#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qov n LYS 2 N 0.00 0.18 -0.95 2.12 2.85 -1.26 -5.17 118.16 115.94 2qov n LYS 2 Ca 0.00 -0.78 -0.35 0.00 -1.05 0.00 0.00 58.31 56.12 2qov n LYS 2 Cb 0.00 -0.32 0.06 0.00 -0.65 0.00 0.00 35.03 34.13 2qov n LYS 2 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 177.40 177.60 2qov n THR 3 N 1.38 0.00 -0.89 0.58 -2.24 -1.26 -4.90 114.28 106.94 2qov n THR 3 Ca 0.01 -0.39 -0.26 0.00 -2.27 0.00 0.00 64.05 61.14 2qov n THR 3 Cb 0.71 -0.16 0.03 0.00 -2.10 0.00 0.00 70.33 68.81 2qov n THR 3 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 2qov n PHE 4 N -2.87 -1.33 0.00 4.78 -0.00 -1.26 -5.04 117.46 111.74 2qov n PHE 4 Ca 0.00 0.63 0.00 0.00 -0.00 0.00 0.00 57.45 58.08 2qov n PHE 4 Cb 0.57 -1.39 0.00 0.00 -0.00 0.00 0.00 39.48 38.66 2qov n PHE 4 CO 0.00 0.00 0.00 -2.37 -0.00 0.00 0.00 176.76 174.39 2qov n THR 5 N -3.43 0.00 -1.52 -2.13 5.66 -1.26 -4.96 114.28 106.65 2qov n THR 5 Ca -0.01 0.00 -0.51 0.00 -3.05 0.00 0.00 64.05 60.48 2qov n THR 5 Cb 0.51 0.00 -0.05 0.00 -1.55 0.00 0.00 70.33 69.24 2qov n THR 5 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2qov n ALA 6 N 0.00 -1.92 -2.61 1.79 0.00 -1.20 -4.95 120.51 111.62 2qov n ALA 6 Ca 0.00 0.49 -0.38 0.00 0.00 0.00 0.00 53.44 53.55 2qov n ALA 6 Cb 0.00 -1.87 -0.06 0.00 0.00 0.00 0.00 19.45 17.52 2qov n ALA 6 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2qov s LYS 7 N -0.45 4.00 0.00 0.00 -0.14 -1.26 -4.92 119.74 116.97 2qov s LYS 7 Ca 0.75 0.31 0.00 0.00 -1.36 0.00 0.00 55.97 55.67 2qov s LYS 7 Cb -0.97 -3.29 0.00 0.00 -1.68 0.00 0.00 37.83 31.89 2qov s LYS 7 CO 0.54 0.53 0.35 -2.30 -0.76 0.00 0.00 175.35 173.72 2qov n PRO 8 N 2.44 0.00 -0.10 -1.68 -0.02 -1.26 -0.76 135.00 133.62 2qov n PRO 8 Ca -0.13 0.00 -0.13 0.00 -2.02 0.00 0.00 63.50 61.22 2qov n PRO 8 Cb 0.52 -1.45 -0.12 0.00 -0.02 0.00 0.00 33.50 32.43 2qov n PRO 8 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2qov n GLU 9 N -0.84 0.80 -1.10 -0.52 4.71 -1.26 -4.49 120.64 117.93 2qov n GLU 9 Ca 0.00 0.07 -0.25 0.00 -0.01 0.00 0.00 57.16 56.97 2qov n GLU 9 Cb 0.00 -1.46 0.05 0.00 -1.01 0.00 0.00 31.44 29.02 2qov n GLU 9 CO 0.00 0.00 0.00 0.25 0.09 0.00 0.00 177.13 177.47 2qov n THR 10 N -2.94 3.16 -3.69 2.62 -2.24 0.06 -4.93 114.28 106.32 2qov n THR 10 Ca -0.36 -2.25 -0.36 0.00 -2.27 0.00 0.00 64.05 58.81 2qov n THR 10 Cb 1.01 -1.27 -0.07 0.00 -2.10 0.00 0.00 70.33 67.90 2qov n THR 10 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2qov s VAL 11 N -3.39 5.37 -0.13 2.28 1.01 -1.24 -4.81 120.40 119.49 2qov s VAL 11 Ca 0.46 0.35 -0.08 0.00 0.00 0.00 0.00 61.98 62.72 2qov s VAL 11 Cb 0.36 -3.52 -0.25 0.00 0.00 0.00 0.00 36.38 32.97 2qov s VAL 11 CO -0.02 0.48 0.32 2.29 0.00 0.00 0.00 175.10 178.18 2qov n LYS 12 N 3.02 0.74 0.00 2.72 0.00 -1.26 -4.98 118.16 118.40 2qov n LYS 12 Ca -0.16 0.29 0.00 0.00 -0.00 0.00 0.00 58.31 58.44 2qov n LYS 12 Cb 0.53 -1.70 0.00 0.00 -0.00 0.00 0.00 35.03 33.85 2qov n LYS 12 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.40 177.94 2qov n ARG 13 N -3.57 0.00 -0.08 -1.58 5.12 -1.26 -4.88 116.66 110.42 2qov n ARG 13 Ca -0.33 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.59 2qov n ARG 13 Cb 1.01 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 32.31 2qov n ARG 13 CO 0.00 0.00 0.00 -0.25 -1.93 0.00 0.00 177.63 175.45 2qov n ASP 14 N 2.65 -1.18 -4.72 0.55 10.43 -1.26 -3.73 116.55 119.30 2qov n ASP 14 Ca 0.00 0.07 -0.30 0.00 2.57 0.00 0.00 54.79 57.13 2qov n ASP 14 Cb 0.00 0.71 -0.07 0.00 1.84 0.00 0.00 41.12 43.60 2qov n ASP 14 CO 0.00 0.00 0.00 0.26 -1.07 0.00 0.00 177.20 176.39 2qov s TRP 15 N -2.48 3.05 0.28 1.24 0.52 -1.26 0.17 118.94 120.46 2qov s TRP 15 Ca 0.00 -0.00 -0.05 0.00 0.02 0.00 0.00 56.10 56.07 2qov s TRP 15 Cb 0.00 -1.55 -0.01 0.00 -1.15 0.00 0.00 33.47 30.76 2qov s TRP 15 CO 0.00 0.50 0.37 0.71 0.02 0.00 0.00 176.95 178.55 2qov s TYR 16 N -1.39 0.92 -0.14 -1.98 1.51 0.54 -3.45 