#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vhv s LEU 1 N 0.00 -0.31 -0.19 2.46 2.96 -0.82 -4.49 118.68 118.30 1vhv s LEU 1 Ca 0.00 0.46 0.01 0.00 -0.22 0.00 0.00 54.13 54.38 1vhv s LEU 1 Cb 0.00 1.66 0.03 0.00 0.50 0.00 0.00 46.19 48.39 1vhv s LEU 1 CO 0.00 -0.20 -0.15 -0.22 -1.32 0.00 0.00 176.35 174.46 1vhv s LEU 2 N -0.55 2.23 -0.17 -0.68 2.96 -0.83 -0.25 118.68 121.40 1vhv s LEU 2 Ca 0.02 -0.77 -0.02 0.00 -0.22 0.00 0.00 54.13 53.14 1vhv s LEU 2 Cb -0.02 -1.35 -0.01 0.00 0.50 0.00 0.00 46.19 45.31 1vhv s LEU 2 CO -0.04 -0.08 -0.09 -0.89 -1.32 0.00 0.00 176.35 173.93 1vhv s THR 3 N 1.34 3.28 -0.21 3.68 2.01 0.09 -2.01 115.64 123.82 1vhv s THR 3 Ca 0.01 -0.56 -0.16 0.00 0.31 0.00 0.00 61.69 61.29 1vhv s THR 3 Cb -0.15 -2.43 -0.04 0.00 0.01 0.00 0.00 72.50 69.90 1vhv s THR 3 CO -0.10 0.48 0.42 -0.36 -0.69 0.00 0.00 174.62 174.37 1vhv s PHE 4 N 0.79 3.35 -0.10 4.92 0.40 -0.18 -0.88 117.98 126.28 1vhv s PHE 4 Ca -0.03 0.61 0.01 0.00 -0.60 0.00 0.00 56.93 56.92 1vhv s PHE 4 Cb -0.15 -2.56 0.02 0.00 0.51 0.00 0.00 43.02 40.84 1vhv s PHE 4 CO 0.01 -0.07 -0.12 0.08 0.70 0.00 0.00 175.22 175.83 1vhv s VAL 5 N 1.51 1.25 0.23 -0.44 1.01 -0.53 -0.24 120.40 123.20 1vhv s VAL 5 Ca 0.19 -0.48 -0.30 0.00 0.00 0.00 0.00 61.98 61.40 1vhv s VAL 5 Cb -0.15 -1.18 -0.09 0.00 0.00 0.00 0.00 36.38 34.96 1vhv s VAL 5 CO 0.08 0.40 1.05 -0.83 0.00 0.00 0.00 175.10 175.80 1vhv s GLY 6 N 1.20 3.02 0.14 4.51 0.00 -0.18 -1.49 107.32 114.52 1vhv s GLY 6 Ca -0.03 0.79 0.23 0.00 0.00 0.00 0.00 44.72 45.70 1vhv s GLY 6 CO -0.03 1.47 1.11 1.04 0.00 0.00 0.00 173.10 176.68 1vhv n LEU 7 N 1.68 0.72 0.00 0.66 4.77 0.10 -4.45 117.00 120.48 1vhv n LEU 7 Ca -0.00 0.21 0.00 0.00 -0.03 0.00 0.00 56.01 56.19 1vhv n LEU 7 Cb 0.46 -0.10 0.00 0.00 -2.33 0.00 0.00 43.42 41.44 1vhv n LEU 7 CO 0.53 -0.09 0.00 0.61 -1.33 0.00 0.00 177.39 177.11 1vhv n GLY 8 N 1.27 -1.83 0.07 -0.72 0.00 -0.75 -3.00 105.19 100.24 1vhv n GLY 8 Ca 0.01 -1.70 0.01 0.00 0.00 0.00 0.00 46.02 44.34 1vhv n GLY 8 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1vhv n LEU 9 N 0.00 0.35 0.09 0.99 4.77 -1.26 -0.06 117.00 121.89 1vhv n LEU 9 Ca 0.00 0.15 0.00 0.00 -0.03 0.00 0.00 56.01 56.13 1vhv n LEU 9 Cb 0.00 0.17 0.00 0.00 -2.33 0.00 0.00 43.42 41.26 1vhv n LEU 9 CO 0.00 0.19 -0.03 1.87 -1.33 0.00 0.00 177.39 178.09 1vhv n TRP 10 N -2.65 -1.37 -4.54 -1.77 -0.00 -1.26 -4.74 117.44 101.10 1vhv n TRP 10 Ca -0.14 0.24 -0.27 0.00 -0.00 0.00 0.00 57.50 57.33 1vhv n TRP 10 Cb 0.84 0.36 -0.07 0.00 -0.00 0.00 0.00 31.31 32.44 1vhv n TRP 10 CO 0.00 0.00 0.00 -0.40 -0.00 0.00 0.00 177.69 177.29 1vhv n ASP 11 N -3.37 1.47 0.14 5.87 5.68 -1.26 -0.72 116.55 124.36 1vhv n ASP 11 Ca 0.00 -3.25 0.16 0.00 -0.50 0.00 0.00 54.79 51.20 1vhv n ASP 11 Cb 0.03 0.99 0.72 0.00 -1.14 0.00 0.00 41.12 41.72 1vhv n ASP 11 CO 0.00 0.00 0.00 -0.37 -1.33 0.00 0.00 177.20 175.50 1vhv h VAL 12 N 1.65 0.73 -0.03 2.12 -1.51 -1.97 -0.57 116.25 116.68 1vhv h VAL 12 Ca -0.34 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.13 1vhv h VAL 12 Cb 1.26 0.84 0.00 0.00 -2.13 0.00 0.00 31.29 31.26 1vhv h VAL 12 CO 0.54 0.00 0.00 0.29 -1.23 0.00 0.00 177.57 177.17 1vhv n LYS 13 N -4.26 1.15 0.00 5.19 5.02 -1.26 -3.54 118.16 120.47 1vhv n LYS 13 Ca 0.04 -0.22 0.14 0.00 -2.02 0.00 0.00 58.31 56.24 1vhv n LYS 13 Cb 0.37 -1.33 0.67 0.00 -0.02 0.00 0.00 35.03 34.72 1vhv n LYS 13 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1vhv n ASP 14 N -0.58 0.02 -4.79 4.39 8.00 -0.22 -4.81 116.55 118.56 1vhv n ASP 14 Ca 0.15 0.22 -0.34 0.00 0.71 0.00 0.00 54.79 55.53 1vhv n ASP 14 Cb 0.12 -0.40 0.00 0.00 -0.02 0.00 0.00 41.12 40.83 1vhv n ASP 14 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 1vhv s ILE 15 N -2.82 3.49 0.65 0.53 2.07 -1.16 -4.33 121.20 119.62 1vhv s ILE 15 Ca 0.20 0.84 -0.13 0.00 -1.41 0.00 0.00 60.65 60.15 1vhv s ILE 15 Cb 0.19 -3.32 -0.01 0.00 0.13 0.00 0.00 42.46 39.45 1vhv s ILE 15 CO 0.51 -0.29 1.06 -0.94 -1.91 0.00 0.00 174.94 173.37 1vhv s SER 16 N -2.17 5.47 0.32 4.50 1.04 -1.26 -4.85 113.70 116.74 1vhv s SER 16 Ca 0.68 1.74 0.00 0.00 0.48 0.00 0.00 55.95 58.86 1vhv s SER 16 Cb -0.20 -2.52 0.54 0.00 0.10 0.00 0.00 66.02 63.94 1vhv s SER 16 CO 0.29 -1.38 1.97 0.58 0.98 0.00 0.00 173.24 175.68 1vhv h VAL 17 N -0.20 1.16 -0.61 5.02 2.07 -1.95 -0.47 116.25 121.27 1vhv h VAL 17 Ca -0.45 -0.34 -0.06 0.00 0.82 0.00 0.00 66.70 66.66 1vhv h VAL 17 Cb 1.22 0.06 -0.03 0.00 -1.52 0.00 0.00 31.29 31.02 1vhv h VAL 17 CO 0.56 0.18 0.14 0.50 0.02 0.00 0.00 177.57 178.98 1vhv h LYS 18 N 1.01 0.95 -0.35 1.57 3.64 -1.99 -1.17 116.57 120.22 1vhv h LYS 18 Ca 0.30 -0.21 -0.05 0.00 -1.27 0.00 0.00 60.65 59.42 1vhv h LYS 18 Cb -0.02 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 31.65 1vhv h LYS 18 CO -0.08 0.86 0.02 0.78 -2.27 0.00 0.00 179.45 178.76 1vhv h GLY 19 N 1.03 0.65 1.02 5.01 0.00 -1.62 -1.60 103.07 107.56 1vhv h GLY 19 Ca 0.19 -0.46 -0.01 0.00 0.00 0.00 0.00 47.33 47.05 1vhv h GLY 19 CO 0.00 0.42 0.44 -2.00 0.00 0.00 0.00 176.54 175.41 1vhv h LEU 20 N 0.42 0.99 -0.94 3.11 5.85 -0.61 -0.78 115.31 123.36 1vhv h LEU 20 Ca 0.10 -0.09 -0.07 0.00 0.84 0.00 0.00 57.88 58.66 1vhv h LEU 20 Cb 0.42 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.17 1vhv h LEU 20 CO 0.01 0.80 0.05 -0.33 -0.34 0.00 0.00 178.44 178.63 1vhv h GLU 21 N 1.10 0.83 -0.47 1.25 5.08 -1.07 -0.94 114.58 120.36 1vhv h GLU 21 Ca 0.28 -0.20 -0.13 0.00 -1.00 0.00 0.00 59.36 58.31 1vhv h GLU 21 Cb 0.02 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.15 1vhv h GLU 21 CO -0.05 0.80 -0.20 0.00 -1.00 0.00 0.00 179.01 178.56 1vhv h ALA 22 N 1.27 0.66 -0.59 3.43 0.00 -0.72 0.20 119.26 123.52 1vhv h ALA 22 Ca 0.16 -0.38 -0.09 0.00 0.00 0.00 0.00 54.91 54.60 1vhv h ALA 22 Cb 0.40 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 1vhv h ALA 22 CO 0.01 0.64 0.03 0.28 0.00 0.00 0.00 179.25 180.21 1vhv h VAL 23 N 0.82 1.26 -0.02 0.00 2.07 -0.92 -0.66 116.25 118.80 1vhv h VAL 23 Ca 0.11 -1.10 -0.12 0.00 0.82 0.00 0.00 66.70 66.41 1vhv h VAL 23 Cb 0.78 0.81 -0.02 0.00 -1.52 0.00 0.00 31.29 31.35 1vhv h VAL 23 CO 0.06 0.40 -0.53 0.03 0.02 0.00 0.00 177.57 177.55 1vhv h ARG 24 N 0.91 0.07 0.00 1.57 3.08 -0.88 -2.97 114.38 116.16 1vhv h ARG 24 Ca 0.17 -0.04 -0.12 0.00 0.07 0.00 0.00 59.98 60.06 1vhv h ARG 24 Cb 0.52 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.55 1vhv h ARG 24 CO 0.03 0.58 -0.57 0.93 -1.07 0.00 0.00 179.97 179.87 1vhv h GLU 25 N 0.05 0.00 -6.90 0.04 4.39 -0.75 -3.47 114.58 107.93 1vhv h GLU 25 Ca -0.00 0.00 -0.56 0.00 0.34 0.00 0.00 59.36 59.14 1vhv h GLU 25 Cb 0.96 0.00 0.14 0.00 -0.10 0.00 0.00 28.75 29.75 1vhv h GLU 25 CO 0.07 0.57 0.44 0.00 -1.16 0.00 0.00 179.01 178.94 1vhv n ALA 26 N -2.27 1.11 -0.04 3.43 0.00 -0.27 -4.96 120.51 117.51 1vhv n ALA 26 Ca 0.01 0.15 -0.14 0.00 0.00 0.00 0.00 53.44 53.46 1vhv n ALA 26 Cb 0.71 -2.26 -0.11 0.00 0.00 0.00 0.00 19.45 17.79 1vhv n ALA 26 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1vhv h ASP 27 N 1.45 0.12 -4.12 0.00 3.32 -0.69 -3.46 116.42 113.06 1vhv h ASP 27 Ca -0.49 -0.77 -0.59 0.00 0.02 0.00 0.00 57.03 55.21 1vhv h ASP 27 Cb 1.32 -0.04 -0.31 0.00 0.22 0.00 0.00 39.33 40.52 1vhv h ASP 27 CO 0.57 0.88 -0.85 -1.61 -1.72 0.00 0.00 179.24 176.51 1vhv s GLU 28 N -3.14 1.78 -0.15 3.56 2.02 -1.10 -5.03 118.70 116.64 1vhv s GLU 28 Ca -0.17 -0.68 0.02 0.00 0.02 0.00 0.00 54.97 54.16 1vhv s GLU 28 Cb 0.00 -1.61 0.02 0.00 0.10 0.00 0.00 34.13 32.64 1vhv s GLU 28 CO 0.72 0.33 -0.19 0.08 0.02 0.00 0.00 175.26 176.22 1vhv s VAL 29 N -0.19 1.87 0.30 2.63 1.01 -1.26 -1.30 120.40 123.46 1vhv s VAL 29 Ca 0.01 -0.84 0.11 0.00 0.00 0.00 0.00 61.98 61.26 1vhv s VAL 29 Cb -0.10 -1.69 -0.05 0.00 0.00 0.00 0.00 36.38 34.54 1vhv s VAL 29 CO 0.01 0.51 -0.14 -0.31 0.00 0.00 0.00 175.10 175.17 1vhv s TYR 30 N 1.11 2.37 0.01 5.22 2.02 0.11 -2.03 117.35 126.17 1vhv s TYR 30 Ca -0.01 -0.37 -0.01 0.00 -0.37 0.00 0.00 57.07 56.31 1vhv s TYR 30 Cb -0.14 -1.14 -0.01 0.00 -0.40 0.00 0.00 41.96 40.26 1vhv s TYR 30 CO -0.07 0.66 -0.01 0.54 -1.57 0.00 0.00 175.55 175.10 1vhv s VAL 31 N -2.52 0.09 0.02 0.71 0.11 -0.23 0.43 120.40 119.01 1vhv s VAL 31 Ca 0.31 -0.74 0.06 0.00 -2.93 0.00 0.00 61.98 58.69 1vhv s VAL 31 Cb -0.03 -0.23 -0.02 0.00 -1.53 0.00 0.00 36.38 34.57 