 0.00 0.02 0.00 -1.41 0.00 0.00 60.65 59.26 1vch s ILE 55 Cb 0.00 -1.00 -0.04 0.00 0.13 0.00 0.00 42.46 41.55 1vch s ILE 55 CO 0.00 0.00 0.29 -0.76 -1.91 0.00 0.00 174.94 172.56 1vch s LEU 56 N -0.74 4.33 -0.04 8.50 1.43 -0.93 -1.17 118.68 130.06 1vch s LEU 56 Ca -0.07 0.20 -0.01 0.00 -1.03 0.00 0.00 54.13 53.21 1vch s LEU 56 Cb -0.01 -2.94 0.03 0.00 0.03 0.00 0.00 46.19 43.30 1vch s LEU 56 CO 0.07 0.04 0.03 0.12 0.23 0.00 0.00 176.35 176.84 1vch s PHE 57 N -1.75 0.28 0.29 0.29 2.19 -0.25 -1.13 117.98 117.90 1vch s PHE 57 Ca 0.35 0.07 0.04 0.00 0.33 0.00 0.00 56.93 57.72 1vch s PHE 57 Cb -0.11 -0.52 -0.03 0.00 -1.31 0.00 0.00 43.02 41.05 1vch s PHE 57 CO 0.29 -0.20 0.21 -0.08 1.83 0.00 0.00 175.22 177.26 1vch s THR 58 N 1.71 0.10 0.11 0.12 -1.32 -0.73 -0.94 115.64 114.68 1vch s THR 58 Ca -0.00 -2.00 0.10 0.00 -1.21 0.00 0.00 61.69 58.58 1vch s THR 58 Cb -0.13 -2.49 -0.04 0.00 -1.51 0.00 0.00 72.50 68.33 1vch s THR 58 CO -0.03 0.00 -0.25 0.42 -2.21 0.00 0.00 174.62 172.55 1vch s THR 59 N -3.65 2.09 0.77 5.08 -4.23 -1.26 -1.11 115.64 113.33 1vch s THR 59 Ca 0.38 -1.65 -0.12 0.00 -1.18 0.00 0.00 61.69 59.13 1vch s THR 59 Cb 0.04 -1.85 0.06 0.00 1.34 0.00 0.00 72.50 72.09 1vch s THR 59 CO 0.21 0.08 1.11 -1.83 -0.54 0.00 0.00 174.62 173.65 1vch s GLU 60 N -1.92 2.15 -0.05 3.99 -1.05 -0.60 -4.24 118.70 116.99 1vch s GLU 60 Ca 0.12 1.32 -0.01 0.00 -0.15 0.00 0.00 54.97 56.24 1vch s GLU 60 Cb -0.10 -1.88 -0.03 0.00 -0.44 0.00 0.00 34.13 31.69 1vch s GLU 60 CO 0.05 -1.74 -0.05 2.41 0.95 0.00 0.00 175.26 176.88 1vch n THR 61 N -3.37 0.27 -0.31 1.83 -1.04 -1.26 -4.82 114.28 105.59 1vch n THR 61 Ca 0.10 -0.08 0.17 0.00 -2.04 0.00 0.00 64.05 62.20 1vch n THR 61 Cb 0.52 -1.10 0.43 0.00 -1.82 0.00 0.00 70.33 68.36 1vch n THR 61 CO 0.00 0.00 0.00 0.28 -0.64 0.00 0.00 175.07 174.71 1vch h SER 62 N -0.09 0.58 0.66 8.00 0.02 -1.99 -0.91 113.55 119.83 1vch h SER 62 Ca -0.11 0.07 0.00 0.00 -0.84 0.00 0.00 61.79 60.91 1vch h SER 62 Cb 1.13 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 63.65 1vch h SER 62 CO -0.04 0.20 0.00 -2.65 -1.14 0.00 0.00 176.83 173.19 1vch n PRO 63 N -4.64 0.14 0.18 3.45 -0.02 -1.26 -3.95 135.00 128.90 1vch n PRO 63 Ca 0.22 0.38 -0.14 0.00 -2.02 0.00 0.00 63.50 61.94 1vch n PRO 63 Cb 0.68 -1.77 -0.07 0.00 -0.02 0.00 0.00 33.50 32.32 1vch n PRO 63 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 1vch h ILE 64 N 0.00 0.39 -0.68 4.25 2.04 -1.37 0.30 117.51 122.43 1vch h ILE 64 Ca 0.00 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.85 1vch h ILE 64 Cb 0.33 0.39 -0.03 0.00 -0.74 0.00 0.00 36.82 36.76 1vch h ILE 64 CO 0.00 0.00 0.38 1.55 0.00 0.00 0.00 178.15 180.08 1vch h PRO 65 N -0.60 0.94 -0.16 2.37 0.13 -1.78 0.11 132.00 133.01 1vch h PRO 65 Ca -0.01 -0.10 -0.00 0.00 -0.87 0.00 0.00 66.00 65.02 1vch h PRO 65 Cb 0.56 -0.19 -0.01 0.00 0.13 0.00 0.00 31.00 31.49 1vch h PRO 65 CO -0.07 0.69 0.09 1.25 -0.23 0.00 0.00 178.00 179.73 1vch h LEU 66 N 0.95 0.19 -0.55 1.56 5.85 -1.68 -1.62 115.31 120.00 1vch h LEU 66 Ca 0.24 -0.06 -0.14 0.00 0.84 0.00 0.00 57.88 58.76 1vch h LEU 66 Cb 0.02 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 40.99 1vch h LEU 66 CO -0.04 0.19 -0.37 0.74 -0.34 0.00 0.00 178.44 178.62 1vch h THR 67 N 0.18 1.28 -0.09 1.05 2.02 -0.60 -2.01 112.91 114.75 1vch h THR 67 Ca 0.06 -1.54 -0.00 0.00 0.77 0.00 0.00 66.41 65.70 1vch h THR 67 Cb 0.04 1.43 -0.00 0.00 -1.74 0.00 0.00 68.15 67.87 1vch h THR 67 CO -0.01 0.50 0.05 -0.74 0.37 0.00 0.00 175.52 175.69 1vch h HIS 68 N 0.62 0.12 -0.62 3.16 -0.00 -0.63 0.97 115.15 118.76 1vch h HIS 68 Ca 0.06 -0.00 -0.03 0.00 -0.00 0.00 0.00 60.37 60.40 1vch h HIS 68 Cb 0.92 -0.04 -0.03 0.00 -0.00 0.00 0.00 27.41 28.26 1vch h HIS 68 CO 0.05 0.13 0.29 0.28 -0.00 0.00 0.00 177.93 178.67 1vch h VAL 69 N 0.07 1.22 -0.36 5.26 2.07 -1.28 -1.24 116.25 121.99 1vch h VAL 69 Ca 0.03 -0.64 -0.03 0.00 0.82 0.00 0.00 66.70 66.88 1vch h VAL 