117.35 113.36 2qov s TYR 16 Ca 0.27 -1.17 -0.10 0.00 -1.01 0.00 0.00 57.07 55.06 2qov s TYR 16 Cb -0.12 -0.17 0.05 0.00 -0.11 0.00 0.00 41.96 41.61 2qov s TYR 16 CO 0.20 -0.94 0.36 0.08 -1.11 0.00 0.00 175.55 174.14 2qov s VAL 17 N -3.67 -0.02 -0.11 0.71 1.01 -1.03 -3.23 120.40 114.06 2qov s VAL 17 Ca 0.31 0.06 -0.30 0.00 0.00 0.00 0.00 61.98 62.04 2qov s VAL 17 Cb 0.02 -0.53 0.11 0.00 0.00 0.00 0.00 36.38 35.98 2qov s VAL 17 CO 0.15 0.02 0.88 0.54 0.00 0.00 0.00 175.10 176.70 2qov s VAL 18 N 0.78 0.00 -0.10 2.92 0.11 -0.79 -1.39 120.40 121.94 2qov s VAL 18 Ca -0.05 0.00 0.04 0.00 -2.93 0.00 0.00 61.98 59.04 2qov s VAL 18 Cb -0.06 -1.00 -0.00 0.00 -1.53 0.00 0.00 36.38 33.79 2qov s VAL 18 CO -0.06 0.00 -0.24 -0.62 -3.33 0.00 0.00 175.10 170.86 2qov s ASP 19 N -1.23 3.13 -1.55 3.54 3.68 -1.26 -2.45 116.67 120.53 2qov s ASP 19 Ca -0.04 -0.55 -0.10 0.00 2.13 0.00 0.00 52.55 53.99 2qov s ASP 19 Cb -0.00 -1.37 -0.03 0.00 -1.45 0.00 0.00 42.92 40.06 2qov s ASP 19 CO 0.04 0.17 2.77 0.00 0.13 0.00 0.00 175.17 178.27 2qov n ALA 20 N 3.47 7.19 -0.03 3.66 0.00 -1.26 -4.53 120.51 129.01 2qov n ALA 20 Ca -0.19 -3.68 -0.02 0.00 0.00 0.00 0.00 53.44 49.56 2qov n ALA 20 Cb 0.53 -3.28 -0.01 0.00 0.00 0.00 0.00 19.45 16.69 2qov n ALA 20 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 2qov h THR 21 N 3.06 0.00 -0.54 0.00 2.02 -1.90 -3.11 112.91 112.43 2qov h THR 21 Ca 0.81 -0.55 -0.26 0.00 0.77 0.00 0.00 66.41 67.18 2qov h THR 21 Cb 0.33 0.00 -0.15 0.00 -1.74 0.00 0.00 68.15 66.59 2qov h THR 21 CO 1.74 0.00 0.33 0.61 0.37 0.00 0.00 175.52 178.57 2qov n GLY 22 N 1.74 3.29 3.78 2.16 0.00 -1.26 -4.08 105.19 110.82 2qov n GLY 22 Ca -0.03 -0.61 -0.32 0.00 0.00 0.00 0.00 46.02 45.06 2qov n GLY 22 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qov s LYS 23 N -1.92 3.04 0.00 1.61 -0.14 -1.26 -4.95 119.74 116.12 2qov s LYS 23 Ca 0.33 -0.53 0.00 0.00 -1.36 0.00 0.00 55.97 54.40 2qov s LYS 23 Cb 0.27 -2.83 0.00 0.00 -1.68 0.00 0.00 37.83 33.59 2qov s LYS 23 CO 0.07 0.63 0.82 0.25 -0.76 0.00 0.00 175.35 176.36 2qov n THR 24 N 0.98 0.00 -1.37 2.17 -2.24 -1.26 -0.28 114.28 112.28 2qov n THR 24 Ca -0.12 0.00 0.03 0.00 -2.27 0.00 0.00 64.05 61.69 2qov n THR 24 Cb 0.52 -0.09 -0.02 0.00 -2.10 0.00 0.00 70.33 68.65 2qov n THR 24 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 2qov n LEU 25 N -0.50 -1.38 0.00 3.22 -0.00 -1.26 -3.96 117.00 113.13 2qov n LEU 25 Ca 0.00 2.45 0.00 0.00 -0.00 0.00 0.00 56.01 58.46 2qov n LEU 25 Cb 0.00 -2.67 0.00 0.00 -0.00 0.00 0.00 43.42 40.76 2qov n LEU 25 CO 0.00 -0.95 0.00 0.61 -0.00 0.00 0.00 177.39 177.05 2qov n GLY 26 N -2.79 0.54 0.23 -3.96 0.00 -1.26 -4.14 105.19 93.81 2qov n GLY 26 Ca -0.02 -0.01 0.08 0.00 0.00 0.00 0.00 46.02 46.08 2qov n GLY 26 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2qov h ARG 27 N 0.00 0.00 0.04 1.61 3.08 -1.99 0.49 114.38 117.61 2qov h ARG 27 Ca 0.00 0.00 -0.31 0.00 0.07 0.00 0.00 59.98 59.74 2qov h ARG 27 Cb 0.00 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.01 2qov h ARG 27 CO 0.00 0.00 -1.72 1.47 -1.07 0.00 0.00 179.97 178.65 2qov n LEU 28 N -2.33 2.19 -0.28 3.04 -0.00 -1.26 -4.22 117.00 114.14 2qov n LEU 28 Ca -0.01 0.31 0.08 0.00 -0.00 0.00 0.00 56.01 56.39 2qov n LEU 28 Cb 0.42 -1.00 0.21 0.00 -0.00 0.00 0.00 43.42 43.05 2qov n LEU 28 CO 0.07 0.54 0.85 0.00 -0.00 0.00 0.00 177.39 178.85 2qov h ALA 29 N -0.34 0.95 -0.56 1.47 0.00 -0.38 0.77 119.26 121.17 2qov h ALA 29 Ca -0.43 0.25 0.07 0.00 0.00 0.00 0.00 54.91 54.79 2qov h ALA 29 Cb 1.61 0.41 -0.09 0.00 0.00 0.00 0.00 17.79 19.71 2qov h ALA 29 CO -0.13 -0.44 -0.54 1.79 0.00 0.00 0.00 179.25 179.92 2qov h THR 30 N 0.13 0.02 -0.71 0.00 1.35 -1.51 1.88 112.91 114.06 2qov h THR 30 Ca 0.47 0.00 -0.05 0.00 -0.55 0.00 0.00 66.41 66.27 2qov h THR 30 Cb 0.88 0.02 -0.03 0.00 -1.73 0.00 0.00 68.15 67.28 2qov h THR 30 CO -0.69 0.00 0.23 -0.08 -0.25 0.00 0.00 175.52 174.73 2qov h GLU 31 N -0.29 1.10 0.00 4.72 