1vhv s VAL 31 CO 0.16 -0.41 -0.19 -1.83 -3.33 0.00 0.00 175.10 169.51 1vhv s GLU 32 N -1.20 1.36 -0.19 1.54 4.04 -0.82 0.14 118.70 123.57 1vhv s GLU 32 Ca -0.13 -0.79 0.16 0.00 0.04 0.00 0.00 54.97 54.26 1vhv s GLU 32 Cb -0.08 -1.39 0.45 0.00 0.02 0.00 0.00 34.13 33.13 1vhv s GLU 32 CO -0.01 0.36 1.18 0.66 -1.84 0.00 0.00 175.26 175.62 1vhv n TYR 33 N 2.20 0.91 -0.08 4.83 4.02 -1.26 -4.39 117.16 123.39 1vhv n TYR 33 Ca -0.16 -1.55 -0.18 0.00 -0.01 0.00 0.00 57.90 56.00 1vhv n TYR 33 Cb 0.54 -0.24 -0.13 0.00 -0.02 0.00 0.00 39.34 39.48 1vhv n TYR 33 CO 0.00 0.00 0.00 0.98 -1.01 0.00 0.00 176.86 176.83 1vhv n TYR 34 N -0.50 0.41 0.15 -0.72 9.36 -1.26 -4.44 117.16 120.15 1vhv n TYR 34 Ca 0.19 0.09 0.04 0.00 3.32 0.00 0.00 57.90 61.54 1vhv n TYR 34 Cb 0.90 -1.06 0.10 0.00 -0.63 0.00 0.00 39.34 38.65 1vhv n TYR 34 CO 0.00 0.00 0.00 1.79 0.22 0.00 0.00 176.86 178.87 1vhv h THR 35 N 0.02 0.82 -1.49 2.97 1.35 -1.98 -3.48 112.91 111.12 1vhv h THR 35 Ca -0.52 -2.03 0.00 0.00 -0.55 0.00 0.00 66.41 63.31 1vhv h THR 35 Cb 1.98 2.31 -0.00 0.00 -1.73 0.00 0.00 68.15 70.70 1vhv h THR 35 CO -0.02 0.45 0.01 -0.24 -0.25 0.00 0.00 175.52 175.46 1vhv n SER 36 N -3.27 -0.02 -3.67 5.36 2.88 -1.26 -5.06 113.62 108.59 1vhv n SER 36 Ca 0.02 -1.01 -0.10 0.00 -1.33 0.00 0.00 58.87 56.45 1vhv n SER 36 Cb 0.68 0.03 -0.05 0.00 -0.75 0.00 0.00 64.21 64.12 1vhv n SER 36 CO 0.00 0.00 0.00 -1.59 -1.23 0.00 0.00 175.04 172.22 1vhv s LYS 37 N -2.00 1.09 0.50 -1.46 0.00 -1.26 -4.48 119.74 112.12 1vhv s LYS 37 Ca 0.00 -0.76 0.04 0.00 0.00 0.00 0.00 55.97 55.25 1vhv s LYS 37 Cb -0.00 0.46 -0.01 0.00 0.00 0.00 0.00 37.83 38.28 1vhv s LYS 37 CO 0.00 -0.42 0.15 -0.51 0.00 0.00 0.00 175.35 174.57 1vhv s LEU 38 N -2.82 2.60 -0.02 2.77 1.43 -1.26 -4.91 118.68 116.47 1vhv s LEU 38 Ca 0.04 -1.41 -0.26 0.00 -1.03 0.00 0.00 54.13 51.47 1vhv s LEU 38 Cb 0.02 -1.00 -0.20 0.00 0.03 0.00 0.00 46.19 45.03 1vhv s LEU 38 CO -0.11 -0.85 1.25 0.25 0.23 0.00 0.00 176.35 177.13 1vhv h LEU 39 N 1.21 0.02 -9.09 1.79 5.85 -1.22 -3.46 115.31 110.42 1vhv h LEU 39 Ca -0.42 -0.51 -0.66 0.00 0.84 0.00 0.00 57.88 57.14 1vhv h LEU 39 Cb 1.30 -0.01 0.11 0.00 0.37 0.00 0.00 40.66 42.43 1vhv h LEU 39 CO 0.69 0.53 -0.42 -1.20 -0.34 0.00 0.00 178.44 177.70 1vhv n SER 40 N -4.83 -0.83 -5.00 1.25 7.64 -1.25 -5.01 113.62 105.60 1vhv n SER 40 Ca -0.08 1.13 -0.18 0.00 1.01 0.00 0.00 58.87 60.74 1vhv n SER 40 Cb 0.27 -1.01 0.01 0.00 -1.01 0.00 0.00 64.21 62.47 1vhv n SER 40 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1vhv s SER 41 N -0.92 5.68 0.44 6.43 1.04 -1.26 -5.01 113.70 120.09 1vhv s SER 41 Ca 0.63 -0.28 0.16 0.00 0.48 0.00 0.00 55.95 56.94 1vhv s SER 41 Cb -0.88 -0.85 0.99 0.00 0.10 0.00 0.00 66.02 65.38 1vhv s SER 41 CO 0.57 -0.74 1.95 -0.29 0.98 0.00 0.00 173.24 175.71 1vhv h ILE 42 N 0.60 1.08 -0.31 -1.02 2.10 -1.97 -2.36 117.51 115.63 1vhv h ILE 42 Ca -0.42 -0.82 -0.16 0.00 1.08 0.00 0.00 64.86 64.55 1vhv h ILE 42 Cb 1.28 1.45 -0.00 0.00 -1.09 0.00 0.00 36.82 38.45 1vhv h ILE 42 CO 0.48 0.23 -0.42 -0.33 -1.08 0.00 0.00 178.15 177.03 1vhv h GLU 43 N 0.00 0.83 -0.73 2.19 3.07 -1.95 -1.59 114.58 116.41 1vhv h GLU 43 Ca -0.00 -0.48 0.00 0.00 -0.50 0.00 0.00 59.36 58.38 1vhv h GLU 43 Cb 0.43 0.04 0.00 0.00 -0.84 0.00 0.00 28.75 28.38 1vhv h GLU 43 CO 0.03 1.12 0.00 0.39 -1.40 0.00 0.00 179.01 179.15 1vhv n GLU 44 N -4.11 0.00 0.00 2.33 1.02 -0.89 -1.15 120.64 117.84 1vhv n GLU 44 Ca -0.04 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.10 1vhv n GLU 44 Cb 0.56 -1.12 0.00 0.00 -0.02 0.00 0.00 31.44 30.86 1vhv n GLU 44 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1vhv n GLU 46 N 0.64 0.00 0.02 3.49 1.02 -0.60 -1.50 120.64 123.71 1vhv n GLU 46 Ca 0.00 0.00 -0.05 0.00 -0.02 0.00 0.00 57.16 57.09 1vhv n GLU 46 Cb 0.00 0.00 0.17 0.00 -0.02 0.00 0.00 31.44 31.59 1vhv n GLU 46 CO 0.00 0.00 0.00 1.49 1.18 0.00 0.00 177.13 179.80 1vhv h GLU 47 N 0.00 0.46 -0.12 3.49 4.81 -1.42 0.55 114.58 122.35 1vhv h GLU 47 Ca 0.00 -0.21 -0.07 0.00 -0.13 0.00 0.00 59.36 58.95 1vhv h GLU 47 Cb 0.00 -0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.37 1vhv h GLU 47 CO 0.00 0.75 -0.19 0.35 -0.73 0.00 0.00 179.01 179.20 1vhv h PHE 48 N 0.39 0.43 0.00 0.92 3.57 -1.53 -3.29 116.94 117.44 1vhv h PHE 48 Ca 0.04 -0.14 -0.17 0.00 3.53 0.00 0.00 57.97 61.23 1vhv h PHE 48 Cb 0.80 -0.08 -0.02 0.00 2.79 0.00 0.00 35.95 39.43 1vhv h PHE 48 CO 0.03 0.79 -0.79 0.74 -2.23 0.00 0.00 178.31 176.85 1vhv h PHE 49 N -0.06 0.00 -0.07 0.41 0.04 -1.80 -3.47 116.94 111.98 1vhv h PHE 49 Ca 0.01 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.77 1vhv h PHE 49 Cb 0.75 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.90 1vhv h PHE 49 CO 0.10 0.79 -0.01 0.41 -0.60 0.00 0.00 178.31 179.00 1vhv n GLY 50 N 0.83 0.36 3.65 -1.45 0.00 0.19 -4.88 105.19 103.89 1vhv n GLY 50 Ca -0.00 -0.91 -0.08 0.00 0.00 0.00 0.00 46.02 45.03 1vhv n GLY 50 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1vhv s LYS 51 N -3.63 1.32 0.37 1.61 -2.85 -1.10 -5.06 119.74 110.40 1vhv s LYS 51 Ca 0.00 -0.64 -0.27 0.00 -1.00 0.00 0.00 55.97 54.06 1vhv s LYS 51 Cb 0.00 0.51 -0.09 0.00 -2.06 0.00 0.00 37.83 36.18 1vhv s LYS 51 CO 0.00 -0.59 1.27 -0.98 0.10 0.00 0.00 175.35 175.15 1vhv s ARG 52 N -3.56 4.18 -0.08 1.78 1.70 -1.26 -4.42 118.95 117.29 1vhv s ARG 52 Ca 0.08 2.11 0.01 0.00 -0.47 0.00 0.00 55.73 57.45 1vhv s ARG 52 Cb -0.03 -2.90 0.02 0.00 -0.57 0.00 0.00 34.95 31.48 1vhv s ARG 52 CO -0.02 -0.30 -0.08 0.08 -1.08 0.00 0.00 175.30 173.90 1vhv s VAL 53 N -1.23 0.88 -0.20 4.99 1.01 -1.26 -4.44 120.40 120.15 1vhv s VAL 53 Ca 0.53 -0.27 -0.06 0.00 0.00 0.00 0.00 61.98 62.18 1vhv s VAL 53 Cb -0.37 -0.87 -0.03 0.00 0.00 0.00 0.00 36.38 35.10 1vhv s VAL 53 CO 0.48 0.32 0.04 -0.69 0.00 0.00 0.00 175.10 175.25 1vhv s VAL 54 N 1.22 4.40 0.02 2.92 1.01 -0.86 -4.95 120.40 124.15 1vhv s VAL 54 Ca -0.05 -0.16 -0.30 0.00 0.00 0.00 0.00 61.98 61.47 1vhv s VAL 54 Cb -0.14 -3.00 -0.04 0.00 0.00 0.00 0.00 36.38 33.21 1vhv s VAL 54 CO -0.02 0.42 1.01 -1.83 0.00 0.00 0.00 175.10 174.68 1vhv s GLU 55 N 0.85 4.55 0.05 2.72 1.03 -1.26 -1.06 118.70 125.57 1vhv s GLU 55 Ca 0.03 1.47 0.02 0.00 0.03 0.00 0.00 54.97 56.51 1vhv s GLU 55 Cb -0.14 -3.44 -0.04 0.00 -0.80 0.00 0.00 34.13 29.71 1vhv s GLU 55 CO 0.02 -0.06 0.08 -0.51 -1.33 0.00 0.00 175.26 173.46 1vhv s LEU 56 N 0.94 3.84 0.48 1.83 1.43 0.12 -4.90 118.68 122.41 1vhv s LEU 56 Ca 0.52 0.05 0.08 0.00 -1.03 0.00 0.00 54.13 53.76 1vhv s LEU 56 Cb -0.22 -2.41 0.03 0.00 0.03 0.00 0.00 46.19 43.62 1vhv s LEU 56 CO 0.28 0.21 0.60 -1.61 0.23 0.00 0.00 176.35 176.07 1vhv s GLU 57 N -2.13 2.58 0.22 1.70 0.41 -1.26 -4.35 118.70 115.87 1vhv s GLU 57 Ca 0.27 -1.46 -0.15 0.00 -0.41 0.00 0.00 54.97 53.22 1vhv s GLU 57 Cb -0.12 -2.63 0.24 0.00 -1.78 0.00 0.00 34.13 29.84 1vhv s GLU 57 CO 0.19 -0.47 1.60 -0.09 -0.49 0.00 0.00 175.26 176.00 1vhv h ARG 58 N 0.55 -0.05 -0.51 1.61 2.43 -1.99 0.09 114.38 116.52 1vhv h ARG 58 Ca -0.37 0.00 0.10 0.00 -0.81 0.00 0.00 59.98 58.91 1vhv h ARG 58 Cb 1.28 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 30.82 1vhv h ARG 58 CO 0.46 -0.03 0.35 0.66 -1.51 0.00 0.00 179.97 179.90 1vhv h SER 59 N -0.05 0.21 0.80 -3.80 4.64 -1.97 -0.57 113.55 112.82 1vhv h SER 59 Ca 0.31 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.64 1vhv h SER 59 Cb 0.53 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.59 1vhv h SER 59 CO -0.73 0.12 0.00 0.44 -0.87 0.00 0.00 176.83 175.80 1vhv h ASP 60 N 0.23 0.00 0.00 4.97 5.19 -1.25 0.78 116.42 126.34 1vhv h ASP 60 Ca 0.24 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.65 1vhv h ASP 60 Cb 0.63 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.14 1vhv h ASP 60 CO -0.04 0.00 -1.51 0.18 -3.12 0.00 0.00 179.24 174.75 1vhv n LEU 61 N -2.32 0.28 0.00 1.55 4.77 -0.29 -3.72 117.00 117.26 1vhv n LEU 61 Ca 0.02 -0.17 0.00 0.00 -0.03 0.00 0.00 56.01 55.84 1vhv n LEU 61 Cb 0.25 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.34 1vhv n LEU 61 CO 0.21 0.07 0.00 -0.62 -1.33 0.00 0.00 177.39 175.72 1vhv n GLU 62 N -1.90 0.00 -0.25 3.23 1.02 -0.76 -4.67 120.64 117.32 1vhv n GLU 62 Ca -0.01 0.00 0.02 0.00 -0.02 0.00 0.00 57.16 57.15 1vhv n GLU 62 Cb 0.41 0.00 0.15 0.00 -0.02 0.00 0.00 31.44 31.98 1vhv n GLU 62 CO 