69 Cb 0.05 0.49 -0.02 0.00 -1.52 0.00 0.00 31.29 30.29 1vch h VAL 69 CO -0.01 0.26 0.10 0.25 0.02 0.00 0.00 177.57 178.20 1vch h LEU 70 N 0.86 0.53 -0.12 2.57 5.85 -1.18 -1.02 115.31 122.79 1vch h LEU 70 Ca 0.21 -0.21 0.02 0.00 0.84 0.00 0.00 57.88 58.74 1vch h LEU 70 Cb 0.14 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.01 1vch h LEU 70 CO -0.02 0.61 -0.02 0.00 -0.34 0.00 0.00 178.44 178.67 1vch h ALA 71 N 0.95 0.09 -0.90 1.25 0.00 -0.57 -0.03 119.26 120.05 1vch h ALA 71 Ca 0.12 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 1vch h ALA 71 Cb 0.27 0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.09 1vch h ALA 71 CO -0.00 -0.47 0.49 1.49 0.00 0.00 0.00 179.25 180.76 1vch h GLU 72 N 0.02 1.27 -0.33 0.00 4.81 -1.15 0.33 114.58 119.52 1vch h GLU 72 Ca 0.06 -0.15 -0.03 0.00 -0.13 0.00 0.00 59.36 59.11 1vch h GLU 72 Cb 0.08 -0.25 -0.02 0.00 0.63 0.00 0.00 28.75 29.20 1vch h GLU 72 CO -0.11 0.93 0.10 0.00 -0.73 0.00 0.00 179.01 179.19 1vch h ALA 73 N 1.27 1.55 0.00 2.92 0.00 -0.53 -1.99 119.26 122.49 1vch h ALA 73 Ca 0.32 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.11 1vch h ALA 73 Cb 0.03 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.68 1vch h ALA 73 CO -0.05 0.34 -0.55 1.28 0.00 0.00 0.00 179.25 180.27 1vch n LEU 74 N -4.37 0.54 -0.82 0.00 4.77 -0.08 -4.95 117.00 112.09 1vch n LEU 74 Ca 0.02 0.06 -0.07 0.00 -0.03 0.00 0.00 56.01 55.99 1vch n LEU 74 Cb 0.16 -0.23 -0.00 0.00 -2.33 0.00 0.00 43.42 41.02 1vch n LEU 74 CO 0.37 0.08 -0.07 0.61 -1.33 0.00 0.00 177.39 177.04 1vch n GLY 75 N 1.45 0.12 3.41 -0.72 0.00 0.86 -5.04 105.19 105.27 1vch n GLY 75 Ca 0.05 -0.59 -0.24 0.00 0.00 0.00 0.00 46.02 45.24 1vch n GLY 75 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1vch s LEU 76 N -2.01 2.50 0.00 0.99 1.43 0.57 -5.00 118.68 117.15 1vch s LEU 76 Ca 0.01 -0.94 -0.03 0.00 -1.03 0.00 0.00 54.13 52.14 1vch s LEU 76 Cb -0.01 -1.02 0.13 0.00 0.03 0.00 0.00 46.19 45.32 1vch s LEU 76 CO 0.02 0.03 0.87 -0.81 0.23 0.00 0.00 176.35 176.68 1vch n PRO 77 N -0.11 -0.21 -3.91 1.29 -0.04 -1.26 -4.14 135.00 126.61 1vch n PRO 77 Ca -0.09 -2.08 -0.08 0.00 -0.04 0.00 0.00 63.50 61.21 1vch n PRO 77 Cb 0.58 -0.66 -0.03 0.00 -0.04 0.00 0.00 33.50 33.34 1vch n PRO 77 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 1vch s TYR 78 N -2.65 0.04 0.16 0.54 1.13 -1.26 -2.19 117.35 113.12 1vch s TYR 78 Ca 0.55 -0.45 0.05 0.00 -1.41 0.00 0.00 57.07 55.81 1vch s TYR 78 Cb -0.03 0.49 -0.05 0.00 -1.10 0.00 0.00 41.96 41.28 1vch s TYR 78 CO 0.37 -1.13 -0.10 0.14 -2.51 0.00 0.00 175.55 172.32 1vch s VAL 79 N -3.96 1.22 -0.09 -3.49 -7.23 -0.28 -4.92 120.40 101.65 1vch s VAL 79 Ca 0.16 -2.08 -0.00 0.00 -1.81 0.00 0.00 61.98 58.25 1vch s VAL 79 Cb -0.04 -1.92 0.02 0.00 0.56 0.00 0.00 36.38 35.00 1vch s VAL 79 CO 0.08 -0.69 -0.07 -0.69 -0.31 0.00 0.00 175.10 173.42 1vch s VAL 80 N -3.29 0.89 0.06 1.32 1.01 -1.26 -1.78 120.40 117.35 1vch s VAL 80 Ca 0.19 -0.23 -0.23 0.00 0.00 0.00 0.00 61.98 61.70 1vch s VAL 80 Cb 0.02 -0.92 -0.06 0.00 0.00 0.00 0.00 36.38 35.42 1vch s VAL 80 CO 0.02 0.34 0.69 0.00 0.00 0.00 0.00 175.10 176.15 1vch s ALA 81 N 1.54 3.45 0.38 5.51 0.00 -0.26 -4.69 121.76 127.68 1vch s ALA 81 Ca 0.01 0.19 0.02 0.00 0.00 0.00 0.00 51.96 52.17 1vch s ALA 81 Cb -0.13 -2.86 -0.02 0.00 0.00 0.00 0.00 23.12 20.11 1vch s ALA 81 CO -0.05 0.19 0.57 1.03 0.00 0.00 0.00 175.76 177.50 1vch s ARG 82 N -0.48 3.26 0.00 0.00 1.81 0.17 -1.55 118.95 122.17 1vch s ARG 82 Ca 0.34 -0.53 0.22 0.00 -1.72 0.00 0.00 55.73 54.04 1vch s ARG 82 Cb -0.20 -2.66 0.54 0.00 -0.45 0.00 0.00 34.95 32.18 1vch s ARG 82 CO 0.21 -0.01 1.47 0.54 -0.68 0.00 0.00 175.30 176.83 1vch n ARG 83 N -1.85 2.49 -3.53 3.54 1.74 -1.26 -0.09 116.66 117.69 1vch n ARG 83 Ca -0.02 -2.28 -0.11 0.00 -0.77 0.00 0.00 57.85 54.67 1vch n ARG 83 Cb 0.57 -1.51 -0.04 0.00 -1.02 0.00 0.00 32.46 30.46 1vch n ARG 83 CO 0.00 0.00 0.00 -0.98 -1.52 0.00 