4.57 -0.88 0.13 114.58 123.94 2qov h GLU 31 Ca 0.11 -0.23 0.00 0.00 -1.18 0.00 0.00 59.36 58.06 2qov h GLU 31 Cb 0.56 -0.16 0.00 0.00 -0.16 0.00 0.00 28.75 28.98 2qov h GLU 31 CO -0.69 0.94 0.00 1.28 -1.18 0.00 0.00 179.01 179.36 2qov n LEU 32 N -4.30 0.00 -0.28 1.64 4.77 0.24 -1.42 117.00 117.65 2qov n LEU 32 Ca 0.05 0.99 0.10 0.00 -0.03 0.00 0.00 56.01 57.12 2qov n LEU 32 Cb 0.22 -0.49 0.24 0.00 -2.33 0.00 0.00 43.42 41.06 2qov n LEU 32 CO 0.41 -0.49 0.94 0.00 -1.33 0.00 0.00 177.39 176.93 2qov h ALA 33 N -1.69 1.15 -0.63 -1.18 0.00 0.28 0.19 119.26 117.37 2qov h ALA 33 Ca 0.00 0.20 0.11 0.00 0.00 0.00 0.00 54.91 55.22 2qov h ALA 33 Cb 0.00 0.27 -0.12 0.00 0.00 0.00 0.00 17.79 17.94 2qov h ALA 33 CO 0.00 -0.40 -0.30 -0.09 0.00 0.00 0.00 179.25 178.47 2qov h ARG 34 N 0.25 -0.12 -0.38 0.00 2.43 -0.32 0.24 114.38 116.48 2qov h ARG 34 Ca 0.49 0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.66 2qov h ARG 34 Cb 0.93 0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 30.49 2qov h ARG 34 CO -0.59 -0.08 0.20 0.00 -1.51 0.00 0.00 179.97 178.00 2qov h ARG 35 N -0.12 0.54 0.00 0.20 -0.00 0.51 -1.27 114.38 114.24 2qov h ARG 35 Ca 0.26 -0.07 0.00 0.00 -0.50 0.00 0.00 59.98 59.67 2qov h ARG 35 Cb 0.54 -0.10 0.00 0.00 0.00 0.00 0.00 29.97 30.41 2qov h ARG 35 CO -0.70 0.46 0.07 1.28 0.00 0.00 0.00 179.97 181.08 2qov n LEU 36 N -4.73 0.00 0.00 3.04 7.99 0.68 0.22 117.00 124.19 2qov n LEU 36 Ca -0.00 0.42 0.00 0.00 -0.01 0.00 0.00 56.01 56.42 2qov n LEU 36 Cb 0.09 -0.42 0.00 0.00 -0.11 0.00 0.00 43.42 42.98 2qov n LEU 36 CO 0.36 -0.42 0.46 -1.14 -1.51 0.00 0.00 177.39 175.13 2qov n ARG 37 N -1.42 2.50 -0.91 3.23 0.63 -0.22 -3.96 116.66 116.51 2qov n ARG 37 Ca 0.00 -1.34 -0.04 0.00 -0.92 0.00 0.00 57.85 55.56 2qov n ARG 37 Cb 0.07 -0.92 -0.02 0.00 0.45 0.00 0.00 32.46 32.04 2qov n ARG 37 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2qov n GLY 38 N -0.42 0.36 0.36 5.14 0.00 0.13 -4.17 105.19 106.59 2qov n GLY 38 Ca 0.00 0.00 0.29 0.00 0.00 0.00 0.00 46.02 46.31 2qov n GLY 38 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2qov h LYS 39 N 0.00 0.16 -0.22 1.61 1.63 -1.61 0.15 116.57 118.28 2qov h LYS 39 Ca -0.08 -0.01 -0.14 0.00 -0.85 0.00 0.00 60.65 59.58 2qov h LYS 39 Cb 0.80 -0.04 0.00 0.00 -0.60 0.00 0.00 32.23 32.40 2qov h LYS 39 CO 0.11 0.10 -0.39 1.12 -3.45 0.00 0.00 179.45 176.95 2qov h HIS 40 N 0.16 0.82 0.00 1.91 2.07 -1.87 -3.42 115.15 114.82 2qov h HIS 40 Ca 0.79 -0.29 0.00 0.00 -2.85 0.00 0.00 60.37 58.02 2qov h HIS 40 Cb 2.07 -0.16 0.00 0.00 2.57 0.00 0.00 27.41 31.89 2qov h HIS 40 CO -0.01 1.05 0.00 1.63 -3.07 0.00 0.00 177.93 177.53 2qov n LYS 41 N -4.23 2.51 -2.22 5.12 5.02 0.51 -4.80 118.16 120.07 2qov n LYS 41 Ca -0.05 0.00 -0.37 0.00 -2.02 0.00 0.00 58.31 55.87 2qov n LYS 41 Cb 0.53 0.00 0.02 0.00 -0.02 0.00 0.00 35.03 35.56 2qov n LYS 41 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2qov n ALA 42 N -3.00 6.05 0.05 7.82 0.00 -1.26 -4.84 120.51 125.32 2qov n ALA 42 Ca 0.00 -4.28 0.00 0.00 0.00 0.00 0.00 53.44 49.16 2qov n ALA 42 Cb 0.00 -1.66 0.02 0.00 0.00 0.00 0.00 19.45 17.81 2qov n ALA 42 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2qov n GLU 43 N -0.43 0.01 -1.28 0.00 0.00 -1.22 -4.58 120.64 113.14 2qov n GLU 43 Ca 0.48 0.18 -0.11 0.00 0.00 0.00 0.00 57.16 57.72 2qov n GLU 43 Cb 0.33 -2.04 -0.11 0.00 0.00 0.00 0.00 31.44 29.62 2qov n GLU 43 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.13 178.11 2qov n TYR 44 N -1.28 0.12 0.00 4.31 -0.00 -1.26 -3.40 117.16 115.65 2qov n TYR 44 Ca -0.00 -0.01 0.00 0.00 -0.00 0.00 0.00 57.90 57.89 2qov n TYR 44 Cb 0.52 -0.74 0.00 0.00 -0.00 0.00 0.00 39.34 39.12 2qov n TYR 44 CO 0.00 0.00 0.00 -2.37 -0.00 0.00 0.00 176.86 174.49 2qov n THR 45 N 5.43 0.00 -0.30 2.97 5.66 -1.26 -3.24 114.28 123.53 2qov n THR 45 Ca 0.34 0.00 0.12 0.00 -3.05 0.00 0.00 64.05 61.45 2qov n THR 45 Cb 0.34 0.00 0.26 0.00 -1.55 0.00 0.00 70.33 69.38 2qov n THR 45 