0.00 0.00 0.00 1.05 1.18 0.00 0.00 177.13 179.36 1vhv h GLU 63 N 0.00 0.60 -1.01 3.49 9.09 -1.81 -2.14 114.58 122.80 1vhv h GLU 63 Ca 0.00 -0.04 -0.42 0.00 0.05 0.00 0.00 59.36 58.96 1vhv h GLU 63 Cb 0.00 -0.14 -0.24 0.00 -1.65 0.00 0.00 28.75 26.72 1vhv h GLU 63 CO 0.00 0.40 0.53 0.09 0.05 0.00 0.00 179.01 180.08 1vhv n ASN 64 N -4.85 3.77 0.31 3.06 3.02 0.26 -4.57 115.26 116.25 1vhv n ASN 64 Ca 0.12 -3.28 0.21 0.00 -0.03 0.00 0.00 54.58 51.60 1vhv n ASN 64 Cb 0.29 -0.78 1.05 0.00 -0.61 0.00 0.00 39.78 39.72 1vhv n ASN 64 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 1vhv h SER 65 N 0.84 0.00 -0.44 6.41 4.64 -1.46 -1.88 113.55 121.65 1vhv h SER 65 Ca 0.50 0.00 0.05 0.00 -0.47 0.00 0.00 61.79 61.87 1vhv h SER 65 Cb 2.40 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 64.46 1vhv h SER 65 CO 0.89 0.00 0.29 2.19 -0.87 0.00 0.00 176.83 179.34 1vhv h PHE 66 N 0.00 0.38 -0.21 4.77 -5.15 -1.85 -2.56 116.94 112.32 1vhv h PHE 66 Ca 0.00 0.01 0.00 0.00 -0.20 0.00 0.00 57.97 57.78 1vhv h PHE 66 Cb 0.14 -0.13 -0.01 0.00 0.22 0.00 0.00 35.95 36.18 1vhv h PHE 66 CO 0.00 0.21 0.14 0.00 -2.00 0.00 0.00 178.31 176.66 1vhv h ARG 67 N 0.39 0.29 -0.70 6.09 3.08 -1.68 -0.09 114.38 121.75 1vhv h ARG 67 Ca 0.19 -0.02 -0.02 0.00 0.07 0.00 0.00 59.98 60.20 1vhv h ARG 67 Cb 0.25 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.21 1vhv h ARG 67 CO -0.04 0.20 0.37 1.25 -1.07 0.00 0.00 179.97 180.67 1vhv h LEU 68 N 0.28 0.90 -1.20 3.04 5.85 -1.65 -2.42 115.31 120.12 1vhv h LEU 68 Ca 0.08 -0.11 -0.07 0.00 0.84 0.00 0.00 57.88 58.62 1vhv h LEU 68 Cb -0.02 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 40.77 1vhv h LEU 68 CO -0.02 0.75 -0.22 0.40 -0.34 0.00 0.00 178.44 179.02 1vhv h ILE 69 N 0.97 1.23 -0.29 4.05 2.04 -1.31 -2.19 117.51 122.01 1vhv h ILE 69 Ca 0.25 -1.06 -0.09 0.00 1.00 0.00 0.00 64.86 64.96 1vhv h ILE 69 Cb 0.07 1.34 -0.02 0.00 -0.74 0.00 0.00 36.82 37.48 1vhv h ILE 69 CO -0.04 0.33 -0.19 -0.08 0.00 0.00 0.00 178.15 178.17 1vhv h GLU 70 N 0.27 0.52 -0.40 2.37 4.57 -0.61 -2.20 114.58 119.10 1vhv h GLU 70 Ca 0.05 -0.18 -0.07 0.00 -1.18 0.00 0.00 59.36 57.97 1vhv h GLU 70 Cb 0.53 -0.04 -0.02 0.00 -0.16 0.00 0.00 28.75 29.06 1vhv h GLU 70 CO 0.04 0.69 -0.06 0.00 -1.18 0.00 0.00 179.01 178.50 1vhv h ARG 71 N 0.47 0.68 0.00 1.92 3.08 -0.93 -2.14 114.38 117.46 1vhv h ARG 71 Ca 0.08 -0.19 0.00 0.00 0.07 0.00 0.00 59.98 59.94 1vhv h ARG 71 Cb 0.59 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.57 1vhv h ARG 71 CO 0.04 0.74 0.00 0.00 -1.07 0.00 0.00 179.97 179.68 1vhv n ALA 72 N -2.48 2.43 0.21 0.04 0.00 -0.85 -2.73 120.51 117.13 1vhv n ALA 72 Ca 0.02 -0.15 0.10 0.00 0.00 0.00 0.00 53.44 53.41 1vhv n ALA 72 Cb 0.31 -1.42 0.32 0.00 0.00 0.00 0.00 19.45 18.66 1vhv n ALA 72 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1vhv h LYS 73 N 0.00 0.00 0.00 0.00 1.57 -1.11 -2.94 116.57 114.10 1vhv h LYS 73 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1vhv h LYS 73 Cb 0.06 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.37 1vhv h LYS 73 CO 0.00 0.18 0.00 -1.13 -0.57 0.00 0.00 179.45 177.93 1vhv n SER 74 N -3.21 0.70 -4.17 0.86 3.41 -1.16 -4.62 113.62 105.43 1vhv n SER 74 Ca 0.02 -0.95 -0.11 0.00 -0.26 0.00 0.00 58.87 57.56 1vhv n SER 74 Cb 0.50 0.06 -0.09 0.00 -0.26 0.00 0.00 64.21 64.42 1vhv n SER 74 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1vhv s LYS 75 N -0.06 1.22 -0.52 4.33 1.02 -1.11 -4.61 119.74 120.01 1vhv s LYS 75 Ca 0.00 -1.56 -0.20 0.00 0.02 0.00 0.00 55.97 54.23 1vhv s LYS 75 Cb 0.00 0.29 0.05 0.00 -0.52 0.00 0.00 37.83 37.66 1vhv s LYS 75 CO 0.00 -0.41 0.70 0.45 -0.92 0.00 0.00 175.35 175.17 1vhv s SER 76 N -3.13 6.25 -0.09 2.83 0.15 -1.26 -1.94 113.70 116.51 1vhv s SER 76 Ca 0.35 -0.79 -0.03 0.00 0.70 0.00 0.00 55.95 56.19 1vhv s SER 76 Cb 0.06 -2.32 -0.04 0.00 -1.71 0.00 0.00 66.02 62.01 1vhv s SER 76 CO 0.11 -0.97 0.05 -0.69 1.20 0.00 0.00 173.24 172.93 1vhv s VAL 77 N 2.94 4.70 -0.09 4.45 1.01 0.66 0.08 120.40 134.15 1vhv s VAL 77 Ca 0.19 -0.13 0.03 0.00 0.00 0.00 0.00 61.98 62.07 1vhv s VAL 77 Cb -0.18 -3.02 -0.01 0.00 0.00 0.00 0.00 36.38 33.18 1vhv s VAL 77 CO 0.14 0.59 -0.20 -0.69 0.00 0.00 0.00 175.10 174.93 1vhv s VAL 78 N -0.96 2.44 -0.31 2.92 1.01 -0.42 -0.73 120.40 124.36 1vhv s VAL 78 Ca 0.15 -0.90 -0.04 0.00 0.00 0.00 0.00 61.98 61.19 1vhv s VAL 78 Cb -0.12 -1.95 0.04 0.00 0.00 0.00 0.00 36.38 34.36 1vhv s VAL 78 CO 0.04 0.56 0.03 -0.22 0.00 0.00 0.00 175.10 175.51 1vhv s LEU 79 N 0.07 3.97 -0.04 3.92 2.96 -0.06 0.07 118.68 129.58 1vhv s LEU 79 Ca -0.09 -1.17 -0.25 0.00 -0.22 0.00 0.00 54.13 52.40 1vhv s LEU 79 Cb -0.15 -1.77 -0.04 0.00 0.50 0.00 0.00 46.19 44.73 1vhv s LEU 79 CO 0.06 -0.27 0.77 -0.76 -1.32 0.00 0.00 176.35 174.83 1vhv s LEU 80 N 1.32 4.35 -0.03 -0.68 1.43 0.17 -1.46 118.68 123.78 1vhv s LEU 80 Ca -0.03 1.33 0.04 0.00 -1.03 0.00 0.00 54.13 54.44 1vhv s LEU 80 Cb -0.19 -3.22 -0.01 0.00 0.03 0.00 0.00 46.19 42.80 1vhv s LEU 80 CO 0.00 -0.13 -0.16 0.68 0.23 0.00 0.00 176.35 176.97 1vhv s VAL 81 N 0.74 1.27 0.33 -1.59 -7.23 -0.55 -1.95 120.40 111.42 1vhv s VAL 81 Ca 0.41 -0.66 -0.29 0.00 -1.81 0.00 0.00 61.98 59.63 1vhv s VAL 81 Cb -0.19 -1.08 -0.12 0.00 0.56 0.00 0.00 36.38 35.56 1vhv s VAL 81 CO 0.21 0.37 1.51 -2.65 -0.31 0.00 0.00 175.10 174.23 1vhv n PRO 82 N 2.95 2.61 0.00 4.82 -0.02 -1.26 0.00 135.00 144.10 1vhv n PRO 82 Ca -0.16 0.92 0.00 0.00 -2.02 0.00 0.00 63.50 62.24 1vhv n PRO 82 Cb 0.54 -2.66 0.00 0.00 -0.02 0.00 0.00 33.50 31.36 1vhv n PRO 82 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1vhv n GLY 83 N 1.28 0.86 3.20 -1.23 0.00 0.92 -4.67 105.19 105.55 1vhv n GLY 83 Ca 0.05 -0.60 -0.33 0.00 0.00 0.00 0.00 46.02 45.14 1vhv n GLY 83 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1vhv s ASP 84 N -4.00 3.26 -0.42 1.61 3.68 -1.22 -1.81 116.67 117.78 1vhv s ASP 84 Ca 0.00 -0.56 -0.24 0.00 2.13 0.00 0.00 52.55 53.88 1vhv s ASP 84 Cb 0.00 -1.47 -0.26 0.00 -1.45 0.00 0.00 42.92 39.73 1vhv s ASP 84 CO 0.00 0.09 1.65 -2.65 0.13 0.00 0.00 175.17 174.39 1vhv n PRO 85 N 4.00 0.03 0.00 4.34 -0.02 -1.26 -4.55 135.00 137.54 1vhv n PRO 85 Ca -0.20 -1.10 0.00 0.00 -2.02 0.00 0.00 63.50 60.18 1vhv n PRO 85 Cb 0.52 -2.80 0.00 0.00 -0.02 0.00 0.00 33.50 31.19 1vhv n PRO 85 CO 0.00 0.00 0.00 1.33 1.98 0.00 0.00 175.50 178.81 1vhv n VAL 87 N 7.30 0.00 -2.87 -1.45 0.24 -1.26 -4.99 118.33 115.30 1vhv n VAL 87 Ca 0.37 0.00 -0.41 0.00 -2.04 0.00 0.00 64.34 62.26 1vhv n VAL 87 Cb 0.43 0.00 -0.04 0.00 -1.47 0.00 0.00 33.84 32.76 1vhv n VAL 87 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1vhv s ALA 88 N 0.00 3.29 0.46 2.33 0.00 -1.26 -4.95 121.76 121.63 1vhv s ALA 88 Ca 0.00 0.39 0.27 0.00 0.00 0.00 0.00 51.96 52.62 1vhv s ALA 88 Cb 0.00 -3.13 1.52 0.00 0.00 0.00 0.00 23.12 21.51 1vhv s ALA 88 CO 0.00 -0.03 2.12 1.79 0.00 0.00 0.00 175.76 179.64 1vhv h THR 89 N 4.29 0.59 -0.71 0.00 1.35 -2.01 -3.02 112.91 113.41 1vhv h THR 89 Ca -0.43 -0.39 0.15 0.00 -0.55 0.00 0.00 66.41 65.19 1vhv h THR 89 Cb 1.21 1.25 -0.13 0.00 -1.73 0.00 0.00 68.15 68.75 1vhv h THR 89 CO 0.72 0.09 -0.07 0.74 -0.25 0.00 0.00 175.52 176.75 1vhv h THR 90 N 0.00 0.34 -0.58 6.82 2.02 -1.96 -1.94 112.91 117.61 1vhv h THR 90 Ca -0.00 -0.02 -0.05 0.00 0.77 0.00 0.00 66.41 67.11 1vhv h THR 90 Cb 0.24 0.28 -0.03 0.00 -1.74 0.00 0.00 68.15 66.91 1vhv h THR 90 CO 0.01 0.01 0.15 0.45 0.37 0.00 0.00 175.52 176.51 1vhv h HIS 91 N 0.06 0.92 -0.72 3.16 -0.00 -1.89 -2.57 115.15 114.12 1vhv h HIS 91 Ca 0.37 -0.09 0.00 0.00 -0.00 0.00 0.00 60.37 60.65 1vhv h HIS 91 Cb 0.60 -0.27 -0.04 0.00 -0.00 0.00 0.00 27.41 27.71 1vhv h HIS 91 CO -0.47 0.76 0.46 0.77 -0.00 0.00 0.00 177.93 179.45 1vhv h SER 92 N 0.86 0.84 -0.16 2.45 0.02 -1.53 -0.70 113.55 115.33 1vhv h SER 92 Ca 0.19 -0.03 -0.09 0.00 -0.84 0.00 0.00 61.79 61.02 1vhv h SER 92 Cb 0.30 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 62.61 1vhv h SER 92 CO -0.00 0.62 -0.19 0.00 -1.14 0.00 0.00 176.83 176.12 1vhv h ALA 93 N 1.53 1.07 -0.10 3.77 0.00 -1.34 -1.55 119.26 122.64 1vhv h ALA 93 Ca 0.26 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 1vhv h ALA 93 Cb -0.09 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.56 1vhv h ALA 93 CO -0.05 0.57 0.01 0.82 0.00 0.00 0.00 179.25 180.60 1vhv h