0.00 177.63 175.13 1vch s ARG 84 N -1.30 0.77 0.33 5.56 1.70 -1.26 -4.57 118.95 120.19 1vch s ARG 84 Ca 0.42 -0.05 -0.29 0.00 -0.47 0.00 0.00 55.73 55.34 1vch s ARG 84 Cb 0.23 0.36 -0.10 0.00 -0.57 0.00 0.00 34.95 34.87 1vch s ARG 84 CO 0.31 -0.29 1.34 0.50 -1.08 0.00 0.00 175.30 176.08 1vch s ARG 85 N -2.07 4.31 0.16 3.89 3.52 -1.26 -4.84 118.95 122.66 1vch s ARG 85 Ca 0.00 2.27 0.09 0.00 -0.13 0.00 0.00 55.73 57.96 1vch s ARG 85 Cb -0.01 -3.06 -0.04 0.00 -1.56 0.00 0.00 34.95 30.28 1vch s ARG 85 CO -0.02 -0.25 -0.14 1.03 -0.81 0.00 0.00 175.30 175.11 1vch s ARG 86 N -1.72 1.93 0.16 5.12 1.81 -1.26 -5.07 118.95 119.92 1vch s ARG 86 Ca 0.50 -1.25 -0.34 0.00 -1.72 0.00 0.00 55.73 52.93 1vch s ARG 86 Cb -0.41 -2.12 -0.15 0.00 -0.45 0.00 0.00 34.95 31.81 1vch s ARG 86 CO 0.54 0.45 1.32 -2.30 -0.68 0.00 0.00 175.30 174.63 1vch n PRO 87 N 0.34 1.48 -1.02 3.54 -0.02 -1.26 -1.35 135.00 136.71 1vch n PRO 87 Ca -0.13 0.53 -0.01 0.00 -2.02 0.00 0.00 63.50 61.88 1vch n PRO 87 Cb 0.54 -2.14 -0.00 0.00 -0.02 0.00 0.00 33.50 31.88 1vch n PRO 87 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1vch n TYR 88 N 2.13 0.00 -1.78 6.00 4.01 -1.26 -4.97 117.16 121.28 1vch n TYR 88 Ca 0.15 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.47 1vch n TYR 88 Cb 0.25 -0.98 -0.03 0.00 -0.31 0.00 0.00 39.34 38.27 1vch n TYR 88 CO 0.00 0.00 0.00 1.41 -0.46 0.00 0.00 176.86 177.81 1vch s MET 89 N -1.04 4.15 -0.01 -0.72 -2.45 -0.46 -4.96 119.30 113.82 1vch s MET 89 Ca 0.00 2.53 -0.20 0.00 -1.25 0.00 0.00 55.69 56.78 1vch s MET 89 Cb 0.00 -3.22 -0.05 0.00 1.25 0.00 0.00 34.83 32.80 1vch s MET 89 CO 0.00 -0.74 0.56 -1.21 1.05 0.00 0.00 175.02 174.69 1vch s GLU 90 N 1.56 4.27 0.00 4.11 0.41 -1.26 -4.72 118.70 123.06 1vch s GLU 90 Ca 0.75 0.68 0.00 0.00 -0.41 0.00 0.00 54.97 55.98 1vch s GLU 90 Cb -0.47 -3.33 0.00 0.00 -1.78 0.00 0.00 34.13 28.55 1vch s GLU 90 CO 0.33 0.41 0.00 -3.47 -0.49 0.00 0.00 175.26 172.04 1vch n ASP 91 N 2.61 0.00 -4.76 -0.19 -0.08 -1.26 -1.22 116.55 111.65 1vch n ASP 91 Ca -0.08 0.00 -0.34 0.00 -1.51 0.00 0.00 54.79 52.86 1vch n ASP 91 Cb 0.51 0.00 0.04 0.00 2.34 0.00 0.00 41.12 44.02 1vch n ASP 91 CO 0.00 0.00 0.00 -2.16 0.12 0.00 0.00 177.20 175.16 1vch s PRO 92 N -0.92 2.81 -0.14 -0.67 0.04 -1.26 -4.03 135.00 130.82 1vch s PRO 92 Ca 0.00 1.56 -0.22 0.00 0.04 0.00 0.00 61.00 62.38 1vch s PRO 92 Cb 0.00 -1.94 -0.03 0.00 0.04 0.00 0.00 34.50 32.57 1vch s PRO 92 CO 0.00 -1.27 0.66 0.42 0.04 0.00 0.00 177.00 176.84 1vch s ILE 93 N -2.06 5.04 -0.16 0.56 1.01 0.03 -4.87 121.20 120.75 1vch s ILE 93 Ca 0.71 1.29 -0.01 0.00 0.00 0.00 0.00 60.65 62.64 1vch s ILE 93 Cb -0.24 -3.98 -0.01 0.00 0.01 0.00 0.00 42.46 38.24 1vch s ILE 93 CO 0.38 0.18 -0.11 -0.63 0.00 0.00 0.00 174.94 174.76 1vch s ILE 94 N 1.36 3.12 -0.05 2.92 1.01 -1.26 -0.57 121.20 127.73 1vch s ILE 94 Ca 0.32 -0.62 -0.00 0.00 0.00 0.00 0.00 60.65 60.35 1vch s ILE 94 Cb -0.16 -2.34 0.03 0.00 0.01 0.00 0.00 42.46 39.99 1vch s ILE 94 CO 0.13 0.50 -0.00 -1.58 0.00 0.00 0.00 174.94 173.99 1vch s GLN 95 N 0.68 0.50 0.11 2.79 2.00 -0.23 -4.98 119.66 120.53 1vch s GLN 95 Ca -0.05 0.08 -0.29 0.00 -2.00 0.00 0.00 55.36 53.09 1vch s GLN 95 Cb -0.15 -0.76 -0.06 0.00 0.80 0.00 0.00 33.01 32.84 1vch s GLN 95 CO 0.02 -0.21 0.93 -1.21 -0.50 0.00 0.00 175.29 174.32 1vch s GLU 96 N 1.49 4.67 -0.23 1.67 2.02 -1.26 -0.20 118.70 126.86 1vch s GLU 96 Ca -0.03 1.39 -0.25 0.00 0.02 0.00 0.00 54.97 56.11 1vch s GLU 96 Cb -0.13 -3.37 -0.01 0.00 0.10 0.00 0.00 34.13 30.73 1vch s GLU 96 CO -0.03 0.24 0.83 0.08 0.02 0.00 0.00 175.26 176.41 1vch s VAL 97 N -0.09 4.84 -0.41 2.63 1.01 0.31 -4.86 120.40 123.83 1vch s VAL 97 Ca 0.45 1.58 -0.29 0.00 0.00 0.00 0.00 61.98 63.72 1vch s VAL 97 Cb -0.23 -4.12 -0.09 0.00 0.00 0.00 0.00 36.38 31.94 1vch s VAL 97 CO 0.29 -0.06 2.33 0.00 0.00 0.00 0.00 175.10 177.66 1vch n GLN 98 N 5.92 1.26 0.00 2.72 1.13 -1.26 -4.39 117.38 122.75 