CO 0.00 0.00 0.00 -0.65 -3.05 0.00 0.00 175.07 171.37 2qov h PRO 46 N 0.00 0.12 -0.28 1.09 0.11 -1.97 0.24 132.00 131.31 2qov h PRO 46 Ca 0.00 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.10 2qov h PRO 46 Cb 0.00 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.08 2qov h PRO 46 CO 0.00 0.08 0.00 -2.39 -0.21 0.00 0.00 178.00 175.48 2qov n HIS 47 N -5.33 0.00 -3.91 0.65 1.44 -1.26 -4.63 115.22 102.19 2qov n HIS 47 Ca 0.20 0.00 -0.10 0.00 -2.01 0.00 0.00 57.72 55.81 2qov n HIS 47 Cb 0.66 -0.03 -0.10 0.00 0.12 0.00 0.00 29.99 30.64 2qov n HIS 47 CO 0.00 0.00 0.00 0.08 -2.81 0.00 0.00 176.34 173.61 2qov s VAL 48 N -1.29 0.10 -1.08 0.61 1.01 0.84 -5.05 120.40 115.54 2qov s VAL 48 Ca 0.00 -0.87 -0.21 0.00 0.00 0.00 0.00 61.98 60.90 2qov s VAL 48 Cb 0.00 -0.57 0.07 0.00 0.00 0.00 0.00 36.38 35.88 2qov s VAL 48 CO 0.00 -0.48 1.47 -0.62 0.00 0.00 0.00 175.10 175.47 2qov s ASP 49 N -1.66 6.61 0.00 3.32 2.15 -1.26 -4.74 116.67 121.09 2qov s ASP 49 Ca -0.12 -1.80 0.24 0.00 0.43 0.00 0.00 52.55 51.30 2qov s ASP 49 Cb -0.06 -2.54 0.93 0.00 -0.30 0.00 0.00 42.92 40.95 2qov s ASP 49 CO -0.01 -1.35 1.66 0.41 -0.17 0.00 0.00 175.17 175.71 2qov n THR 50 N 6.52 0.11 -0.31 1.71 -1.04 -1.26 -4.90 114.28 115.11 2qov n THR 50 Ca 0.35 -0.28 -0.30 0.00 -2.04 0.00 0.00 64.05 61.79 2qov n THR 50 Cb 0.49 0.34 0.29 0.00 -1.82 0.00 0.00 70.33 69.64 2qov n THR 50 CO 0.00 0.00 0.00 -0.83 -0.64 0.00 0.00 175.07 173.60 2qov s GLY 51 N -1.75 1.42 0.00 3.41 0.00 -1.25 -3.67 107.32 105.48 2qov s GLY 51 Ca 0.35 -0.65 0.00 0.00 0.00 0.00 0.00 44.72 44.42 2qov s GLY 51 CO 0.29 0.32 0.00 1.22 0.00 0.00 0.00 173.10 174.93 2qov n ASP 52 N -5.62 0.13 -3.38 1.64 10.43 0.15 -4.09 116.55 115.80 2qov n ASP 52 Ca 0.10 0.00 -0.26 0.00 2.57 0.00 0.00 54.79 57.20 2qov n ASP 52 Cb 0.59 0.00 -0.10 0.00 1.84 0.00 0.00 41.12 43.45 2qov n ASP 52 CO 0.00 0.00 0.00 -1.22 -1.07 0.00 0.00 177.20 174.91 2qov n TYR 53 N 0.00 -0.49 -3.96 1.24 4.01 0.46 -4.82 117.16 113.60 2qov n TYR 53 Ca 0.00 -3.43 -0.32 0.00 -0.16 0.00 0.00 57.90 53.99 2qov n TYR 53 Cb 0.00 0.08 -0.05 0.00 -0.31 0.00 0.00 39.34 39.06 2qov n TYR 53 CO 0.00 0.00 0.00 -1.50 -0.46 0.00 0.00 176.86 174.90 2qov s ILE 54 N -0.32 5.18 -0.01 -0.72 1.10 -1.26 -0.34 121.20 124.83 2qov s ILE 54 Ca 0.33 -0.35 0.01 0.00 -0.51 0.00 0.00 60.65 60.13 2qov s ILE 54 Cb 0.06 -3.45 0.00 0.00 0.15 0.00 0.00 42.46 39.22 2qov s ILE 54 CO -0.18 0.25 -0.04 0.27 -2.11 0.00 0.00 174.94 173.13 2qov s ILE 55 N -1.36 0.37 0.75 2.00 -4.36 -1.20 -3.18 121.20 114.22 2qov s ILE 55 Ca 0.29 -0.15 -0.02 0.00 -0.26 0.00 0.00 60.65 60.51 2qov s ILE 55 Cb -0.13 -0.35 0.14 0.00 1.25 0.00 0.00 42.46 43.37 2qov s ILE 55 CO 0.21 0.13 1.03 -0.69 0.24 0.00 0.00 174.94 175.87 2qov s VAL 56 N 0.21 2.10 0.00 8.37 1.01 -1.22 -1.88 120.40 129.00 2qov s VAL 56 Ca -0.02 -0.53 0.00 0.00 0.00 0.00 0.00 61.98 61.43 2qov s VAL 56 Cb -0.06 -2.57 0.00 0.00 0.00 0.00 0.00 36.38 33.75 2qov s VAL 56 CO -0.00 0.00 0.00 0.18 0.00 0.00 0.00 175.10 175.28 2qov n LEU 57 N -2.95 0.00 -0.06 3.92 4.32 -1.03 -4.26 117.00 116.95 2qov n LEU 57 Ca 0.15 0.00 -0.03 0.00 -0.02 0.00 0.00 56.01 56.11 2qov n LEU 57 Cb 0.60 0.00 -0.02 0.00 -1.62 0.00 0.00 43.42 42.38 2qov n LEU 57 CO 0.43 0.00 0.50 0.78 -1.22 0.00 0.00 177.39 177.87 2qov h ASN 58 N 0.00 -0.44 0.00 -1.43 4.21 -1.76 -3.30 115.58 112.85 2qov h ASN 58 Ca 0.00 0.06 0.00 0.00 1.21 0.00 0.00 56.30 57.57 2qov h ASN 58 Cb 0.00 0.19 0.00 0.00 -1.12 0.00 0.00 38.32 37.39 2qov h ASN 58 CO 0.00 -0.07 0.00 0.00 -1.29 0.00 0.00 177.43 176.07 2qov n ALA 59 N -2.90 0.00 0.21 -0.83 0.00 -1.26 -4.34 120.51 111.38 2qov n ALA 59 Ca -0.00 0.00 0.10 0.00 0.00 0.00 0.00 53.44 53.53 2qov n ALA 59 Cb 0.07 0.00 0.52 0.00 0.00 0.00 0.00 19.45 20.04 2qov n ALA 59 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.50 177.88 2qov h ASP 60 N 0.00 0.00 -0.76 0.00 2.03 -1.84 0.62 116.42 116.46 2qov h ASP 60 Ca 0.00 0.00 -0.46 0.00 -0.73 0.00 0.00 