ILE 94 N 0.53 1.22 -0.70 0.00 2.04 -1.22 -1.88 117.51 117.49 1vhv h ILE 94 Ca 0.08 -0.70 0.09 0.00 1.00 0.00 0.00 64.86 65.34 1vhv h ILE 94 Cb 0.63 1.50 -0.07 0.00 -0.74 0.00 0.00 36.82 38.14 1vhv h ILE 94 CO 0.04 0.20 0.35 0.50 0.00 0.00 0.00 178.15 179.24 1vhv h LYS 95 N -0.07 0.57 0.09 2.37 3.64 -1.11 -0.67 116.57 121.40 1vhv h LYS 95 Ca 0.03 -0.03 0.01 0.00 -1.27 0.00 0.00 60.65 59.39 1vhv h LYS 95 Cb 0.30 -0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 31.97 1vhv h LYS 95 CO 0.00 0.38 -0.16 1.25 -2.27 0.00 0.00 179.45 178.66 1vhv h LEU 96 N 0.59 -0.43 -0.58 5.20 5.85 -1.04 0.14 115.31 125.04 1vhv h LEU 96 Ca 0.35 0.05 0.04 0.00 0.84 0.00 0.00 57.88 59.16 1vhv h LEU 96 Cb 0.36 0.16 -0.05 0.00 0.37 0.00 0.00 40.66 41.51 1vhv h LEU 96 CO -0.27 -0.23 0.32 -0.08 -0.34 0.00 0.00 178.44 177.85 1vhv h GLU 97 N -0.31 0.61 0.12 1.25 4.81 -0.92 -0.62 114.58 119.52 1vhv h GLU 97 Ca 0.02 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.21 1vhv h GLU 97 Cb 0.32 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.57 1vhv h GLU 97 CO -0.08 0.40 -0.06 0.00 -0.73 0.00 0.00 179.01 178.54 1vhv h ALA 98 N 1.29 -0.16 -0.73 2.92 0.00 -0.92 -1.29 119.26 120.37 1vhv h ALA 98 Ca 0.25 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 1vhv h ALA 98 Cb 0.11 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 1vhv h ALA 98 CO -0.15 -0.53 0.40 0.93 0.00 0.00 0.00 179.25 179.91 1vhv h GLU 99 N -0.28 1.02 0.00 0.00 5.08 -0.81 -0.25 114.58 119.34 1vhv h GLU 99 Ca -0.02 -0.12 -0.01 0.00 -1.00 0.00 0.00 59.36 58.22 1vhv h GLU 99 Cb 0.23 -0.20 -0.00 0.00 0.50 0.00 0.00 28.75 29.28 1vhv h GLU 99 CO 0.03 0.76 -0.04 0.00 -1.00 0.00 0.00 179.01 178.76 1vhv h ARG 100 N 1.01 0.00 -0.44 2.33 3.08 -0.82 -1.53 114.38 118.01 1vhv h ARG 100 Ca 0.26 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.31 1vhv h ARG 100 Cb 0.04 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.09 1vhv h ARG 100 CO -0.04 0.04 0.00 1.63 -1.07 0.00 0.00 179.97 180.53 1vhv n LYS 101 N -4.28 2.03 -1.14 0.04 5.02 -0.51 -4.92 118.16 114.40 1vhv n LYS 101 Ca -0.03 -1.39 -0.05 0.00 -2.02 0.00 0.00 58.31 54.83 1vhv n LYS 101 Cb 0.12 -1.38 -0.02 0.00 -0.02 0.00 0.00 35.03 33.73 1vhv n LYS 101 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1vhv n GLY 102 N 0.98 0.73 3.61 0.72 0.00 -0.58 -5.01 105.19 105.64 1vhv n GLY 102 Ca 0.13 -0.49 -0.39 0.00 0.00 0.00 0.00 46.02 45.26 1vhv n GLY 102 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1vhv s VAL 103 N -2.06 5.16 0.33 1.61 1.01 -0.17 -5.00 120.40 121.27 1vhv s VAL 103 Ca 0.00 0.63 -0.29 0.00 0.00 0.00 0.00 61.98 62.33 1vhv s VAL 103 Cb 0.00 -3.72 -0.10 0.00 0.00 0.00 0.00 36.38 32.55 1vhv s VAL 103 CO 0.00 0.15 1.36 -1.59 0.00 0.00 0.00 175.10 175.01 1vhv s LYS 104 N 2.08 4.30 0.39 2.72 0.00 -1.26 -3.60 119.74 124.37 1vhv s LYS 104 Ca 0.16 2.29 0.06 0.00 0.00 0.00 0.00 55.97 58.48 1vhv s LYS 104 Cb -0.16 -3.06 -0.08 0.00 0.00 0.00 0.00 37.83 34.54 1vhv s LYS 104 CO 0.10 -0.28 0.02 0.95 0.00 0.00 0.00 175.35 176.14 1vhv s THR 105 N -0.97 1.83 -0.07 3.79 -4.23 -1.26 -1.97 115.64 112.77 1vhv s THR 105 Ca 0.51 -2.00 -0.21 0.00 -1.18 0.00 0.00 61.69 58.81 1vhv s THR 105 Cb -0.41 -2.96 0.05 0.00 1.34 0.00 0.00 72.50 70.52 1vhv s THR 105 CO 0.53 -0.00 0.48 -0.60 -0.54 0.00 0.00 174.62 174.49 1vhv s ARG 106 N -3.75 0.79 -0.09 3.99 3.52 -0.85 -4.94 118.95 117.61 1vhv s ARG 106 Ca 0.35 0.17 0.02 0.00 -0.13 0.00 0.00 55.73 56.14 1vhv s ARG 106 Cb 0.10 0.36 0.01 0.00 -1.56 0.00 0.00 34.95 33.86 1vhv s ARG 106 CO 0.17 -0.21 -0.15 0.42 -0.81 0.00 0.00 175.30 174.73 1vhv s ILE 107 N -0.92 1.43 -0.31 4.11 1.01 -1.26 -1.01 121.20 124.25 1vhv s ILE 107 Ca -0.10 -0.62 -0.08 0.00 0.00 0.00 0.00 60.65 59.85 1vhv s ILE 107 Cb -0.03 -1.29 0.01 0.00 0.01 0.00 0.00 42.46 41.16 1vhv s ILE 107 CO 0.05 0.42 0.11 -0.63 0.00 0.00 0.00 174.94 174.90 1vhv s ILE 108 N 0.79 4.13 0.54 2.92 1.01 0.67 -4.95 121.20 126.32 1vhv s ILE 108 Ca -0.11 -0.72 -0.18 0.00 0.00 0.00 0.00 60.65 59.64 1vhv s ILE 108 Cb -0.16 -3.18 -0.06 0.00 0.01 0.00 0.00 42.46 39.08 1vhv s ILE 108 CO 0.02 0.00 1.06 -1.00 0.00 0.00 0.00 174.94 175.02 1vhv s HIS 109 N 1.51 2.95 0.27 3.97 3.76 -1.26 -1.01 115.29 125.49 1vhv s HIS 109 Ca 0.02 1.54 0.04 0.00 -0.15 0.00 0.00 55.06 56.52 1vhv s HIS 109 Cb -0.18 -3.07 -0.06 0.00 1.11 0.00 0.00 32.58 30.39 1vhv s HIS 109 CO 0.04 -1.05 -0.00 0.20 -0.85 0.00 0.00 174.74 173.08 1vhv s GLY 110 N -2.32 1.80 0.34 -2.22 0.00 -1.25 -4.46 107.32 99.21 1vhv s GLY 110 Ca 0.66 -1.90 -0.27 0.00 0.00 0.00 0.00 44.72 43.21 1vhv s GLY 110 CO 0.28 -1.76 1.13 0.00 0.00 0.00 0.00 173.10 172.75 1vhv s ALA 111 N -3.26 3.28 0.32 3.20 0.00 -1.25 -4.10 121.76 119.94 1vhv s ALA 111 Ca 0.31 0.91 0.09 0.00 0.00 0.00 0.00 51.96 53.28 1vhv s ALA 111 Cb 0.06 -3.34 -0.05 0.00 0.00 0.00 0.00 23.12 19.79 1vhv s ALA 111 CO 0.12 -0.32 -0.01 -1.54 0.00 0.00 0.00 175.76 174.01 1vhv s SER 112 N -1.06 4.23 0.28 0.00 1.04 -1.26 -3.43 113.70 113.50 1vhv s SER 112 Ca 0.51 -0.91 -0.03 0.00 0.48 0.00 0.00 55.95 56.01 1vhv s SER 112 Cb -0.30 -0.59 0.39 0.00 0.10 0.00 0.00 66.02 65.62 1vhv s SER 112 CO 0.39 -0.16 1.90 0.40 0.98 0.00 0.00 173.24 176.75 1vhv h ILE 113 N 1.86 1.22 -0.39 -1.02 2.04 -1.97 -2.73 117.51 116.51 1vhv h ILE 113 Ca -0.43 -0.56 0.07 0.00 1.00 0.00 0.00 64.86 64.94 1vhv h ILE 113 Cb 1.25 0.21 -0.07 0.00 -0.74 0.00 0.00 36.82 37.48 1vhv h ILE 113 CO 0.64 0.25 -0.04 0.77 0.00 0.00 0.00 178.15 179.78 1vhv h SER 114 N 1.05 -0.24 -0.08 1.72 4.64 -1.99 0.17 113.55 118.81 1vhv h SER 114 Ca 0.27 0.10 0.04 0.00 -0.47 0.00 0.00 61.79 61.72 1vhv h SER 114 Cb 0.03 0.19 -0.04 0.00 -0.31 0.00 0.00 62.40 62.27 1vhv h SER 114 CO -0.04 -0.08 -0.16 0.74 -0.87 0.00 0.00 176.83 176.42 1vhv h THR 115 N 0.06 0.59 -0.93 2.95 2.02 -1.94 -2.20 112.91 113.46 1vhv h THR 115 Ca 0.19 0.00 0.09 0.00 0.77 0.00 0.00 66.41 67.46 1vhv h THR 115 Cb 0.28 0.59 -0.07 0.00 -1.74 0.00 0.00 68.15 67.21 1vhv h THR 115 CO -0.35 0.00 0.58 0.00 0.37 0.00 0.00 175.52 176.11 1vhv h ALA 116 N 0.78 1.33 -0.70 6.16 0.00 -1.02 -1.46 119.26 124.36 1vhv h ALA 116 Ca 0.08 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 1vhv h ALA 116 Cb 0.33 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 1vhv h ALA 116 CO -0.21 0.27 0.36 0.28 0.00 0.00 0.00 179.25 179.94 1vhv h VAL 117 N 0.99 1.22 -0.77 0.00 2.07 -0.60 -1.49 116.25 117.67 1vhv h VAL 117 Ca 0.43 -0.57 -0.05 0.00 0.82 0.00 0.00 66.70 67.33 1vhv h VAL 117 Cb 0.30 0.30 -0.03 0.00 -1.52 0.00 0.00 31.29 30.34 1vhv h VAL 117 CO -0.22 0.25 0.29 0.00 0.02 0.00 0.00 177.57 177.91 1vhv h GLY 119 N 1.14 0.20 2.00 0.00 0.00 -1.18 -0.03 103.07 105.20 1vhv h GLY 119 Ca 0.25 -0.29 -0.06 0.00 0.00 0.00 0.00 47.33 47.24 1vhv h GLY 119 CO -0.02 0.26 -0.26 1.41 0.00 0.00 0.00 176.54 177.93 1vhv h LEU 120 N 0.12 0.00 0.00 3.11 3.38 -1.04 -3.37 115.31 117.51 1vhv h LEU 120 Ca -0.02 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.86 1vhv h LEU 120 Cb 1.27 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.01 1vhv h LEU 120 CO 0.11 0.26 -1.48 0.35 0.09 0.00 0.00 178.44 177.77 1vhv n THR 121 N -3.21 0.33 -0.77 0.22 -2.24 -0.84 -4.75 114.28 103.01 1vhv n THR 121 Ca 0.02 -0.28 0.00 0.00 -2.27 0.00 0.00 64.05 61.52 1vhv n THR 121 Cb 0.59 -0.37 0.00 0.00 -2.10 0.00 0.00 70.33 68.45 1vhv n THR 121 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1vhv n GLY 122 N 2.33 0.76 3.77 3.38 0.00 -0.03 -3.51 105.19 111.89 1vhv n GLY 122 Ca -0.08 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.56 1vhv n GLY 122 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1vhv s LEU 123 N 0.00 4.12 -0.08 0.99 1.43 -1.24 -4.41 118.68 119.50 1vhv s LEU 123 Ca 0.00 2.21 -0.30 0.00 -1.03 0.00 0.00 54.13 55.02 1vhv s LEU 123 Cb 0.00 -4.15 -0.03 0.00 0.03 0.00 0.00 46.19 42.05 1vhv s LEU 123 CO 0.00 -0.67 1.16 -1.00 0.23 0.00 0.00 176.35 176.07 1vhv s HIS 124 N -1.55 3.24 0.32 0.29 3.76 -1.26 -4.65 115.29 115.44 1vhv s HIS 124 Ca 0.59 1.29 0.01 0.00 -0.15 0.00 0.00 55.06 56.80 1vhv s HIS 124 Cb -0.27 -3.37 0.56 0.00 1.11 0.00 0.00 32.58 30.61 1vhv s HIS 124 CO 0.33 -1.09 1.96 -0.97 -0.85 0.00 0.00 174.74 174.12 1vhv h ASN 125 N 7.43 0.84 0.49 1.40 -0.73 -1.94 -0.92 115.58 122.16 1vhv h ASN 125 Ca -0.32 -0.01 0.00 0.00 1.87 0.00 0.00 56.30 57.83 