1vch n GLN 98 Ca 0.06 0.23 0.00 0.00 -1.94 0.00 0.00 57.00 55.35 1vch n GLN 98 Cb 0.48 -3.00 0.00 0.00 0.11 0.00 0.00 30.24 27.82 1vch n GLN 98 CO 0.00 0.00 0.00 -2.37 -1.44 0.00 0.00 177.06 173.25 1vch n THR 99 N 7.71 0.00 0.00 5.09 5.66 -1.26 -4.96 114.28 126.52 1vch n THR 99 Ca 0.38 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.38 1vch n THR 99 Cb 0.40 -0.15 0.00 0.00 -1.55 0.00 0.00 70.33 69.03 1vch n THR 99 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1vch n GLY 105 N 1.56 1.56 3.78 1.09 0.00 -1.26 -5.19 105.19 106.73 1vch n GLY 105 Ca 0.00 -0.26 -0.35 0.00 0.00 0.00 0.00 46.02 45.40 1vch n GLY 105 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1vch s GLU 106 N -1.80 3.70 -0.06 1.61 0.41 -1.26 -4.91 118.70 116.39 1vch s GLU 106 Ca 0.00 1.52 0.01 0.00 -0.41 0.00 0.00 54.97 56.10 1vch s GLU 106 Cb 0.00 -2.17 0.02 0.00 -1.78 0.00 0.00 34.13 30.20 1vch s GLU 106 CO 0.00 -0.55 -0.08 0.08 -0.49 0.00 0.00 175.26 174.23 1vch s VAL 107 N -1.81 0.81 -0.05 2.63 1.01 -1.26 -0.53 120.40 121.20 1vch s VAL 107 Ca 0.67 -0.27 -0.07 0.00 0.00 0.00 0.00 61.98 62.32 1vch s VAL 107 Cb -0.21 -0.79 -0.04 0.00 0.00 0.00 0.00 36.38 35.34 1vch s VAL 107 CO 0.25 0.29 0.21 -0.76 0.00 0.00 0.00 175.10 175.09 1vch s LEU 108 N 0.91 4.39 -0.12 3.92 1.43 0.73 -4.18 118.68 125.74 1vch s LEU 108 Ca -0.11 0.51 0.01 0.00 -1.03 0.00 0.00 54.13 53.51 1vch s LEU 108 Cb -0.15 -2.41 0.02 0.00 0.03 0.00 0.00 46.19 43.68 1vch s LEU 108 CO 0.01 0.32 -0.13 0.26 0.23 0.00 0.00 176.35 177.04 1vch s TRP 109 N -1.18 1.94 -0.23 0.29 0.52 0.87 -1.06 118.94 120.09 1vch s TRP 109 Ca 0.22 -1.00 -0.00 0.00 0.02 0.00 0.00 56.10 55.34 1vch s TRP 109 Cb -0.13 -1.44 0.03 0.00 -1.15 0.00 0.00 33.47 30.78 1vch s TRP 109 CO 0.12 -0.55 -0.10 -1.17 0.02 0.00 0.00 176.95 175.27 1vch s LEU 110 N 1.31 3.00 0.44 2.99 2.96 0.26 0.45 118.68 130.09 1vch s LEU 110 Ca -0.00 -0.89 -0.25 0.00 -0.22 0.00 0.00 54.13 52.77 1vch s LEU 110 Cb -0.14 -1.61 -0.09 0.00 0.50 0.00 0.00 46.19 44.85 1vch s LEU 110 CO -0.06 -0.11 1.30 -0.67 -1.32 0.00 0.00 176.35 175.49 1vch n ASP 111 N 4.63 2.65 -0.31 3.68 -0.08 -1.26 -0.79 116.55 125.06 1vch n ASP 111 Ca -0.17 1.09 0.09 0.00 -1.51 0.00 0.00 54.79 54.30 1vch n ASP 111 Cb 0.47 -1.52 0.31 0.00 2.34 0.00 0.00 41.12 42.72 1vch n ASP 111 CO 0.00 0.00 0.00 -0.09 0.12 0.00 0.00 177.20 177.23 1vch h ARG 112 N 2.03 0.81 -0.41 -0.67 9.65 -1.30 -0.37 114.38 124.11 1vch h ARG 112 Ca -0.49 -0.05 0.05 0.00 -1.10 0.00 0.00 59.98 58.39 1vch h ARG 112 Cb 1.29 -0.18 -0.02 0.00 -1.39 0.00 0.00 29.97 29.67 1vch h ARG 112 CO 0.60 0.54 0.28 0.00 2.80 0.00 0.00 179.97 184.18 1vch h ARG 113 N 0.83 0.36 0.18 0.20 2.47 -1.90 -0.67 114.38 115.85 1vch h ARG 113 Ca 0.46 -0.02 -0.24 0.00 -1.26 0.00 0.00 59.98 58.92 1vch h ARG 113 Cb 0.59 -0.08 0.03 0.00 -1.65 0.00 0.00 29.97 28.86 1vch h ARG 113 CO -0.23 0.24 -1.05 0.74 0.56 0.00 0.00 179.97 180.23 1vch h PHE 114 N 0.37 0.69 -0.81 3.04 0.04 -1.45 -3.33 116.94 115.48 1vch h PHE 114 Ca 0.18 -0.50 0.10 0.00 2.80 0.00 0.00 57.97 60.54 1vch h PHE 114 Cb 0.24 -0.03 -0.07 0.00 2.20 0.00 0.00 35.95 38.28 1vch h PHE 114 CO -0.00 1.40 0.46 0.00 -0.60 0.00 0.00 178.31 179.57 1vch h ALA 115 N 0.10 1.17 -0.02 2.45 0.00 -0.61 -0.09 119.26 122.26 1vch h ALA 115 Ca -0.18 0.04 0.01 0.00 0.00 0.00 0.00 54.91 54.77 1vch h ALA 115 Cb 1.82 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 19.50 1vch h ALA 115 CO 0.19 0.06 0.04 0.93 0.00 0.00 0.00 179.25 180.47 1vch h GLU 116 N 0.75 0.00 0.00 0.00 5.08 -1.25 -0.57 114.58 118.59 1vch h GLU 116 Ca 0.40 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.76 1vch h GLU 116 Cb 0.39 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.64 1vch h GLU 116 CO -0.26 0.00 -0.16 1.63 -1.00 0.00 0.00 179.01 179.22 1vch n LYS 117 N -3.61 0.00 0.01 2.33 5.02 -0.05 -3.44 118.16 118.42 1vch n LYS 117 Ca -0.02 0.00 0.11 0.00 -2.02 0.00 0.00 58.31 56.38 1vch n LYS 117 