57.03 55.84 2qov h ASP 60 Cb 0.00 0.00 -0.26 0.00 -0.83 0.00 0.00 39.33 38.24 2qov h ASP 60 CO 0.00 0.00 0.28 0.29 -1.03 0.00 0.00 179.24 178.78 2qov n LYS 61 N -2.31 2.40 -3.51 4.15 5.02 -1.26 -5.00 118.16 117.65 2qov n LYS 61 Ca -0.01 -3.29 -0.32 0.00 -2.02 0.00 0.00 58.31 52.66 2qov n LYS 61 Cb 0.30 -2.10 -0.05 0.00 -0.02 0.00 0.00 35.03 33.15 2qov n LYS 61 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2qov s VAL 62 N -3.85 5.02 0.00 -0.18 0.11 0.21 -4.28 120.40 117.44 2qov s VAL 62 Ca 0.54 0.35 0.00 0.00 -2.93 0.00 0.00 61.98 59.94 2qov s VAL 62 Cb 0.46 -3.63 0.00 0.00 -1.53 0.00 0.00 36.38 31.68 2qov s VAL 62 CO 0.03 0.03 0.00 0.00 -3.33 0.00 0.00 175.10 171.83 2qov n ALA 63 N 0.12 0.00 -0.07 1.54 0.00 0.61 -4.94 120.51 117.77 2qov n ALA 63 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.42 2qov n ALA 63 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.97 2qov n ALA 63 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05 2qov n VAL 64 N -2.39 0.00 -1.35 0.00 3.14 -1.25 -4.28 118.33 112.19 2qov n VAL 64 Ca 0.00 0.00 0.18 0.00 -2.96 0.00 0.00 64.34 61.56 2qov n VAL 64 Cb 0.00 0.00 -0.05 0.00 -1.06 0.00 0.00 33.84 32.73 2qov n VAL 64 CO 0.00 0.00 0.00 1.07 -6.46 0.00 0.00 176.83 171.44 2qov n THR 65 N 0.00 0.00 -1.55 1.55 5.66 -1.26 -4.75 114.28 113.93 2qov n THR 65 Ca 0.00 0.13 0.00 0.00 -3.05 0.00 0.00 64.05 61.13 2qov n THR 65 Cb 0.00 -0.58 0.00 0.00 -1.55 0.00 0.00 70.33 68.20 2qov n THR 65 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2qov n GLY 66 N -4.01 2.86 0.00 1.09 0.00 -1.26 -3.45 105.19 100.42 2qov n GLY 66 Ca -0.00 -0.19 0.00 0.00 0.00 0.00 0.00 46.02 45.83 2qov n GLY 66 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2qov n ASN 67 N 1.93 1.10 -0.16 1.61 2.85 -1.26 -4.76 115.26 116.57 2qov n ASN 67 Ca 0.00 -1.46 0.29 0.00 -0.11 0.00 0.00 54.58 53.30 2qov n ASN 67 Cb 0.00 0.00 0.67 0.00 1.24 0.00 0.00 39.78 41.69 2qov n ASN 67 CO 0.00 0.00 0.00 0.11 -2.11 0.00 0.00 177.26 175.26 2qov h LYS 68 N 0.00 0.00 -1.18 1.20 1.57 -1.81 0.19 116.57 116.53 2qov h LYS 68 Ca 0.00 0.00 0.34 0.00 -1.87 0.00 0.00 60.65 59.12 2qov h LYS 68 Cb 0.54 0.00 -0.10 0.00 0.08 0.00 0.00 32.23 32.75 2qov h LYS 68 CO 0.00 0.00 0.78 -0.09 -0.57 0.00 0.00 179.45 179.57 2qov h ARG 69 N 0.00 0.21 0.00 3.15 9.65 -1.86 -1.93 114.38 123.60 2qov h ARG 69 Ca 0.43 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 59.29 2qov h ARG 69 Cb 2.08 -0.05 0.00 0.00 -1.39 0.00 0.00 29.97 30.61 2qov h ARG 69 CO -0.00 0.14 -0.01 0.25 2.80 0.00 0.00 179.97 183.15 2qov n THR 70 N -4.56 0.43 -2.66 0.20 -2.24 -0.01 -0.80 114.28 104.64 2qov n THR 70 Ca 0.30 -0.43 -0.10 0.00 -2.27 0.00 0.00 64.05 61.55 2qov n THR 70 Cb 1.15 0.77 0.03 0.00 -2.10 0.00 0.00 70.33 70.18 2qov n THR 70 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2qov n ASP 71 N -0.22 1.88 0.00 3.42 9.92 -0.74 -4.85 116.55 125.96 2qov n ASP 71 Ca 0.00 -2.71 0.00 0.00 -0.53 0.00 0.00 54.79 51.55 2qov n ASP 71 Cb 0.40 -0.51 0.00 0.00 -0.64 0.00 0.00 41.12 40.37 2qov n ASP 71 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 2qov n LYS 72 N -0.22 3.19 0.00 -1.24 4.76 -1.12 -4.62 118.16 118.92 2qov n LYS 72 Ca 0.13 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.57 2qov n LYS 72 Cb 0.80 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.99 2qov n LYS 72 CO 0.00 0.00 0.00 1.33 -1.37 0.00 0.00 177.40 177.36 2qov n VAL 73 N 0.00 0.00 -2.43 -0.18 0.24 -1.26 -4.82 118.33 109.88 2qov n VAL 73 Ca 0.00 0.00 -0.01 0.00 -2.04 0.00 0.00 64.34 62.29 2qov n VAL 73 Cb 0.00 0.00 -0.01 0.00 -1.47 0.00 0.00 33.84 32.36 2qov n VAL 73 CO 0.00 0.00 0.00 -1.22 -2.14 0.00 0.00 176.83 173.47 2qov n TYR 74 N -0.04 -3.19 -4.42 6.34 4.02 -1.26 -1.62 117.16 117.00 2qov n TYR 74 Ca 0.00 1.50 -0.34 0.00 -0.01 0.00 0.00 57.90 59.05 2qov n TYR 74 Cb 0.00 -3.45 -0.13 0.00 -0.02 0.00 0.00 39.34 35.74 2qov n TYR 74 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 176.86 