1vhv h ASN 125 Cb 1.15 -0.20 0.00 0.00 0.27 0.00 0.00 38.32 39.55 1vhv h ASN 125 CO 0.88 0.58 0.00 0.10 -0.37 0.00 0.00 177.43 178.63 1vhv h TYR 126 N 0.98 0.00 -0.00 0.67 -0.00 -2.04 -2.18 116.97 114.41 1vhv h TYR 126 Ca 0.31 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 59.04 1vhv h TYR 126 Cb 0.03 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 36.76 1vhv h TYR 126 CO -0.00 0.00 -0.17 0.54 -0.00 0.00 0.00 178.16 178.53 1vhv n ARG 127 N -2.70 0.03 -2.30 0.10 1.74 -0.35 -4.87 116.66 108.30 1vhv n ARG 127 Ca -0.00 -0.01 -0.42 0.00 -0.77 0.00 0.00 57.85 56.65 1vhv n ARG 127 Cb 0.17 -1.50 -0.03 0.00 -1.02 0.00 0.00 32.46 30.08 1vhv n ARG 127 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 1vhv s PHE 128 N -2.98 3.35 0.00 -1.55 0.40 -0.82 -1.14 117.98 115.23 1vhv s PHE 128 Ca 0.14 1.23 0.00 0.00 -0.60 0.00 0.00 56.93 57.70 1vhv s PHE 128 Cb 0.19 -3.53 0.00 0.00 0.51 0.00 0.00 43.02 40.19 1vhv s PHE 128 CO 0.58 -1.67 0.00 0.41 0.70 0.00 0.00 175.22 175.25 1vhv n GLY 129 N 2.80 1.74 3.76 4.36 0.00 0.39 -4.82 105.19 113.43 1vhv n GLY 129 Ca 0.08 -1.80 -0.36 0.00 0.00 0.00 0.00 46.02 43.93 1vhv n GLY 129 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1vhv s LYS 130 N 3.49 3.27 0.41 1.61 1.02 -1.26 -4.79 119.74 123.48 1vhv s LYS 130 Ca 0.00 1.80 0.03 0.00 0.02 0.00 0.00 55.97 57.83 1vhv s LYS 130 Cb 0.00 -2.10 -0.00 0.00 -0.52 0.00 0.00 37.83 35.21 1vhv s LYS 130 CO 0.00 -0.96 0.59 -1.54 -0.92 0.00 0.00 175.35 172.52 1vhv s SER 131 N -1.51 5.85 0.11 2.83 1.04 -1.26 -4.28 113.70 116.48 1vhv s SER 131 Ca 0.72 0.04 -0.09 0.00 0.48 0.00 0.00 55.95 57.11 1vhv s SER 131 Cb -0.29 -1.34 -0.00 0.00 0.10 0.00 0.00 66.02 64.49 1vhv s SER 131 CO 0.33 -0.61 0.22 0.00 0.98 0.00 0.00 173.24 174.16 1vhv s ALA 132 N -2.40 -0.20 -0.16 5.32 0.00 -0.86 -5.00 121.76 118.47 1vhv s ALA 132 Ca 0.48 -0.66 0.00 0.00 0.00 0.00 0.00 51.96 51.78 1vhv s ALA 132 Cb -0.10 0.59 0.00 0.00 0.00 0.00 0.00 23.12 23.61 1vhv s ALA 132 CO 0.35 -0.55 -0.15 0.99 0.00 0.00 0.00 175.76 176.40 1vhv s THR 133 N -3.88 2.62 -0.34 0.00 2.01 -1.26 -0.74 115.64 114.04 1vhv s THR 133 Ca 0.08 -0.78 -0.26 0.00 0.31 0.00 0.00 61.69 61.04 1vhv s THR 133 Cb 0.04 -2.11 0.01 0.00 0.01 0.00 0.00 72.50 70.46 1vhv s THR 133 CO -0.08 0.51 0.92 -0.69 -0.69 0.00 0.00 174.62 174.59 1vhv s VAL 134 N 0.90 4.62 0.31 3.82 1.01 0.39 -4.69 120.40 126.76 1vhv s VAL 134 Ca -0.04 1.30 0.00 0.00 0.00 0.00 0.00 61.98 63.24 1vhv s VAL 134 Cb -0.15 -4.30 -0.04 0.00 0.00 0.00 0.00 36.38 31.89 1vhv s VAL 134 CO -0.02 -0.45 0.51 -0.94 0.00 0.00 0.00 175.10 174.20 1vhv s SER 135 N 1.77 6.32 0.39 3.32 1.04 -1.26 -1.05 113.70 124.24 1vhv s SER 135 Ca 0.38 0.43 0.06 0.00 0.48 0.00 0.00 55.95 57.30 1vhv s SER 135 Cb -0.13 -2.02 0.80 0.00 0.10 0.00 0.00 66.02 64.77 1vhv s SER 135 CO 0.16 -0.23 2.03 -0.50 0.98 0.00 0.00 173.24 175.68 1vhv h TRP 136 N 1.05 0.55 -3.36 5.02 4.06 -1.94 -3.39 115.95 117.94 1vhv h TRP 136 Ca -0.50 0.00 -0.56 0.00 2.06 0.00 0.00 58.89 59.89 1vhv h TRP 136 Cb 1.21 -0.18 -0.06 0.00 -1.00 0.00 0.00 29.16 29.13 1vhv h TRP 136 CO 0.52 0.37 0.18 -3.38 -3.56 0.00 0.00 178.44 172.57 1vhv s HIS 137 N -5.45 3.54 0.34 0.49 -3.43 -1.26 -5.00 115.29 104.52 1vhv s HIS 137 Ca -0.08 1.27 -0.24 0.00 -0.80 0.00 0.00 55.06 55.20 1vhv s HIS 137 Cb 0.17 -2.88 -0.14 0.00 -1.43 0.00 0.00 32.58 28.30 1vhv s HIS 137 CO 0.74 -0.01 0.53 2.89 -2.00 0.00 0.00 174.74 176.89 1vhv n ARG 138 N 4.17 0.44 -3.53 -0.38 0.00 -1.26 -5.00 116.66 111.10 1vhv n ARG 138 Ca 0.01 0.16 -0.18 0.00 -0.00 0.00 0.00 57.85 57.84 1vhv n ARG 138 Cb 0.51 -1.33 -0.06 0.00 -0.00 0.00 0.00 32.46 31.57 1vhv n ARG 138 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 1vhv s SER 139 N -0.91 -0.67 0.00 2.89 0.15 -1.26 -5.03 113.70 108.87 1vhv s SER 139 Ca 0.62 0.78 0.26 0.00 0.70 0.00 0.00 55.95 58.31 1vhv s SER 139 Cb -0.71 0.62 0.62 0.00 -1.71 0.00 0.00 66.02 64.84 1vhv s SER 139 CO 0.59 -0.58 1.48 0.00 1.20 0.00 0.00 173.24 175.93 1vhv n GLN 140 N 1.06 0.69 0.20 5.44 10.64 -1.26 -4.46 117.38 129.69 1vhv n GLN 140 Ca -0.19 -0.43 -0.15 0.00 -1.83 0.00 0.00 57.00 54.41 1vhv n GLN 140 Cb 0.57 -1.49 -0.08 0.00 -0.86 0.00 0.00 30.24 28.38 1vhv n GLN 140 CO 0.00 0.00 0.00 1.15 -1.83 0.00 0.00 177.06 176.38 1vhv h THR 141 N 1.05 0.65 -0.61 -0.39 2.02 -1.96 -2.04 112.91 111.62 1vhv h THR 141 Ca 0.00 -0.28 0.07 0.00 0.77 0.00 0.00 66.41 66.98 1vhv h THR 141 Cb 0.53 0.79 -0.06 0.00 -1.74 0.00 0.00 68.15 67.67 1vhv h THR 141 CO 0.00 0.05 0.29 -0.65 0.37 0.00 0.00 175.52 175.58 1vhv h PRO 142 N -0.65 0.51 -0.59 6.66 0.11 -1.84 -0.74 132.00 135.46 1vhv h PRO 142 Ca -0.05 -0.03 -0.06 0.00 0.11 0.00 0.00 66.00 65.97 1vhv h PRO 142 Cb 0.47 -0.11 -0.03 0.00 0.11 0.00 0.00 31.00 31.44 1vhv h PRO 142 CO 0.08 0.33 0.14 0.28 -0.21 0.00 0.00 178.00 178.63 1vhv h VAL 143 N 0.52 1.24 -0.51 3.15 2.07 -1.83 -0.73 116.25 120.15 1vhv h VAL 143 Ca 0.29 -0.87 -0.10 0.00 0.82 0.00 0.00 66.70 66.84 1vhv h VAL 143 Cb 0.28 0.63 -0.02 0.00 -1.52 0.00 0.00 31.29 30.66 1vhv h VAL 143 CO -0.24 0.33 -0.08 0.78 0.02 0.00 0.00 177.57 178.38 1vhv h ASN 144 N 0.88 0.92 -0.27 0.57 2.35 -0.55 -1.46 115.58 118.02 1vhv h ASN 144 Ca 0.19 -0.28 -0.05 0.00 -0.55 0.00 0.00 56.30 55.60 1vhv h ASN 144 Cb 0.32 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.43 1vhv h ASN 144 CO -0.00 1.03 -0.04 0.58 -1.65 0.00 0.00 177.43 177.35 1vhv h VAL 145 N 0.84 1.27 -0.29 2.81 2.07 -0.80 -0.97 116.25 121.18 1vhv h VAL 145 Ca 0.14 -1.03 0.05 0.00 0.82 0.00 0.00 66.70 66.68 1vhv h VAL 145 Cb 0.61 1.39 -0.05 0.00 -1.52 0.00 0.00 31.29 31.73 1vhv h VAL 145 CO 0.04 0.33 0.00 0.40 0.02 0.00 0.00 177.57 178.36 1vhv h ILE 146 N 0.28 0.80 -0.81 4.57 2.04 -1.02 0.77 117.51 124.12 1vhv h ILE 146 Ca 0.07 -0.03 -0.03 0.00 1.00 0.00 0.00 64.86 65.87 1vhv h ILE 146 Cb 0.50 0.70 -0.04 0.00 -0.74 0.00 0.00 36.82 37.24 1vhv h ILE 146 CO 0.02 0.02 0.40 0.11 0.00 0.00 0.00 178.15 178.70 1vhv h LYS 147 N 0.09 1.16 -0.49 2.37 1.57 -1.15 0.81 116.57 120.93 1vhv h LYS 147 Ca 0.14 -0.16 -0.08 0.00 -1.87 0.00 0.00 60.65 58.67 1vhv h LYS 147 Cb 0.18 -0.21 -0.02 0.00 0.08 0.00 0.00 32.23 32.26 1vhv h LYS 147 CO -0.23 0.88 -0.02 0.00 -0.57 0.00 0.00 179.45 179.52 1vhv h ALA 148 N 1.28 0.66 -0.37 3.86 0.00 -0.78 -1.76 119.26 122.15 1vhv h ALA 148 Ca 0.28 -0.29 -0.05 0.00 0.00 0.00 0.00 54.91 54.85 1vhv h ALA 148 Cb 0.10 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1vhv h ALA 148 CO -0.04 0.48 0.05 -0.91 0.00 0.00 0.00 179.25 178.83 1vhv h ASN 149 N 0.73 0.59 -0.13 0.00 2.35 -0.52 -2.13 115.58 116.48 1vhv h ASN 149 Ca 0.14 -0.27 0.04 0.00 -0.55 0.00 0.00 56.30 55.65 1vhv h ASN 149 Cb 0.54 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.74 1vhv h ASN 149 CO 0.03 0.71 0.09 0.03 -1.65 0.00 0.00 177.43 176.65 1vhv h ARG 150 N 0.45 0.00 0.00 0.81 3.08 -0.68 -1.19 114.38 116.85 1vhv h ARG 150 Ca 0.11 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.14 1vhv h ARG 150 Cb 0.38 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.43 1vhv h ARG 150 CO 0.01 0.00 -0.08 0.66 -1.07 0.00 0.00 179.97 179.49 1vhv h SER 151 N 0.00 0.00 -0.22 7.04 4.64 -0.62 -0.64 113.55 123.75 1vhv h SER 151 Ca 0.06 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.31 1vhv h SER 151 Cb 0.25 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.30 1vhv h SER 151 CO -0.00 0.08 -0.07 2.30 -0.87 0.00 0.00 176.83 178.27 1vhv n ILE 152 N -3.73 2.31 -3.72 0.95 -5.35 -0.73 -4.98 119.36 104.11 1vhv n ILE 152 Ca -0.02 -2.39 -0.25 0.00 -0.27 0.00 0.00 62.75 59.82 1vhv n ILE 152 Cb 0.18 -0.28 0.03 0.00 -1.74 0.00 0.00 39.64 37.83 1vhv n ILE 152 CO 0.00 0.00 0.00 -0.67 -1.76 0.00 0.00 176.55 174.12 1vhv n ASP 153 N -0.96 -2.53 -4.24 7.28 2.03 -0.25 -5.02 116.55 112.86 1vhv n ASP 153 Ca 0.25 -0.91 -0.22 0.00 0.52 0.00 0.00 54.79 54.42 1vhv n ASP 153 Cb 0.88 -3.72 -0.13 0.00 -0.72 0.00 0.00 41.12 37.44 1vhv n ASP 153 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1vhv s ALA 154 N -3.66 1.59 0.79 -1.67 0.00 -0.53 -4.74 121.76 113.54 1vhv s ALA 154 Ca 0.17 -1.13 -0.11 0.00 0.00 0.00 0.00 51.96 50.88 1vhv s ALA 154 Cb -0.05 -0.21 0.07 0.00 0.00 0.00 0.00 23.12 22.93 1vhv s ALA 154 CO 0.84 0.30 1.09 -1.01 0.00 0.00 0.00 175.76 176.98 1vhv s HIS 155 N -1.14 2.79 -0.10 0.00 3.76 -0.29 -3.87 115.29 