Cb 0.12 -1.50 0.10 0.00 -0.02 0.00 0.00 35.03 33.73 1vch n LYS 117 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1vch n LEU 118 N -1.50 0.65 -4.66 -0.35 4.77 -0.22 -4.80 117.00 110.88 1vch n LEU 118 Ca 0.07 -0.10 -0.44 0.00 -0.03 0.00 0.00 56.01 55.50 1vch n LEU 118 Cb 0.34 -0.15 -0.04 0.00 -2.33 0.00 0.00 43.42 41.24 1vch n LEU 118 CO 0.30 0.12 1.58 -0.11 -1.33 0.00 0.00 177.39 177.95 1vch n LEU 119 N -1.67 3.87 -0.89 2.23 7.94 -1.22 -1.59 117.00 125.66 1vch n LEU 119 Ca 0.04 0.89 -0.12 0.00 -1.11 0.00 0.00 56.01 55.71 1vch n LEU 119 Cb 0.37 -1.47 -0.05 0.00 0.53 0.00 0.00 43.42 42.80 1vch n LEU 119 CO 0.38 0.07 -0.11 0.59 -1.11 0.00 0.00 177.39 177.21 1vch n ASN 120 N 7.47 -4.82 -4.89 1.96 3.02 0.31 -4.90 115.26 113.40 1vch n ASN 120 Ca 0.22 0.29 -0.30 0.00 -0.03 0.00 0.00 54.58 54.75 1vch n ASN 120 Cb 0.37 -3.34 -0.04 0.00 -0.61 0.00 0.00 39.78 36.16 1vch n ASN 120 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 1vch s GLN 121 N -2.86 3.33 -0.36 3.52 -1.52 -0.62 -4.99 119.66 116.16 1vch s GLN 121 Ca 0.00 -0.52 -0.22 0.00 -1.95 0.00 0.00 55.36 52.67 1vch s GLN 121 Cb 0.00 -2.96 0.01 0.00 -0.22 0.00 0.00 33.01 29.84 1vch s GLN 121 CO 0.00 0.58 0.73 1.03 -0.25 0.00 0.00 175.29 177.38 1vch s ARG 122 N -2.62 3.72 -0.02 2.91 3.00 -1.26 -2.69 118.95 121.99 1vch s ARG 122 Ca 0.34 0.20 -0.02 0.00 0.00 0.00 0.00 55.73 56.25 1vch s ARG 122 Cb -0.12 -3.81 -0.04 0.00 0.00 0.00 0.00 34.95 30.98 1vch s ARG 122 CO 0.27 -0.81 0.14 0.08 0.00 0.00 0.00 175.30 174.98 1vch s VAL 123 N 2.95 5.13 -0.19 3.52 1.01 -0.13 -1.07 120.40 131.62 1vch s VAL 123 Ca 0.29 -0.24 0.00 0.00 0.00 0.00 0.00 61.98 62.03 1vch s VAL 123 Cb -0.14 -3.36 0.02 0.00 0.00 0.00 0.00 36.38 32.90 1vch s VAL 123 CO 0.16 0.36 -0.17 -0.69 0.00 0.00 0.00 175.10 174.76 1vch s VAL 124 N -1.25 2.28 0.15 2.92 1.01 -0.32 -0.29 120.40 124.90 1vch s VAL 124 Ca 0.24 -0.91 -0.28 0.00 0.00 0.00 0.00 61.98 61.04 1vch s VAL 124 Cb -0.12 -2.00 -0.07 0.00 0.00 0.00 0.00 36.38 34.19 1vch s VAL 124 CO 0.16 0.49 0.88 -0.76 0.00 0.00 0.00 175.10 175.86 1vch s LEU 125 N 1.31 4.55 -0.02 3.92 1.43 0.13 -1.10 118.68 128.91 1vch s LEU 125 Ca 0.04 1.74 0.02 0.00 -1.03 0.00 0.00 54.13 54.90 1vch s LEU 125 Cb -0.14 -3.46 0.01 0.00 0.03 0.00 0.00 46.19 42.62 1vch s LEU 125 CO -0.11 0.07 -0.07 -0.69 0.23 0.00 0.00 176.35 175.79 1vch s VAL 126 N -0.59 0.59 0.09 -1.59 1.01 -0.12 -0.05 120.40 119.74 1vch s VAL 126 Ca 0.41 -0.26 -0.06 0.00 0.00 0.00 0.00 61.98 62.08 1vch s VAL 126 Cb -0.24 -0.54 -0.02 0.00 0.00 0.00 0.00 36.38 35.59 1vch s VAL 126 CO 0.28 0.20 0.13 -0.55 0.00 0.00 0.00 175.10 175.16 1vch s SER 127 N 0.25 0.23 0.05 3.32 0.15 -0.42 -4.39 113.70 112.88 1vch s SER 127 Ca -0.03 -0.80 -0.12 0.00 0.70 0.00 0.00 55.95 55.69 1vch s SER 127 Cb -0.08 0.31 -0.30 0.00 -1.71 0.00 0.00 66.02 64.24 1vch s SER 127 CO 0.00 -0.71 1.09 -2.24 1.20 0.00 0.00 173.24 172.58 1vch h ASP 128 N 2.85 0.75 -3.95 5.45 2.03 -1.91 -2.73 116.42 118.91 1vch h ASP 128 Ca -0.34 -0.75 -0.27 0.00 -0.73 0.00 0.00 57.03 54.94 1vch h ASP 128 Cb 1.19 -0.24 -0.27 0.00 -0.83 0.00 0.00 39.33 39.17 1vch h ASP 128 CO 0.58 1.57 -0.73 -0.69 -1.03 0.00 0.00 179.24 178.95 1vch s VAL 129 N -2.79 0.21 -0.09 4.15 1.01 -1.26 -1.20 120.40 120.43 1vch s VAL 129 Ca -0.08 -0.22 0.04 0.00 0.00 0.00 0.00 61.98 61.72 1vch s VAL 129 Cb 0.05 -0.20 0.00 0.00 0.00 0.00 0.00 36.38 36.24 1vch s VAL 129 CO 0.93 -0.01 -0.21 0.54 0.00 0.00 0.00 175.10 176.35 1vch s VAL 130 N -0.23 1.80 0.00 2.92 0.11 -0.48 -4.97 120.40 119.55 1vch s VAL 130 Ca -0.01 -0.87 0.00 0.00 -2.93 0.00 0.00 61.98 58.17 1vch s VAL 130 Cb -0.02 -1.57 0.00 0.00 -1.53 0.00 0.00 36.38 33.26 1vch s VAL 130 CO -0.00 0.50 0.00 0.00 -3.33 0.00 0.00 175.10 172.27 1vch n ALA 131 N 3.60 1.18 0.09 1.54 0.00 -1.26 -1.29 120.51 124.37 1vch n ALA 131 Ca -0.20 0.00 -0.17 0.00 0.00 0.00 0.00 53.44 53.07 1vch n ALA 131 Cb 0.53 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.87 