176.56 2qov s TYR 75 N -1.13 2.94 -0.30 -0.72 2.02 -1.26 -1.59 117.35 117.31 2qov s TYR 75 Ca -0.04 -0.53 -0.02 0.00 -0.37 0.00 0.00 57.07 56.10 2qov s TYR 75 Cb 0.00 -1.95 0.10 0.00 -0.40 0.00 0.00 41.96 39.71 2qov s TYR 75 CO 0.61 -0.19 0.12 -3.38 -1.57 0.00 0.00 175.55 171.14 2qov s HIS 76 N 0.59 0.93 0.01 2.71 -3.43 -0.07 -4.98 115.29 111.06 2qov s HIS 76 Ca -0.04 -1.27 -0.30 0.00 -0.80 0.00 0.00 55.06 52.64 2qov s HIS 76 Cb -0.15 -1.25 -0.05 0.00 -1.43 0.00 0.00 32.58 29.70 2qov s HIS 76 CO 0.03 -0.85 1.25 -1.58 -2.00 0.00 0.00 174.74 171.59 2qov s HIS 77 N 1.86 3.23 0.42 0.38 2.46 -1.26 -3.08 115.29 119.30 2qov s HIS 77 Ca 0.10 1.16 0.11 0.00 0.47 0.00 0.00 55.06 56.89 2qov s HIS 77 Cb -0.17 -3.48 0.92 0.00 -0.13 0.00 0.00 32.58 29.71 2qov s HIS 77 CO -0.31 -1.59 1.99 1.79 -2.47 0.00 0.00 174.74 174.15 2qov h THR 78 N 4.74 1.13 0.00 0.89 1.35 -1.91 -3.45 112.91 115.66 2qov h THR 78 Ca -0.38 -0.54 0.00 0.00 -0.55 0.00 0.00 66.41 64.93 2qov h THR 78 Cb 1.19 1.11 0.00 0.00 -1.73 0.00 0.00 68.15 68.72 2qov h THR 78 CO 0.86 0.17 0.00 0.61 -0.25 0.00 0.00 175.52 176.91 2qov n GLY 79 N -1.09 1.14 0.52 5.82 0.00 -1.26 -5.06 105.19 105.25 2qov n GLY 79 Ca -0.01 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.97 2qov n GLY 79 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2qov n HIS 80 N -1.69 0.10 0.00 1.61 8.25 -1.26 -5.09 115.22 117.15 2qov n HIS 80 Ca 0.00 -0.38 0.00 0.00 -0.26 0.00 0.00 57.72 57.08 2qov n HIS 80 Cb 0.00 -0.03 0.00 0.00 1.12 0.00 0.00 29.99 31.08 2qov n HIS 80 CO 0.00 0.00 0.00 1.51 0.64 0.00 0.00 176.34 178.49 2qov n ILE 81 N -0.16 0.00 -0.00 1.59 3.06 -1.26 -4.07 119.36 118.51 2qov n ILE 81 Ca -0.02 0.56 -0.00 0.00 -2.50 0.00 0.00 62.75 60.79 2qov n ILE 81 Cb 0.09 -0.89 -0.00 0.00 0.54 0.00 0.00 39.64 39.38 2qov n ILE 81 CO 0.00 0.00 0.00 1.23 -2.50 0.00 0.00 176.55 175.28 2qov h GLY 82 N 0.00 -0.00 0.00 4.50 0.00 -2.04 -3.47 103.07 102.06 2qov h GLY 82 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2qov h GLY 82 CO 0.00 -0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.15 2qov n GLY 83 N 1.91 3.17 2.41 4.60 0.00 -1.26 -4.86 105.19 111.16 2qov n GLY 83 Ca -0.00 0.19 -0.17 0.00 0.00 0.00 0.00 46.02 46.04 2qov n GLY 83 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 2qov n ILE 84 N 0.00 -1.71 -4.15 -0.61 0.13 -1.26 -4.80 119.36 106.96 2qov n ILE 84 Ca 0.00 0.02 -0.32 0.00 -1.10 0.00 0.00 62.75 61.35 2qov n ILE 84 Cb 0.00 -1.56 -0.08 0.00 -0.84 0.00 0.00 39.64 37.17 2qov n ILE 84 CO 0.00 0.00 0.00 -0.54 2.80 0.00 0.00 176.55 178.81 2qov s LYS 85 N -1.70 2.94 0.28 9.51 1.02 -1.18 -4.93 119.74 125.68 2qov s LYS 85 Ca 0.14 -0.56 0.11 0.00 0.02 0.00 0.00 55.97 55.68 2qov s LYS 85 Cb -0.01 -2.77 -0.05 0.00 -0.52 0.00 0.00 37.83 34.47 2qov s LYS 85 CO 0.41 0.63 -0.17 1.14 -0.92 0.00 0.00 175.35 176.44 2qov s GLN 86 N -1.78 1.65 -0.23 1.68 -2.07 -1.26 -0.89 119.66 116.77 2qov s GLN 86 Ca 0.23 -1.77 -0.03 0.00 -1.82 0.00 0.00 55.36 51.96 2qov s GLN 86 Cb -0.12 -1.66 0.12 0.00 -1.09 0.00 0.00 33.01 30.26 2qov s GLN 86 CO 0.14 0.28 0.38 0.00 -1.32 0.00 0.00 175.29 174.76 2qov s ALA 87 N -2.60 -1.07 0.89 2.60 0.00 -0.62 -5.01 121.76 115.96 2qov s ALA 87 Ca 0.29 0.98 -0.10 0.00 0.00 0.00 0.00 51.96 53.13 2qov s ALA 87 Cb -0.03 -1.59 0.13 0.00 0.00 0.00 0.00 23.12 21.62 2qov s ALA 87 CO 0.14 -1.17 1.12 -0.08 0.00 0.00 0.00 175.76 175.77 2qov s THR 88 N 2.55 2.46 0.06 0.00 -1.32 -1.24 -4.07 115.64 114.08 2qov s THR 88 Ca 0.10 0.15 -0.20 0.00 -1.21 0.00 0.00 61.69 60.53 2qov s THR 88 Cb -0.15 -2.34 -0.08 0.00 -1.51 0.00 0.00 72.50 68.42 2qov s THR 88 CO -0.15 -0.19 1.32 0.15 -2.21 0.00 0.00 174.62 173.54 2qov h PHE 89 N -1.70 -0.91 -1.05 9.09 -0.00 -1.78 0.83 116.94 121.43 2qov h PHE 89 Ca -0.45 0.03 0.30 0.00 -0.00 0.00 0.00 57.97 57.85 2qov h PHE 89 Cb 1.26 0.39 -0.04 0.00 -0.00 0.00 0.00 35.95 37.56 2qov h PHE 89 CO 0.50 -0.34 0.93 1.49 -0.00 0.00 0.00 178.31 180.89 2qov h GLU 90 N -0.41 