116.43 1vhv s HIS 155 Ca 0.04 1.23 -0.00 0.00 -0.15 0.00 0.00 55.06 56.18 1vhv s HIS 155 Cb -0.10 -3.09 0.02 0.00 1.11 0.00 0.00 32.58 30.53 1vhv s HIS 155 CO 0.03 -1.78 -0.08 0.99 -0.85 0.00 0.00 174.74 173.06 1vhv s THR 156 N -3.09 1.00 -0.16 1.30 2.01 -0.28 -0.46 115.64 115.96 1vhv s THR 156 Ca 0.61 -0.29 -0.21 0.00 0.31 0.00 0.00 61.69 62.11 1vhv s THR 156 Cb -0.15 -1.01 -0.03 0.00 0.01 0.00 0.00 72.50 71.32 1vhv s THR 156 CO 0.55 0.36 0.61 -0.22 -0.69 0.00 0.00 174.62 175.23 1vhv s LEU 157 N 1.55 4.19 -0.17 4.42 2.96 -1.26 0.01 118.68 130.38 1vhv s LEU 157 Ca 0.02 0.88 -0.03 0.00 -0.22 0.00 0.00 54.13 54.78 1vhv s LEU 157 Cb -0.13 -2.88 -0.02 0.00 0.50 0.00 0.00 46.19 43.66 1vhv s LEU 157 CO -0.06 -0.20 -0.06 -0.76 -1.32 0.00 0.00 176.35 173.95 1vhv s LEU 158 N 1.51 3.02 0.15 -0.68 1.43 -1.26 -2.02 118.68 120.83 1vhv s LEU 158 Ca 0.30 -0.25 -0.07 0.00 -1.03 0.00 0.00 54.13 53.08 1vhv s LEU 158 Cb -0.16 -1.73 -0.06 0.00 0.03 0.00 0.00 46.19 44.27 1vhv s LEU 158 CO 0.12 0.11 0.42 -0.36 0.23 0.00 0.00 176.35 176.87 1vhv s PHE 159 N 0.68 3.48 0.17 0.29 0.08 0.08 -4.64 117.98 118.12 1vhv s PHE 159 Ca -0.03 0.67 0.07 0.00 0.12 0.00 0.00 56.93 57.75 1vhv s PHE 159 Cb -0.15 -2.09 -0.04 0.00 -0.57 0.00 0.00 43.02 40.17 1vhv s PHE 159 CO 0.02 0.41 0.02 -0.51 -0.10 0.00 0.00 175.22 175.07 1vhv s LEU 160 N -2.55 3.39 0.36 -0.37 1.43 -1.26 -0.46 118.68 119.22 1vhv s LEU 160 Ca 0.41 -0.35 -0.27 0.00 -1.03 0.00 0.00 54.13 52.89 1vhv s LEU 160 Cb -0.12 -2.04 -0.12 0.00 0.03 0.00 0.00 46.19 43.94 1vhv s LEU 160 CO 0.23 0.09 1.22 -0.67 0.23 0.00 0.00 176.35 177.44 1vhv n ASP 161 N -0.14 2.35 -0.04 2.29 -0.08 -0.21 -4.88 116.55 115.84 1vhv n ASP 161 Ca -0.09 1.16 0.01 0.00 -1.51 0.00 0.00 54.79 54.36 1vhv n ASP 161 Cb 0.55 -1.45 -0.14 0.00 2.34 0.00 0.00 41.12 42.42 1vhv n ASP 161 CO 0.00 0.00 0.00 -0.11 0.12 0.00 0.00 177.20 177.21 1vhv n LEU 162 N 0.65 0.00 -4.32 -2.67 -0.00 -1.26 -4.31 117.00 105.10 1vhv n LEU 162 Ca 0.06 0.00 -0.27 0.00 -0.00 0.00 0.00 56.01 55.80 1vhv n LEU 162 Cb 0.37 0.19 -0.14 0.00 -0.00 0.00 0.00 43.42 43.84 1vhv n LEU 162 CO 0.61 0.19 -0.55 -1.00 -0.00 0.00 0.00 177.39 176.64 1vhv s HIS 163 N -2.88 2.08 -0.73 1.96 3.76 -1.26 -2.88 115.29 115.33 1vhv s HIS 163 Ca -0.07 -0.39 0.25 0.00 -0.15 0.00 0.00 55.06 54.69 1vhv s HIS 163 Cb 0.09 -1.20 0.91 0.00 1.11 0.00 0.00 32.58 33.49 1vhv s HIS 163 CO 0.73 0.18 1.77 -0.35 -0.85 0.00 0.00 174.74 176.22 1vhv n PRO 164 N 1.49 0.19 -4.07 8.40 -0.04 -1.26 -4.87 135.00 134.84 1vhv n PRO 164 Ca -0.18 0.23 -0.13 0.00 -0.04 0.00 0.00 63.50 63.39 1vhv n PRO 164 Cb 0.53 -1.75 -0.12 0.00 -0.04 0.00 0.00 33.50 32.12 1vhv n PRO 164 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1vhv s GLU 165 N -3.13 0.52 0.00 0.54 0.41 -1.22 -5.28 118.70 110.54 1vhv s GLU 165 Ca 0.09 -0.74 0.00 0.00 -0.41 0.00 0.00 54.97 53.92 1vhv s GLU 165 Cb 0.12 -0.30 0.00 0.00 -1.78 0.00 0.00 34.13 32.18 1vhv s GLU 165 CO 0.52 0.05 0.00 -0.35 -0.49 0.00 0.00 175.26 174.99 1vhv n PRO 166 N 1.52 1.16 -4.03 0.39 -0.04 -1.14 -4.49 135.00 128.37 1vhv n PRO 166 Ca -0.22 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.14 1vhv n PRO 166 Cb 0.55 0.00 -0.08 0.00 -0.04 0.00 0.00 33.50 33.93 1vhv n PRO 166 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 1vhv s THR 168 N 0.00 0.09 0.26 0.52 -4.23 -1.26 -5.00 115.64 106.01 1vhv s THR 168 Ca 0.00 -1.58 -0.03 0.00 -1.18 0.00 0.00 61.69 58.91 1vhv s THR 168 Cb 0.00 -1.87 0.23 0.00 1.34 0.00 0.00 72.50 72.20 1vhv s THR 168 CO 0.00 -0.41 1.81 0.40 -0.54 0.00 0.00 174.62 175.88 1vhv h ILE 169 N 2.69 0.89 -0.55 2.99 2.04 -1.94 -2.35 117.51 121.29 1vhv h ILE 169 Ca -0.33 -0.28 0.10 0.00 1.00 0.00 0.00 64.86 65.35 1vhv h ILE 169 Cb 1.21 0.00 -0.08 0.00 -0.74 0.00 0.00 36.82 37.21 1vhv h ILE 169 CO 0.53 0.15 0.09 1.23 0.00 0.00 0.00 178.15 180.15 1vhv h GLY 170 N 0.81 0.66 1.47 5.37 0.00 -1.94 -0.69 103.07 108.75 1vhv h GLY 170 Ca 0.43 -0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.69 1vhv h GLY 170 CO -0.27 -0.11 -0.04 0.45 0.00 0.00 0.00 176.54 176.58 1vhv h HIS 171 N 0.21 0.69 -0.33 5.60 3.86 -1.89 -2.63 115.15 120.66 1vhv h HIS 171 Ca 0.28 -0.09 -0.14 0.00 -1.16 0.00 0.00 60.37 59.26 1vhv h HIS 171 Cb 0.41 -0.19 -0.01 0.00 1.06 0.00 0.00 27.41 28.68 1vhv h HIS 171 CO -0.26 0.68 -0.37 0.00 0.86 0.00 0.00 177.93 178.84 1vhv h ALA 172 N 1.35 0.72 -0.17 2.45 0.00 -0.88 -0.60 119.26 122.13 1vhv h ALA 172 Ca 0.12 -0.44 0.00 0.00 0.00 0.00 0.00 54.91 54.59 1vhv h ALA 172 Cb 0.44 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1vhv h ALA 172 CO 0.02 0.66 0.11 0.28 0.00 0.00 0.00 179.25 180.32 1vhv h VAL 173 N 0.64 1.05 -0.54 0.00 2.07 -0.95 -0.31 116.25 118.21 1vhv h VAL 173 Ca 0.06 -0.09 0.06 0.00 0.82 0.00 0.00 66.70 67.55 1vhv h VAL 173 Cb 0.92 0.81 -0.05 0.00 -1.52 0.00 0.00 31.29 31.44 1vhv h VAL 173 CO 0.08 0.04 0.24 -0.33 0.02 0.00 0.00 177.57 177.63 1vhv h GLU 174 N 0.22 0.45 -0.33 1.57 5.08 -1.22 -1.06 114.58 119.29 1vhv h GLU 174 Ca 0.06 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.39 1vhv h GLU 174 Cb -0.02 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.11 1vhv h GLU 174 CO -0.01 0.30 0.19 -0.97 -1.00 0.00 0.00 179.01 177.51 1vhv h ASN 175 N 0.46 0.41 -0.45 1.42 -0.73 -0.68 0.61 115.58 116.63 1vhv h ASN 175 Ca 0.25 -0.08 -0.04 0.00 1.87 0.00 0.00 56.30 58.30 1vhv h ASN 175 Cb 0.22 -0.10 -0.02 0.00 0.27 0.00 0.00 38.32 38.69 1vhv h ASN 175 CO -0.21 0.37 0.12 -0.07 -0.37 0.00 0.00 177.43 177.27 1vhv h LEU 176 N 0.42 0.66 -0.77 0.34 3.38 -0.78 -1.88 115.31 116.69 1vhv h LEU 176 Ca 0.12 -0.22 -0.10 0.00 0.09 0.00 0.00 57.88 57.77 1vhv h LEU 176 Cb 0.05 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.61 1vhv h LEU 176 CO -0.02 0.71 -0.11 0.40 0.09 0.00 0.00 178.44 179.51 1vhv h ILE 177 N 0.58 1.26 -0.81 1.22 2.04 -1.04 -1.15 117.51 119.61 1vhv h ILE 177 Ca 0.14 -1.19 -0.02 0.00 1.00 0.00 0.00 64.86 64.79 1vhv h ILE 177 Cb 0.30 1.03 -0.04 0.00 -0.74 0.00 0.00 36.82 37.37 1vhv h ILE 177 CO -0.00 0.41 0.43 0.00 0.00 0.00 0.00 178.15 178.99 1vhv h ALA 178 N 1.13 1.04 -0.40 1.87 0.00 -0.61 -2.79 119.26 119.50 1vhv h ALA 178 Ca 0.12 -0.13 -0.11 0.00 0.00 0.00 0.00 54.91 54.79 1vhv h ALA 178 Cb 0.61 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1vhv h ALA 178 CO 0.04 0.56 -0.18 1.49 0.00 0.00 0.00 179.25 181.17 1vhv h GLU 179 N 1.13 0.83 -1.80 0.00 4.57 -1.15 -3.43 114.58 114.73 1vhv h GLU 179 Ca 0.28 -0.35 -0.15 0.00 -1.18 0.00 0.00 59.36 57.96 1vhv h GLU 179 Cb 0.05 -0.03 -0.29 0.00 -0.16 0.00 0.00 28.75 28.33 1vhv h GLU 179 CO -0.04 0.99 -0.48 0.34 -1.18 0.00 0.00 179.01 178.63 1vhv s ASP 180 N -6.53 0.20 0.41 1.04 -1.08 -0.45 -5.03 116.67 105.23 1vhv s ASP 180 Ca -0.12 0.11 0.20 0.00 -0.52 0.00 0.00 52.55 52.23 1vhv s ASP 180 Cb 0.10 1.17 1.15 0.00 -1.46 0.00 0.00 42.92 43.88 1vhv s ASP 180 CO 0.84 -0.31 1.78 0.00 0.52 0.00 0.00 175.17 178.00 1vhv h ALA 181 N 8.17 2.32 0.00 3.66 0.00 -1.76 -3.39 119.26 128.26 1vhv h ALA 181 Ca -0.17 0.05 -0.09 0.00 0.00 0.00 0.00 54.91 54.70 1vhv h ALA 181 Cb 1.15 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.97 1vhv h ALA 181 CO 0.27 -0.71 1.13 1.04 0.00 0.00 0.00 179.25 180.98 1vhv n GLN 182 N -4.57 0.53 0.00 0.00 6.02 -1.26 -4.58 117.38 113.51 1vhv n GLN 182 Ca 0.25 -0.59 0.00 0.00 -0.01 0.00 0.00 57.00 56.65 1vhv n GLN 182 Cb 0.90 -1.96 0.00 0.00 1.02 0.00 0.00 30.24 30.20 1vhv n GLN 182 CO 0.00 0.00 0.00 0.36 -1.01 0.00 0.00 177.06 176.41 1vhv n LYS 184 N 4.19 0.00 -0.04 -1.09 2.85 -1.26 -4.10 118.16 118.70 1vhv n LYS 184 Ca 0.11 0.00 0.12 0.00 -1.05 0.00 0.00 58.31 57.50 1vhv n LYS 184 Cb 0.07 -0.28 0.28 0.00 -0.65 0.00 0.00 35.03 34.46 1vhv n LYS 184 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 1vhv n ASP 185 N 0.00 2.46 -4.77 -5.58 8.00 -1.26 -1.74 116.55 113.66 1vhv n ASP 185 Ca 0.00 -1.81 -0.38 0.00 0.71 0.00 0.00 54.79 53.30 1vhv n ASP 185 Cb 0.00 -0.06 -0.05 0.00 -0.02 0.00 0.00 41.12 40.99 1vhv n ASP 185 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1vhv s LEU 186 N -1.85 4.40 0.26 0.64 1.43 -1.26 -4.72 118.68 117.59 1vhv s LEU 186 Ca 0.33 2.04 -0.30 0.00 -1.03 0.00 0.00 54.13 55.17 1vhv s LEU 186 Cb 0.20 -3.88 -0.09 0.00 0.03 0.00 0.00 46.19 42.46 1vhv s LEU 186 CO 0.31 -0.16 1.04 -0.31 0.23 0.00 0.00 176.35 