1vch n ALA 131 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1vch h SER 132 N 0.00 0.59 0.00 0.00 4.64 -1.88 -3.07 113.55 113.84 1vch h SER 132 Ca 0.00 -0.56 0.00 0.00 -0.47 0.00 0.00 61.79 60.76 1vch h SER 132 Cb 0.00 -0.19 0.00 0.00 -0.31 0.00 0.00 62.40 61.90 1vch h SER 132 CO 0.00 1.39 0.00 0.61 -0.87 0.00 0.00 176.83 177.96 1vch n GLY 133 N 1.31 0.51 0.36 -0.77 0.00 -1.26 -0.06 105.19 105.28 1vch n GLY 133 Ca -0.10 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.92 1vch n GLY 133 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1vch h GLU 134 N 4.27 1.17 -0.47 1.61 4.39 -1.93 -0.45 114.58 123.18 1vch h GLU 134 Ca 0.00 -0.07 -0.01 0.00 0.34 0.00 0.00 59.36 59.62 1vch h GLU 134 Cb 0.00 -0.26 -0.02 0.00 -0.10 0.00 0.00 28.75 28.36 1vch h GLU 134 CO 0.00 0.77 0.25 1.15 -1.16 0.00 0.00 179.01 180.02 1vch h THR 135 N 1.20 1.17 -0.07 1.13 2.02 -1.94 -1.39 112.91 115.03 1vch h THR 135 Ca 0.38 -0.45 -0.08 0.00 0.77 0.00 0.00 66.41 67.02 1vch h THR 135 Cb -0.01 0.62 -0.01 0.00 -1.74 0.00 0.00 68.15 67.01 1vch h THR 135 CO -0.12 0.18 -0.33 0.24 0.37 0.00 0.00 175.52 175.86 1vch h MET 136 N 0.61 0.14 -0.56 6.66 2.86 -1.85 0.18 114.93 122.98 1vch h MET 136 Ca 0.16 -0.05 -0.07 0.00 -2.06 0.00 0.00 59.70 57.68 1vch h MET 136 Cb 0.07 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.70 1vch h MET 136 CO -0.02 0.46 0.09 0.00 1.06 0.00 0.00 176.91 178.49 1vch h ARG 137 N 0.12 0.93 -0.36 1.72 3.08 -0.62 0.47 114.38 119.72 1vch h ARG 137 Ca 0.02 -0.25 -0.03 0.00 0.07 0.00 0.00 59.98 59.79 1vch h ARG 137 Cb 0.65 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 30.58 1vch h ARG 137 CO 0.05 0.89 0.11 0.00 -1.07 0.00 0.00 179.97 179.96 1vch h ALA 138 N 1.00 0.47 -0.46 0.04 0.00 -0.79 -1.97 119.26 117.55 1vch h ALA 138 Ca 0.17 -0.16 0.02 0.00 0.00 0.00 0.00 54.91 54.94 1vch h ALA 138 Cb 0.42 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.04 1vch h ALA 138 CO 0.01 0.11 0.28 0.52 0.00 0.00 0.00 179.25 180.17 1vch h MET 139 N 0.43 0.55 -0.79 0.00 2.86 -0.66 -2.03 114.93 115.29 1vch h MET 139 Ca 0.12 -0.03 0.01 0.00 -2.06 0.00 0.00 59.70 57.73 1vch h MET 139 Cb 0.25 -0.12 -0.04 0.00 0.06 0.00 0.00 31.60 31.75 1vch h MET 139 CO -0.00 0.36 0.52 1.49 1.06 0.00 0.00 176.91 180.34 1vch h GLU 140 N 0.56 1.03 -0.33 1.72 4.81 -0.75 -0.73 114.58 120.89 1vch h GLU 140 Ca 0.18 -0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 59.33 1vch h GLU 140 Cb -0.01 -0.23 -0.02 0.00 0.63 0.00 0.00 28.75 29.12 1vch h GLU 140 CO -0.07 0.68 0.11 0.87 -0.73 0.00 0.00 179.01 179.87 1vch h LYS 141 N 1.06 0.46 -0.31 1.92 1.57 -0.95 -0.48 116.57 119.84 1vch h LYS 141 Ca 0.29 -0.06 -0.13 0.00 -1.87 0.00 0.00 60.65 58.88 1vch h LYS 141 Cb -0.11 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.10 1vch h LYS 141 CO -0.07 0.41 -0.33 0.52 -0.57 0.00 0.00 179.45 179.41 1vch h MET 142 N 0.46 0.67 -0.15 3.15 2.86 -0.57 -1.27 114.93 120.09 1vch h MET 142 Ca 0.11 -0.31 -0.00 0.00 -2.06 0.00 0.00 59.70 57.44 1vch h MET 142 Cb 0.13 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.77 1vch h MET 142 CO -0.01 0.91 0.08 0.28 1.06 0.00 0.00 176.91 179.23 1vch h VAL 143 N 0.57 1.09 -0.57 -2.22 2.07 0.26 -1.80 116.25 115.65 1vch h VAL 143 Ca 0.06 -0.25 0.00 0.00 0.82 0.00 0.00 66.70 67.34 1vch h VAL 143 Cb 0.84 0.99 -0.03 0.00 -1.52 0.00 0.00 31.29 31.57 1vch h VAL 143 CO 0.07 0.09 0.38 -0.07 0.02 0.00 0.00 177.57 178.05 1vch h LEU 144 N 0.15 0.66 -1.86 2.57 3.38 -0.99 -2.12 115.31 117.10 1vch h LEU 144 Ca 0.05 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.98 1vch h LEU 144 Cb 0.06 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.65 1vch h LEU 144 CO -0.01 0.48 -0.10 0.03 0.09 0.00 0.00 178.44 178.93 1vch h ARG 145 N 0.77 0.00 0.00 1.13 3.08 -1.03 -1.47 114.38 116.86 1vch h ARG 145 Ca 0.21 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.26 1vch h ARG 145 Cb -0.08 0.00 0.00 0.00 