0.00 0.07 1.11 4.81 -1.21 0.14 114.58 119.08 2qov h GLU 90 Ca 0.00 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2qov h GLU 90 Cb 0.43 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.81 2qov h GLU 90 CO -0.19 0.00 -0.03 0.93 -0.73 0.00 0.00 179.01 178.98 2qov h GLU 91 N 0.00 -0.09 -0.20 1.92 5.08 -1.18 -3.17 114.58 116.94 2qov h GLU 91 Ca 0.50 0.01 0.05 0.00 -1.00 0.00 0.00 59.36 58.92 2qov h GLU 91 Cb 2.35 0.02 -0.06 0.00 0.50 0.00 0.00 28.75 31.56 2qov h GLU 91 CO -0.01 0.46 -0.22 0.52 -1.00 0.00 0.00 179.01 178.77 2qov h MET 92 N -0.74 -0.23 -0.97 2.33 2.86 0.34 -0.88 114.93 117.63 2qov h MET 92 Ca -0.01 0.02 0.24 0.00 -2.06 0.00 0.00 59.70 57.88 2qov h MET 92 Cb 0.59 0.05 -0.07 0.00 0.06 0.00 0.00 31.60 32.23 2qov h MET 92 CO 0.02 -0.16 0.64 0.82 1.06 0.00 0.00 176.91 179.29 2qov h ILE 93 N -0.24 0.60 -0.66 -1.22 5.03 -1.57 0.17 117.51 119.61 2qov h ILE 93 Ca 0.12 -0.13 -0.03 0.00 -0.12 0.00 0.00 64.86 64.71 2qov h ILE 93 Cb 0.43 0.20 -0.03 0.00 -3.03 0.00 0.00 36.82 34.39 2qov h ILE 93 CO -0.34 0.07 0.31 0.00 -0.68 0.00 0.00 178.15 177.51 2qov h ALA 94 N 1.60 1.30 -3.19 1.87 0.00 -1.13 -3.40 119.26 116.32 2qov h ALA 94 Ca 0.52 -0.14 -0.35 0.00 0.00 0.00 0.00 54.91 54.94 2qov h ALA 94 Cb 1.37 -0.27 -0.38 0.00 0.00 0.00 0.00 17.79 18.51 2qov h ALA 94 CO -0.21 0.54 -0.70 -0.98 0.00 0.00 0.00 179.25 177.90 2qov s ARG 95 N -5.53 -0.02 -0.92 0.00 1.04 0.58 -4.94 118.95 109.17 2qov s ARG 95 Ca -0.11 0.39 -0.05 0.00 -1.04 0.00 0.00 55.73 54.92 2qov s ARG 95 Cb 0.16 -0.59 -0.03 0.00 -2.04 0.00 0.00 34.95 32.46 2qov s ARG 95 CO 0.80 -0.37 0.79 0.54 -0.04 0.00 0.00 175.30 177.02 2qov n ARG 96 N 5.31 -1.69 0.15 3.89 1.74 -1.24 -4.66 116.66 120.15 2qov n ARG 96 Ca -0.04 1.07 0.00 0.00 -0.77 0.00 0.00 57.85 58.11 2qov n ARG 96 Cb 0.50 -5.37 0.28 0.00 -1.02 0.00 0.00 32.46 26.84 2qov n ARG 96 CO 0.00 0.00 0.00 -1.35 -1.52 0.00 0.00 177.63 174.76 2qov h PRO 97 N -0.51 0.08 -0.85 5.56 0.11 -1.76 -3.25 132.00 131.38 2qov h PRO 97 Ca -0.37 -0.04 0.25 0.00 0.11 0.00 0.00 66.00 65.96 2qov h PRO 97 Cb 1.19 -0.00 -0.16 0.00 0.11 0.00 0.00 31.00 32.15 2qov h PRO 97 CO 0.38 0.50 0.09 0.39 -0.21 0.00 0.00 178.00 179.15 2qov n GLU 98 N -4.02 -0.07 -0.33 1.05 4.71 -1.26 0.10 120.64 120.83 2qov n GLU 98 Ca -0.02 1.27 0.19 0.00 -0.01 0.00 0.00 57.16 58.59 2qov n GLU 98 Cb 0.47 -2.05 0.44 0.00 -1.01 0.00 0.00 31.44 29.29 2qov n GLU 98 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2qov h ARG 99 N 0.00 0.50 -0.61 3.49 3.08 -1.96 0.25 114.38 119.13 2qov h ARG 99 Ca 0.55 -0.03 0.18 0.00 0.07 0.00 0.00 59.98 60.75 2qov h ARG 99 Cb 1.20 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 31.12 2qov h ARG 99 CO -0.78 0.33 0.68 0.28 -1.07 0.00 0.00 179.97 179.41 2qov h VAL 100 N 0.52 0.26 0.00 2.04 2.07 0.44 0.70 116.25 122.28 2qov h VAL 100 Ca 0.61 0.00 -0.27 0.00 0.82 0.00 0.00 66.70 67.86 2qov h VAL 100 Cb 1.31 0.46 -0.04 0.00 -1.52 0.00 0.00 31.29 31.50 2qov h VAL 100 CO -0.38 0.00 -1.54 -0.38 0.02 0.00 0.00 177.57 175.30 2qov n ILE 101 N -3.58 1.52 0.23 4.57 2.08 0.85 -3.72 119.36 121.31 2qov n ILE 101 Ca 0.12 -0.10 -0.16 0.00 0.56 0.00 0.00 62.75 63.18 2qov n ILE 101 Cb 0.90 -2.04 -0.08 0.00 -0.75 0.00 0.00 39.64 37.67 2qov n ILE 101 CO 0.00 0.00 0.00 -0.33 0.56 0.00 0.00 176.55 176.78 2qov h GLU 102 N -1.00 -0.69 0.00 0.38 5.08 -0.85 0.49 114.58 117.99 2qov h GLU 102 Ca -0.41 0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.00 2qov h GLU 102 Cb 1.31 0.16 0.00 0.00 0.50 0.00 0.00 28.75 30.72 2qov h GLU 102 CO -0.25 -0.46 0.00 0.44 -1.00 0.00 0.00 179.01 177.74 2qov n ILE 103 N -5.45 1.00 -0.07 3.13 -6.64 0.23 0.21 119.36 111.77 2qov n ILE 103 Ca -0.10 0.25 -0.12 0.00 -1.77 0.00 0.00 62.75 61.01 2qov n ILE 103 Cb 0.35 -1.12 -0.15 0.00 -1.44 0.00 0.00 39.64 37.28 2qov n ILE 103 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 2qov n ALA 104 N -1.34 1.44 -0.04 -1.28 0.00 0.01 -3.55 120.51 115.75 2qov n ALA 104 Ca 