177.45 1vhv s TYR 187 N -1.42 3.74 0.19 0.29 2.02 -1.26 -0.20 117.35 120.72 1vhv s TYR 187 Ca 0.49 1.79 -0.06 0.00 -0.37 0.00 0.00 57.07 58.92 1vhv s TYR 187 Cb -0.25 -3.16 -0.02 0.00 -0.40 0.00 0.00 41.96 38.13 1vhv s TYR 187 CO 0.31 -0.15 0.24 0.00 -1.57 0.00 0.00 175.55 174.39 1vhv s ALA 188 N -1.14 0.49 -0.08 3.71 0.00 -0.40 -1.03 121.76 123.32 1vhv s ALA 188 Ca 0.43 -1.26 0.02 0.00 0.00 0.00 0.00 51.96 51.14 1vhv s ALA 188 Cb -0.30 1.10 0.02 0.00 0.00 0.00 0.00 23.12 23.94 1vhv s ALA 188 CO 0.37 -0.65 -0.11 0.08 0.00 0.00 0.00 175.76 175.45 1vhv s VAL 189 N -4.06 1.13 -0.18 0.00 1.01 -0.07 -1.52 120.40 116.70 1vhv s VAL 189 Ca 0.27 -0.44 -0.09 0.00 0.00 0.00 0.00 61.98 61.72 1vhv s VAL 189 Cb 0.04 -1.05 -0.05 0.00 0.00 0.00 0.00 36.38 35.32 1vhv s VAL 189 CO 0.07 0.36 0.13 -0.83 0.00 0.00 0.00 175.10 174.83 1vhv s GLY 190 N 0.91 2.06 -0.13 4.51 0.00 0.00 -0.53 107.32 114.15 1vhv s GLY 190 Ca -0.10 -0.68 0.00 0.00 0.00 0.00 0.00 44.72 43.94 1vhv s GLY 190 CO 0.01 0.02 -0.12 -0.42 0.00 0.00 0.00 173.10 172.59 1vhv s ILE 191 N 0.05 1.35 -0.09 0.90 1.01 -0.35 -1.67 121.20 122.40 1vhv s ILE 191 Ca 0.09 -0.50 -0.00 0.00 0.00 0.00 0.00 60.65 60.24 1vhv s ILE 191 Cb -0.11 -1.29 -0.03 0.00 0.01 0.00 0.00 42.46 41.04 1vhv s ILE 191 CO -0.01 0.42 -0.06 0.00 0.00 0.00 0.00 174.94 175.30 1vhv s ALA 192 N 1.48 3.01 -1.40 9.38 0.00 0.06 -1.32 121.76 132.96 1vhv s ALA 192 Ca 0.03 -0.86 -0.07 0.00 0.00 0.00 0.00 51.96 51.06 1vhv s ALA 192 Cb -0.13 -1.33 0.04 0.00 0.00 0.00 0.00 23.12 21.70 1vhv s ALA 192 CO -0.08 0.49 0.90 0.54 0.00 0.00 0.00 175.76 177.60 1vhv n ARG 193 N 2.54 -5.67 -1.63 0.00 1.74 -0.34 -2.72 116.66 110.57 1vhv n ARG 193 Ca -0.18 0.65 -0.49 0.00 -0.77 0.00 0.00 57.85 57.06 1vhv n ARG 193 Cb 0.53 -5.44 -0.05 0.00 -1.02 0.00 0.00 32.46 26.47 1vhv n ARG 193 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1vhv n ALA 194 N -4.53 0.19 0.00 7.54 0.00 -1.26 -1.48 120.51 120.96 1vhv n ALA 194 Ca -0.12 0.48 0.00 0.00 0.00 0.00 0.00 53.44 53.80 1vhv n ALA 194 Cb 0.60 -2.22 0.00 0.00 0.00 0.00 0.00 19.45 17.83 1vhv n ALA 194 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1vhv n GLY 195 N 3.02 1.23 0.17 0.00 0.00 -1.26 -4.79 105.19 103.56 1vhv n GLY 195 Ca 0.18 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.25 1vhv n GLY 195 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1vhv h SER 196 N 0.00 0.00 0.00 1.61 4.64 -1.61 -3.42 113.55 114.77 1vhv h SER 196 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1vhv h SER 196 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1vhv h SER 196 CO 0.00 0.41 0.00 0.61 -0.87 0.00 0.00 176.83 176.98 1vhv n GLY 197 N 0.69 1.37 1.85 -0.77 0.00 -1.26 -4.84 105.19 102.23 1vhv n GLY 197 Ca 0.01 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.95 1vhv n GLY 197 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1vhv n GLU 198 N -2.00 2.26 -1.20 1.61 1.02 -1.26 -5.09 120.64 115.98 1vhv n GLU 198 Ca 0.00 -3.55 -0.32 0.00 -0.02 0.00 0.00 57.16 53.27 1vhv n GLU 198 Cb 0.00 -1.68 0.11 0.00 -0.02 0.00 0.00 31.44 29.85 1vhv n GLU 198 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 1vhv s GLU 199 N -3.12 1.92 -0.29 3.49 8.01 -1.26 -4.96 118.70 122.49 1vhv s GLU 199 Ca 0.40 1.46 -0.02 0.00 0.01 0.00 0.00 54.97 56.82 1vhv s GLU 199 Cb 0.38 -1.84 0.05 0.00 -4.31 0.00 0.00 34.13 28.41 1vhv s GLU 199 CO -0.03 -1.94 -0.01 0.08 0.01 0.00 0.00 175.26 173.37 1vhv s VAL 200 N -2.53 3.00 -0.17 2.63 1.01 -1.10 -4.97 120.40 118.27 1vhv s VAL 200 Ca 0.67 -1.33 0.01 0.00 0.00 0.00 0.00 61.98 61.33 1vhv s VAL 200 Cb -0.22 -2.70 0.02 0.00 0.00 0.00 0.00 36.38 33.48 1vhv s VAL 200 CO 0.52 -0.07 -0.18 -0.69 0.00 0.00 0.00 175.10 174.68 1vhv s VAL 201 N 1.27 1.89 -0.04 2.92 1.01 -1.26 -0.76 120.40 125.43 1vhv s VAL 201 Ca -0.05 -0.84 -0.00 0.00 0.00 0.00 0.00 61.98 61.10 1vhv s VAL 201 Cb -0.19 -1.72 0.03 0.00 0.00 0.00 0.00 36.38 34.49 1vhv s VAL 201 CO -0.01 0.51 -0.00 -0.75 0.00 0.00 0.00 175.10 174.85 1vhv s LYS 202 N 1.32 0.40 -0.18 2.72 2.47 -0.67 -4.41 119.74 121.39 1vhv s LYS 202 Ca 0.04 0.08 -0.07 0.00 -1.56 0.00 0.00 55.97 54.46 1vhv s LYS 202 Cb -0.13 -0.62 -0.04 0.00 -1.46 0.00 0.00 37.83 35.58 1vhv s LYS 202 CO -0.11 -0.17 0.05 0.00 0.16 0.00 0.00 175.35 175.27 1vhv n ASP 204 N 3.56 -1.80 -4.74 0.00 -0.08 -0.58 -4.19 116.55 108.72 1vhv n ASP 204 Ca -0.17 -1.99 -0.37 0.00 -1.51 0.00 0.00 54.79 50.75 1vhv n ASP 204 Cb 0.52 2.94 0.06 0.00 2.34 0.00 0.00 41.12 46.98 1vhv n ASP 204 CO 0.00 0.00 0.00 -0.13 0.12 0.00 0.00 177.20 177.19 1vhv s ARG 205 N -2.06 2.76 0.16 -0.67 0.52 -1.26 -1.27 118.95 117.13 1vhv s ARG 205 Ca 0.22 2.12 -0.18 0.00 -0.52 0.00 0.00 55.73 57.37 1vhv s ARG 205 Cb -0.03 -1.98 0.09 0.00 0.52 0.00 0.00 34.95 33.54 1vhv s ARG 205 CO 0.06 -1.45 1.66 1.25 0.02 0.00 0.00 175.30 176.84 1vhv h LEU 206 N 0.86 -0.46 -1.54 2.53 5.85 -0.44 -0.16 115.31 121.94 1vhv h LEU 206 Ca -0.51 0.13 0.06 0.00 0.84 0.00 0.00 57.88 58.40 1vhv h LEU 206 Cb 1.32 0.28 -0.03 0.00 0.37 0.00 0.00 40.66 42.60 1vhv h LEU 206 CO 0.55 -0.17 0.39 1.05 -0.34 0.00 0.00 178.44 179.92 1vhv h GLU 207 N -0.05 0.54 0.00 1.25 4.11 -1.63 -0.75 114.58 118.05 1vhv h GLU 207 Ca 0.19 -0.03 0.00 0.00 0.07 0.00 0.00 59.36 59.58 1vhv h GLU 207 Cb 0.33 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.46 1vhv h GLU 207 CO -0.42 0.36 0.00 -0.91 0.07 0.00 0.00 179.01 178.11 1vhv h ASN 208 N 0.56 0.00 0.53 3.06 2.35 -1.30 -2.94 115.58 117.85 1vhv h ASN 208 Ca 0.25 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.00 1vhv h ASN 208 Cb 0.29 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.66 1vhv h ASN 208 CO -0.07 0.00 0.00 0.18 -1.65 0.00 0.00 177.43 175.89 1vhv n LEU 209 N -2.75 0.03 0.21 1.61 4.77 -0.29 -2.69 117.00 117.90 1vhv n LEU 209 Ca -0.00 0.51 0.15 0.00 -0.03 0.00 0.00 56.01 56.63 1vhv n LEU 209 Cb 0.20 -0.50 0.56 0.00 -2.33 0.00 0.00 43.42 41.34 1vhv n LEU 209 CO 0.21 -0.25 0.93 0.11 -1.33 0.00 0.00 177.39 177.06 1vhv h LYS 210 N 0.00 0.00 0.00 3.23 1.57 -1.69 -2.88 116.57 116.80 1vhv h LYS 210 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1vhv h LYS 210 Cb 0.27 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.58 1vhv h LYS 210 CO 0.00 0.00 0.00 1.63 -0.57 0.00 0.00 179.45 180.51 1vhv n LYS 211 N -2.77 0.07 -3.47 3.15 5.02 -1.09 -4.86 118.16 114.21 1vhv n LYS 211 Ca 0.02 0.07 -0.37 0.00 -2.02 0.00 0.00 58.31 56.01 1vhv n LYS 211 Cb 0.31 -1.59 -0.06 0.00 -0.02 0.00 0.00 35.03 33.67 1vhv n LYS 211 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1vhv s ILE 212 N -3.03 4.99 -0.72 -0.18 -1.09 -1.09 -5.02 121.20 115.05 1vhv s ILE 212 Ca 0.13 0.80 -0.20 0.00 -2.23 0.00 0.00 60.65 59.14 1vhv s ILE 212 Cb 0.17 -3.72 0.10 0.00 -1.58 0.00 0.00 42.46 37.42 1vhv s ILE 212 CO 0.54 0.47 0.94 -0.62 -1.23 0.00 0.00 174.94 175.04 1vhv s ASP 213 N -1.31 6.31 0.00 3.58 -1.08 -1.26 -4.87 116.67 118.04 1vhv s ASP 213 Ca 0.28 -1.42 0.31 0.00 -0.52 0.00 0.00 52.55 51.20 1vhv s ASP 213 Cb -0.16 -2.38 1.75 0.00 -1.46 0.00 0.00 42.92 40.67 1vhv s ASP 213 CO 0.16 -1.24 2.14 0.49 0.52 0.00 0.00 175.17 177.24 1vhv n PHE 214 N 6.98 0.00 -4.43 -5.34 3.72 -1.26 -5.03 117.46 112.10 1vhv n PHE 214 Ca 0.03 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.43 1vhv n PHE 214 Cb 0.46 -0.03 0.00 0.00 -0.94 0.00 0.00 39.48 38.97 1vhv n PHE 214 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1vhv n GLY 215 N 1.05 -0.40 3.80 1.37 0.00 -1.26 -4.75 105.19 105.00 1vhv n GLY 215 Ca 0.22 -1.09 -0.33 0.00 0.00 0.00 0.00 46.02 44.83 1vhv n GLY 215 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1vhv s LYS 216 N 0.00 3.25 1.10 1.61 1.02 -1.26 -5.04 119.74 120.42 1vhv s LYS 216 Ca 0.00 1.23 -0.13 0.00 0.02 0.00 0.00 55.97 57.09 1vhv s LYS 216 Cb 0.00 -2.02 0.25 0.00 -0.52 0.00 0.00 37.83 35.53 1vhv s LYS 216 CO 0.00 -0.87 1.06 -2.14 -0.92 0.00 0.00 175.35 172.48 1vhv s PRO 217 N -4.08 -0.38 0.42 -1.68 0.02 -1.26 -4.50 135.00 123.53 1vhv s PRO 217 Ca 0.64 0.70 -0.18 0.00 0.02 0.00 0.00 61.00 62.19 1vhv s PRO 217 Cb -0.17 -1.63 -0.09 0.00 0.02 0.00 0.00 34.50 32.63 1vhv s PRO 217 CO 0.38 -3.33 0.89 -0.51 -0.33 0.00 0.00 177.00 174.10 1vhv s LEU 218 N -6.91 3.88 0.09 -5.54 1.43 -1.26 -4.80 118.68 105.57 1vhv s LEU 218 Ca 0.67 1.51 0.09 0.00 -1.03 0.00 0.00 54.13 55.38 1vhv s LEU 