0.08 0.00 0.00 29.97 29.97 1vch h ARG 145 CO -0.04 0.10 -0.23 0.00 -1.07 0.00 0.00 179.97 178.73 1vch n ALA 146 N -2.48 2.77 0.00 0.04 0.00 -0.69 -4.94 120.51 115.21 1vch n ALA 146 Ca -0.03 -0.19 0.00 0.00 0.00 0.00 0.00 53.44 53.23 1vch n ALA 146 Cb 0.18 -1.33 0.00 0.00 0.00 0.00 0.00 19.45 18.30 1vch n ALA 146 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1vch n GLY 147 N 1.46 1.55 0.00 0.00 0.00 -0.55 -3.77 105.19 103.87 1vch n GLY 147 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.08 1vch n GLY 147 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1vch n GLY 148 N -1.36 4.31 3.36 -0.02 0.00 -0.88 0.11 105.19 110.71 1vch n GLY 148 Ca 0.00 -1.70 -0.15 0.00 0.00 0.00 0.00 46.02 44.17 1vch n GLY 148 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1vch s HIS 149 N -1.67 -0.37 -0.23 1.61 -3.43 -1.09 -3.68 115.29 106.43 1vch s HIS 149 Ca 0.00 0.54 -0.29 0.00 -0.80 0.00 0.00 55.06 54.50 1vch s HIS 149 Cb 0.00 0.24 -0.00 0.00 -1.43 0.00 0.00 32.58 31.39 1vch s HIS 149 CO 0.00 -0.52 1.22 0.08 -2.00 0.00 0.00 174.74 173.51 1vch s VAL 150 N -1.66 4.33 -1.76 -5.38 1.01 -1.26 -0.95 120.40 114.73 1vch s VAL 150 Ca -0.10 1.57 0.21 0.00 0.00 0.00 0.00 61.98 63.66 1vch s VAL 150 Cb -0.02 -4.15 -0.04 0.00 0.00 0.00 0.00 36.38 32.17 1vch s VAL 150 CO 0.04 -0.29 1.00 1.33 0.00 0.00 0.00 175.10 177.19 1vch n VAL 151 N 5.67 0.00 -3.62 2.92 0.24 0.60 -4.90 118.33 119.24 1vch n VAL 151 Ca 0.14 -0.24 -0.07 0.00 -2.04 0.00 0.00 64.34 62.13 1vch n VAL 151 Cb 0.46 1.21 -0.06 0.00 -1.47 0.00 0.00 33.84 33.98 1vch n VAL 151 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1vch s ALA 152 N -2.42 -2.04 -0.12 2.33 0.00 -1.22 -4.90 121.76 113.39 1vch s ALA 152 Ca 0.16 1.74 0.00 0.00 0.00 0.00 0.00 51.96 53.86 1vch s ALA 152 Cb 0.17 -1.28 0.02 0.00 0.00 0.00 0.00 23.12 22.03 1vch s ALA 152 CO 0.58 -0.23 -0.11 1.03 0.00 0.00 0.00 175.76 177.02 1vch s ARG 153 N -0.54 1.87 0.05 0.00 0.52 -1.26 -0.69 118.95 118.91 1vch s ARG 153 Ca 0.04 -0.40 0.05 0.00 -0.52 0.00 0.00 55.73 54.90 1vch s ARG 153 Cb -0.03 -1.80 -0.02 0.00 0.52 0.00 0.00 34.95 33.62 1vch s ARG 153 CO -0.06 -0.23 -0.15 -0.51 0.02 0.00 0.00 175.30 174.38 1vch s LEU 154 N 1.53 2.21 -0.05 2.53 1.43 0.93 -1.45 118.68 125.81 1vch s LEU 154 Ca 0.03 -0.52 -0.14 0.00 -1.03 0.00 0.00 54.13 52.48 1vch s LEU 154 Cb -0.13 -0.61 0.03 0.00 0.03 0.00 0.00 46.19 45.51 1vch s LEU 154 CO -0.08 0.01 0.32 0.00 0.23 0.00 0.00 176.35 176.82 1vch s ALA 155 N -0.98 -0.79 0.02 4.21 0.00 -0.68 -1.31 121.76 122.23 1vch s ALA 155 Ca 0.01 0.51 -0.25 0.00 0.00 0.00 0.00 51.96 52.23 1vch s ALA 155 Cb -0.09 -0.12 -0.17 0.00 0.00 0.00 0.00 23.12 22.74 1vch s ALA 155 CO 0.02 -0.23 1.33 0.28 0.00 0.00 0.00 175.76 177.16 1vch h VAL 156 N 4.11 0.89 -3.40 0.00 2.07 -1.13 -3.30 116.25 115.49 1vch h VAL 156 Ca -0.29 -0.61 -0.66 0.00 0.82 0.00 0.00 66.70 65.96 1vch h VAL 156 Cb 1.18 1.25 -0.13 0.00 -1.52 0.00 0.00 31.29 32.07 1vch h VAL 156 CO 0.37 0.14 -0.67 -0.36 0.02 0.00 0.00 177.57 177.06 1vch s PHE 157 N -4.85 2.96 -0.17 1.57 0.08 -0.34 -1.87 117.98 115.36 1vch s PHE 157 Ca -0.15 -0.03 -0.01 0.00 0.12 0.00 0.00 56.93 56.86 1vch s PHE 157 Cb 0.03 -1.55 -0.01 0.00 -0.57 0.00 0.00 43.02 40.92 1vch s PHE 157 CO 0.60 0.46 -0.12 0.50 -0.10 0.00 0.00 175.22 176.56 1vch s ARG 158 N -2.11 3.31 -0.31 0.44 3.52 0.91 -1.38 118.95 123.34 1vch s ARG 158 Ca 0.24 -0.69 -0.04 0.00 -0.13 0.00 0.00 55.73 55.10 1vch s ARG 158 Cb -0.12 -2.74 0.04 0.00 -1.56 0.00 0.00 34.95 30.58 1vch s ARG 158 CO 0.16 0.01 0.04 -1.14 -0.81 0.00 0.00 175.30 173.56 1vch s GLN 159 N 0.86 2.63 5.08 5.12 0.74 -0.41 0.95 119.66 134.62 1vch s GLN 159 Ca -0.03 -1.15 0.00 0.00 0.05 0.00 0.00 55.36 54.23 1vch s GLN 159 Cb -0.15 -3.27 0.00 0.00 1.10 0.00 0.00 33.01 30.69 1vch s GLN 159 CO 0.00 -0.58 0.00 0.41 -0.55 0.00 0.00 175.29 174.57 1vch n GLY 160 N 4.72 1.45 2.94 2.59 0.00 -1.26 -4.48 105.19 111.16 1vch n GLY 160 Ca -0.14 -0.67 -0.30 0.00 0.00 0.00 0.00 46.02 44.91 1vch n GLY 160 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1vch s THR 161 N 0.00 1.62 0.54 2.61 -4.23 -1.26 -5.04 115.64 109.88 1vch s THR 161 Ca 0.00 -1.39 -0.21 0.00 -1.18 0.00 0.00 61.69 58.91 1vch s THR 161 Cb 0.00 -1.92 -0.05 0.00 1.34 0.00 0.00 72.50 71.87 1vch s THR 161 CO 0.00 -0.19 1.28 -2.84 -0.54 0.00 0.00 174.62 172.33 1vch s PRO 162 N 1.33 3.22 -0.12 3.99 0.02 -1.16 -4.83 135.00 137.45 1vch s PRO 162 Ca -0.03 2.05 0.06 0.00 0.02 0.00 0.00 61.00 63.10 1vch s PRO 162 Cb -0.19 -2.21 0.37 0.00 0.02 0.00 0.00 34.50 32.49 1vch s PRO 162 CO -0.08 -1.07 1.11 0.41 -0.33 0.00 0.00 177.00 177.04 1vch n GLY 163 N 0.64 2.27 3.15 0.52 0.00 0.91 -4.81 105.19 107.87 1vch n GLY 163 Ca 0.11 -0.43 -0.11 0.00 0.00 0.00 0.00 46.02 45.59 1vch n GLY 163 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1vch s LEU 164 N -1.29 1.44 -0.45 0.99 2.96 -1.25 -4.98 118.68 116.12 1vch s LEU 164 Ca 0.25 -0.27 -0.29 0.00 -0.22 0.00 0.00 54.13 53.61 1vch s LEU 164 Cb 0.19 0.83 0.02 0.00 0.50 0.00 0.00 46.19 47.73 1vch s LEU 164 CO 0.07 -0.46 1.21 0.00 -1.32 0.00 0.00 176.35 175.85 1vch s ALA 165 N -1.91 3.16 -0.02 5.97 0.00 -1.26 -4.99 121.76 122.70 1vch s ALA 165 Ca -0.10 -0.35 0.00 0.00 0.00 0.00 0.00 51.96 51.51 1vch s ALA 165 Cb -0.04 -3.89 0.03 0.00 0.00 0.00 0.00 23.12 19.21 1vch s ALA 165 CO -0.01 -2.23 0.02 0.08 0.00 0.00 0.00 175.76 173.63 1vch s VAL 166 N 4.65 -0.02 -0.07 0.00 1.01 -1.26 -4.73 120.40 119.98 1vch s VAL 166 Ca 0.51 0.19 -0.30 0.00 0.00 0.00 0.00 61.98 62.39 1vch s VAL 166 Cb -0.09 -0.11 -0.02 0.00 0.00 0.00 0.00 36.38 36.16 1vch s VAL 166 CO 0.31 0.09 1.04 -1.81 0.00 0.00 0.00 175.10 174.73 1vch s ASP 167 N 1.02 7.23 0.22 3.32 1.11 -0.53 -4.93 116.67 124.11 1vch s ASP 167 Ca -0.09 1.62 0.03 0.00 0.18 0.00 0.00 52.55 54.30 1vch s ASP 167 Cb -0.12 -2.56 -0.05 0.00 1.07 0.00 0.00 42.92 41.25 1vch s ASP 167 CO -0.03 -0.43 -0.01 0.42 1.18 0.00 0.00 175.17 176.30 1vch s THR 168 N 1.80 1.02 -0.20 -1.27 -4.23 -1.26 -1.68 115.64 109.82 1vch s THR 168 Ca 0.51 -2.03 0.07 0.00 -1.18 0.00 0.00 61.69 59.05 1vch s THR 168 Cb -0.20 -2.31 -0.08 0.00 1.34 0.00 0.00 72.50 71.25 1vch s THR 168 CO 0.21 -0.35 0.23 1.33 -0.54 0.00 0.00 174.62 175.50 1vch n VAL 169 N -0.40 0.00 -3.74 2.29 0.24 -0.79 -5.02 118.33 110.90 1vch n VAL 169 Ca -0.05 -0.28 -0.10 0.00 -2.04 0.00 0.00 64.34 61.87 1vch n VAL 169 Cb 0.64 0.77 -0.06 0.00 -1.47 0.00 0.00 33.84 33.71 1vch n VAL 169 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1vch s ALA 170 N -1.91 -0.60 -0.13 2.33 0.00 -0.78 -5.04 121.76 115.63 1vch s ALA 170 Ca 0.01 -0.28 -0.05 0.00 0.00 0.00 0.00 51.96 51.63 1vch s ALA 170 Cb 0.05 0.55 -0.04 0.00 0.00 0.00 0.00 23.12 23.68 1vch s ALA 170 CO 0.27 -0.55 0.06 -2.00 0.00 0.00 0.00 175.76 173.53 1vch s GLU 171 N -3.66 3.44 -0.33 0.00 2.12 -1.26 -0.06 118.70 118.96 1vch s GLU 171 Ca 0.03 -0.32 -0.12 0.00 0.36 0.00 0.00 54.97 54.92 1vch s GLU 171 Cb 0.03 -3.03 -0.02 0.00 0.26 0.00 0.00 34.13 31.36 1vch s GLU 171 CO -0.10 0.57 0.22 -1.17 -0.54 0.00 0.00 175.26 174.23 1vch s LEU 172 N -0.48 4.37 0.46 2.70 2.96 0.27 -4.81 118.68 124.15 1vch s LEU 172 Ca 0.10 -0.38 -0.21 0.00 -0.22 0.00 0.00 54.13 53.42 1vch s LEU 172 Cb -0.12 -2.11 -0.09 0.00 0.50 0.00 0.00 46.19 44.37 1vch s LEU 172 CO 0.02 -0.20 1.02 -2.16 -1.32 0.00 0.00 176.35 173.71 1vch s PRO 173 N 1.71 3.96 -0.24 0.98 0.04 -1.26 -4.30 135.00 135.89 1vch s PRO 173 Ca 0.06 1.34 -0.08 0.00 0.04 0.00 0.00 61.00 62.36 1vch s PRO 173 Cb -0.17 -2.21 -0.04 0.00 0.04 0.00 0.00 34.50 32.13 1vch s PRO 173 CO 0.10 -0.29 0.09 0.08 0.04 0.00 0.00 177.00 177.02 1vch s VAL 174 N -1.95 4.61 -2.74 -0.36 1.01 -1.26 -4.15 120.40 115.55 1vch s VAL 174 Ca 0.64 -0.08 0.22 0.00 0.00 0.00 0.00 61.98 62.77 1vch s VAL 174 Cb -0.16 -3.15 0.17 0.00 0.00 0.00 0.00 36.38 33.24 1vch s VAL 174 CO 0.20 0.34 1.19 0.18 0.00 0.00 0.00 175.10 177.01