218 Cb -0.22 -4.38 -0.03 0.00 0.03 0.00 0.00 46.19 41.59 1vhv s LEU 218 CO 0.62 -0.38 -0.24 -1.00 0.23 0.00 0.00 176.35 175.57 1vhv s HIS 219 N -2.26 2.10 0.00 0.29 3.76 -1.26 -1.20 115.29 116.72 1vhv s HIS 219 Ca 0.58 -0.40 0.00 0.00 -0.15 0.00 0.00 55.06 55.10 1vhv s HIS 219 Cb -0.10 -1.18 0.00 0.00 1.11 0.00 0.00 32.58 32.41 1vhv s HIS 219 CO 0.20 0.22 0.00 1.33 -0.85 0.00 0.00 174.74 175.64 1vhv n VAL 220 N 1.27 0.00 -3.67 -0.90 0.24 -0.44 -4.21 118.33 110.62 1vhv n VAL 220 Ca -0.18 0.00 -0.09 0.00 -2.04 0.00 0.00 64.34 62.03 1vhv n VAL 220 Cb 0.53 0.00 -0.09 0.00 -1.47 0.00 0.00 33.84 32.81 1vhv n VAL 220 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 1vhv s VAL 222 N -1.41 -0.02 -0.27 3.34 1.01 0.32 -1.21 120.40 122.15 1vhv s VAL 222 Ca 0.00 0.05 -0.11 0.00 0.00 0.00 0.00 61.98 61.93 1vhv s VAL 222 Cb 0.00 -0.77 -0.05 0.00 0.00 0.00 0.00 36.38 35.56 1vhv s VAL 222 CO 0.00 0.02 0.18 -0.69 0.00 0.00 0.00 175.10 174.61 1vhv s VAL 223 N 1.51 5.27 0.67 2.92 1.01 0.10 -0.89 120.40 130.98 1vhv s VAL 223 Ca -0.10 0.15 -0.16 0.00 0.00 0.00 0.00 61.98 61.88 1vhv s VAL 223 Cb -0.07 -3.50 0.01 0.00 0.00 0.00 0.00 36.38 32.82 1vhv s VAL 223 CO -0.16 0.27 1.17 -0.76 0.00 0.00 0.00 175.10 175.62 1vhv s LEU 224 N 1.63 3.43 1.27 3.92 1.43 -0.19 -1.12 118.68 129.05 1vhv s LEU 224 Ca 0.07 2.23 -0.17 0.00 -1.03 0.00 0.00 54.13 55.22 1vhv s LEU 224 Cb -0.16 -4.58 0.32 0.00 0.03 0.00 0.00 46.19 41.80 1vhv s LEU 224 CO 0.09 -1.85 0.99 0.00 0.23 0.00 0.00 176.35 175.82 1vhv s ALA 225 N -2.02 -0.47 0.19 4.21 0.00 -1.25 -4.82 121.76 117.60 1vhv s ALA 225 Ca 0.72 -0.51 -0.09 0.00 0.00 0.00 0.00 51.96 52.08 1vhv s ALA 225 Cb -0.26 -3.08 0.11 0.00 0.00 0.00 0.00 23.12 19.89 1vhv s ALA 225 CO 0.40 -4.11 1.71 0.87 0.00 0.00 0.00 175.76 174.64 1vhv h LYS 226 N -2.93 1.09 -5.75 0.00 1.57 -1.84 -3.45 116.57 105.25 1vhv h LYS 226 Ca -0.53 -0.25 -0.63 0.00 -1.87 0.00 0.00 60.65 57.37 1vhv h LYS 226 Cb 1.34 -0.15 -0.13 0.00 0.08 0.00 0.00 32.23 33.37 1vhv h LYS 226 CO 0.41 0.96 -0.63 0.95 -0.57 0.00 0.00 179.45 180.57 1vhv s THR 227 N -5.35 2.08 0.00 -0.16 -4.23 -1.26 -4.84 115.64 101.88 1vhv s THR 227 Ca -0.12 -2.07 0.05 0.00 -1.18 0.00 0.00 61.69 58.37 1vhv s THR 227 Cb 0.14 -2.88 -0.01 0.00 1.34 0.00 0.00 72.50 71.09 1vhv s THR 227 CO 0.84 -0.07 -0.16 -0.76 -0.54 0.00 0.00 174.62 173.93 1vhv s LEU 228 N -3.67 2.07 0.61 4.79 1.43 -0.22 -4.99 118.68 118.70 1vhv s LEU 228 Ca 0.34 -0.33 -0.16 0.00 -1.03 0.00 0.00 54.13 52.94 1vhv s LEU 228 Cb 0.07 -0.77 -0.02 0.00 0.03 0.00 0.00 46.19 45.50 1vhv s LEU 228 CO 0.17 0.16 1.10 -2.28 0.23 0.00 0.00 176.35 175.74 1vhv s HIS 229 N -0.49 2.70 0.00 0.29 5.65 -1.26 -4.19 115.29 117.99 1vhv s HIS 229 Ca 0.05 1.54 0.00 0.00 0.25 0.00 0.00 55.06 56.91 1vhv s HIS 229 Cb -0.07 -3.17 0.00 0.00 -1.18 0.00 0.00 32.58 28.16 1vhv s HIS 229 CO -0.00 -1.54 0.00 0.34 -0.65 0.00 0.00 174.74 172.89 1vhv n PHE 230 N -2.01 0.00 0.00 3.88 7.35 -1.26 -1.52 117.46 123.90 1vhv n PHE 230 Ca 0.10 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.79 1vhv n PHE 230 Cb 0.52 -0.13 0.00 0.00 0.35 0.00 0.00 39.48 40.22 1vhv n PHE 230 CO 0.00 0.00 0.00 0.39 -0.76 0.00 0.00 176.76 176.39 1vhv n GLU 232 N 1.18 0.00 -0.11 -4.13 1.02 -1.26 -1.12 120.64 116.22 1vhv n GLU 232 Ca 0.00 0.00 -0.06 0.00 -0.02 0.00 0.00 57.16 57.08 1vhv n GLU 232 Cb 0.00 0.00 0.02 0.00 -0.02 0.00 0.00 31.44 31.44 1vhv n GLU 232 CO 0.00 0.00 0.00 0.35 1.18 0.00 0.00 177.13 178.66 1vhv h PHE 233 N 0.00 0.16 -0.83 -0.32 3.57 -1.60 -1.08 116.94 116.84 1vhv h PHE 233 Ca 0.00 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.51 1vhv h PHE 233 Cb 0.00 -0.02 -0.04 0.00 2.79 0.00 0.00 35.95 38.68 1vhv h PHE 233 CO 0.00 0.04 0.46 0.93 -2.23 0.00 0.00 178.31 177.51 1vhv h GLU 234 N 0.22 1.15 -0.19 1.11 5.08 -1.40 -1.00 114.58 119.56 1vhv h GLU 234 Ca 0.17 -0.13 -0.16 0.00 -1.00 0.00 0.00 59.36 58.25 1vhv h GLU 234 Cb 0.18 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.19 1vhv h GLU 234 CO -0.21 0.84 -0.53 0.00 -1.00 0.00 0.00 179.01 178.11 1vhv h LEU 236 N 0.42 0.47 -0.68 0.00 3.38 -0.80 0.56 115.31 118.66 1vhv h LEU 236 Ca 0.01 -0.22 -0.07 0.00 0.09 0.00 0.00 57.88 57.69 1vhv h LEU 236 Cb 1.07 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.66 1vhv h LEU 236 CO 0.10 0.87 0.15 0.03 0.09 0.00 0.00 178.44 179.68 1vhv h ARG 237 N 0.35 1.10 0.21 1.13 2.47 -1.05 -0.86 114.38 117.73 1vhv h ARG 237 Ca 0.02 -0.27 -0.35 0.00 -1.26 0.00 0.00 59.98 58.12 1vhv h ARG 237 Cb 0.96 -0.14 0.02 0.00 -1.65 0.00 0.00 29.97 29.16 1vhv h ARG 237 CO 0.08 0.98 -1.65 1.49 0.56 0.00 0.00 179.97 181.44 1vhv h GLU 238 N 1.03 0.45 0.00 0.04 4.57 -1.01 -3.14 114.58 116.51 1vhv h GLU 238 Ca 0.21 -0.76 -0.11 0.00 -1.18 0.00 0.00 59.36 57.52 1vhv h GLU 238 Cb 0.39 0.28 -0.02 0.00 -0.16 0.00 0.00 28.75 29.24 1vhv h GLU 238 CO 0.00 1.36 -1.83 1.19 -1.18 0.00 0.00 179.01 178.56 1vhv n PHE 239 N -3.63 0.34 -0.76 0.92 3.72 0.19 -4.35 117.46 113.88 1vhv n PHE 239 Ca -0.21 0.11 0.07 0.00 -0.05 0.00 0.00 57.45 57.36 1vhv n PHE 239 Cb 1.09 -0.79 0.11 0.00 -0.94 0.00 0.00 39.48 38.94 1vhv n PHE 239 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1vhv n ALA 240 N -2.38 2.22 -3.53 4.37 0.00 -0.36 -4.75 120.51 116.08 1vhv n ALA 240 Ca -0.11 -2.14 -0.26 0.00 0.00 0.00 0.00 53.44 50.93 1vhv n ALA 240 Cb 0.75 -0.29 0.00 0.00 0.00 0.00 0.00 19.45 19.91 1vhv n ALA 240 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1vhv n ASP 241 N -1.10 -4.11 -4.76 0.00 2.03 -1.07 -1.30 116.55 106.23 1vhv n ASP 241 Ca 0.12 -0.52 -0.38 0.00 0.52 0.00 0.00 54.79 54.52 1vhv n ASP 241 Cb 0.54 -3.36 0.01 0.00 -0.72 0.00 0.00 41.12 37.59 1vhv n ASP 241 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1vhv s ALA 242 N -3.06 3.01 0.67 -1.67 0.00 -1.01 -4.68 121.76 115.03 1vhv s ALA 242 Ca 0.48 1.21 -0.15 0.00 0.00 0.00 0.00 51.96 53.51 1vhv s ALA 242 Cb -0.25 -3.50 0.00 0.00 0.00 0.00 0.00 23.12 19.38 1vhv s ALA 242 CO 0.59 -1.02 1.11 -1.25 0.00 0.00 0.00 175.76 175.19 1vhv s PRO 243 N -2.64 2.74 0.46 0.00 0.04 -1.26 -4.74 135.00 129.60 1vhv s PRO 243 Ca 0.65 1.39 0.13 0.00 0.04 0.00 0.00 61.00 63.21 1vhv s PRO 243 Cb -0.37 -1.94 1.08 0.00 0.04 0.00 0.00 34.50 33.31 1vhv s PRO 243 CO 0.45 -1.30 2.07 0.00 0.04 0.00 0.00 177.00 178.27 1vhv h ALA 244 N -0.05 1.94 0.00 8.56 0.00 -2.00 -2.27 119.26 125.44 1vhv h ALA 244 Ca -0.47 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.43 1vhv h ALA 244 Cb 1.25 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1vhv h ALA 244 CO 0.54 0.02 0.00 -0.85 0.00 0.00 0.00 179.25 178.96 1vhv n GLU 245 N -4.49 0.34 0.27 0.00 0.00 -1.26 -1.83 120.64 113.67 1vhv n GLU 245 Ca 0.03 0.08 0.15 0.00 0.00 0.00 0.00 57.16 57.42 1vhv n GLU 245 Cb 0.18 -1.50 0.75 0.00 0.00 0.00 0.00 31.44 30.86 1vhv n GLU 245 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.13 178.38 1vhv h LEU 246 N 0.00 0.00 -1.32 -1.84 5.85 -1.78 -2.13 115.31 114.09 1vhv h LEU 246 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1vhv h LEU 246 Cb 0.08 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.11 1vhv h LEU 246 CO 0.00 0.09 0.00 -0.08 -0.34 0.00 0.00 178.44 178.11 1vhv h GLU 247 N 0.00 0.00 0.00 1.25 4.81 -1.59 -1.68 114.58 117.37 1vhv h GLU 247 Ca -0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1vhv h GLU 247 Cb 0.39 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.77 1vhv h GLU 247 CO 0.01 0.00 0.00 0.00 -0.73 0.00 0.00 179.01 178.29 1vhv h ARG 248 N 0.00 0.00 0.00 1.92 3.08 -1.64 -1.68 114.38 116.06 1vhv h ARG 248 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1vhv h ARG 248 Cb 0.15 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.20 1vhv h ARG 248 CO 0.00 0.00 -0.04 1.28 -1.07 0.00 0.00 179.97 180.14 1vhv n LEU 249 N -2.79 0.67 -4.65 3.04 4.32 -0.63 -4.73 117.00 112.23 1vhv n LEU 249 Ca -0.00 0.54 -0.42 0.00 -0.02 0.00 0.00 56.01 56.11 1vhv n LEU 249 Cb 0.21 -0.34 -0.04 0.00 -1.62 0.00 0.00 43.42 41.63 1vhv n LEU 249 CO 0.22 -0.14 0.68 -0.69 -1.22 0.00 0.00 177.39 176.24 1vhv s VAL 250 N -3.09 4.82 -2.00 4.08 1.01 -0.63 -1.06 120.40 123.53 1vhv s VAL 250 Ca 0.11 1.66 0.32 0.00 0.00 0.00 0.00 61.98 64.07 1vhv s VAL 250 Cb 0.14 -4.15 0.91 0.00 0.00 0.00 0.00 36.38 33.27 1vhv s VAL 250 CO 0.59 -0.07 2.22 0.00 0.00 0.00 0.00 175.10 177.85