0.03 -1.07 -0.18 0.00 0.00 0.00 0.00 53.44 52.22 2qov n ALA 104 Cb 0.07 -0.42 -0.14 0.00 0.00 0.00 0.00 19.45 18.97 2qov n ALA 104 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 2qov n VAL 105 N -2.97 1.65 -0.38 0.00 0.24 0.15 -3.52 118.33 113.51 2qov n VAL 105 Ca -0.30 -0.67 -0.02 0.00 -2.04 0.00 0.00 64.34 61.32 2qov n VAL 105 Cb 1.09 -1.47 0.12 0.00 -1.47 0.00 0.00 33.84 32.11 2qov n VAL 105 CO 0.00 0.00 0.00 0.50 -2.14 0.00 0.00 176.83 175.19 2qov h LYS 106 N 0.04 1.30 0.00 7.34 1.63 0.23 0.56 116.57 127.67 2qov h LYS 106 Ca -0.46 -0.08 0.00 0.00 -0.85 0.00 0.00 60.65 59.26 2qov h LYS 106 Cb 2.01 -0.29 0.00 0.00 -0.60 0.00 0.00 32.23 33.35 2qov h LYS 106 CO 0.03 0.86 0.00 0.41 -3.45 0.00 0.00 179.45 177.31 2qov n GLY 107 N -1.38 -0.97 0.04 5.01 0.00 -1.23 -2.92 105.19 103.74 2qov n GLY 107 Ca 0.12 -0.18 -0.01 0.00 0.00 0.00 0.00 46.02 45.95 2qov n GLY 107 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2qov n MET 108 N -0.97 1.34 -2.70 1.61 2.81 0.10 -5.00 117.12 114.32 2qov n MET 108 Ca 0.22 -0.05 -0.34 0.00 -1.81 0.00 0.00 57.70 55.71 2qov n MET 108 Cb 0.10 -1.31 -0.06 0.00 -0.71 0.00 0.00 33.22 31.24 2qov n MET 108 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 2qov s LEU 109 N -4.48 4.01 0.55 4.03 1.43 0.16 -5.06 118.68 119.32 2qov s LEU 109 Ca -0.05 1.83 -0.03 0.00 -1.03 0.00 0.00 54.13 54.84 2qov s LEU 109 Cb 0.06 -4.41 0.02 0.00 0.03 0.00 0.00 46.19 41.88 2qov s LEU 109 CO 0.51 -0.44 0.82 -2.16 0.23 0.00 0.00 176.35 175.31 2qov s PRO 110 N -2.92 2.79 1.51 1.29 0.04 -1.26 -4.95 135.00 131.51 2qov s PRO 110 Ca 0.61 -0.35 0.00 0.00 0.04 0.00 0.00 61.00 61.30 2qov s PRO 110 Cb -0.14 -2.39 0.00 0.00 0.04 0.00 0.00 34.50 32.01 2qov s PRO 110 CO 0.19 -0.64 0.00 1.63 0.04 0.00 0.00 177.00 178.21 2qov n LYS 111 N -2.42 0.00 0.00 4.56 5.02 -1.26 -3.16 118.16 120.90 2qov n LYS 111 Ca 0.05 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.34 2qov n LYS 111 Cb 0.58 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.59 2qov n LYS 111 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2qov n GLY 112 N 0.00 0.14 0.37 0.72 0.00 -1.26 -4.38 105.19 100.78 2qov n GLY 112 Ca 0.00 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.12 2qov n GLY 112 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2qov h PRO 113 N 0.00 0.79 0.13 1.61 0.13 -1.98 1.20 132.00 133.88 2qov h PRO 113 Ca 0.00 -0.05 -0.25 0.00 -0.87 0.00 0.00 66.00 64.83 2qov h PRO 113 Cb 0.00 -0.18 0.01 0.00 0.13 0.00 0.00 31.00 30.96 2qov h PRO 113 CO 0.00 0.52 -1.22 1.25 -0.23 0.00 0.00 178.00 178.32 2qov h LEU 114 N 0.82 0.43 0.36 1.56 5.85 -1.89 -3.22 115.31 119.22 2qov h LEU 114 Ca 0.45 -0.89 -0.02 0.00 0.84 0.00 0.00 57.88 58.27 2qov h LEU 114 Cb 0.58 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 41.47 2qov h LEU 114 CO -0.21 1.55 -0.17 1.23 -0.34 0.00 0.00 178.44 180.49 2qov h GLY 115 N -0.07 -0.51 -0.19 3.75 0.00 -1.41 0.30 103.07 104.93 2qov h GLY 115 Ca -0.25 0.19 0.28 0.00 0.00 0.00 0.00 47.33 47.55 2qov h GLY 115 CO 0.10 -0.18 0.69 -0.09 0.00 0.00 0.00 176.54 177.05 2qov h ARG 116 N -0.63 0.35 0.08 4.80 9.65 0.13 0.59 114.38 129.34 2qov h ARG 116 Ca -0.05 -0.02 -0.25 0.00 -1.10 0.00 0.00 59.98 58.56 2qov h ARG 116 Cb 0.46 -0.08 -0.00 0.00 -1.39 0.00 0.00 29.97 28.96 2qov h ARG 116 CO 0.08 0.23 -1.11 0.00 2.80 0.00 0.00 179.97 181.97 2qov h ALA 117 N 1.61 0.23 0.00 2.80 0.00 -1.46 -2.70 119.26 119.74 2qov h ALA 117 Ca 0.60 -0.83 -0.08 0.00 0.00 0.00 0.00 54.91 54.60 2qov h ALA 117 Cb 1.60 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.35 2qov h ALA 117 CO -0.29 0.96 -0.39 0.52 0.00 0.00 0.00 179.25 180.05 2qov h MET 118 N 0.10 0.00 0.02 0.00 2.86 0.37 -3.27 114.93 115.01 2qov h MET 118 Ca -0.10 0.00 -0.05 0.00 -2.06 0.00 0.00 59.70 57.49 2qov h MET 118 Cb 1.81 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.48 2qov h MET 118 CO 0.18 0.39 -0.20 0.35 1.06 0.00 0.00 176.91 178.70 2qov h PHE 119 N 0.00 0.16 0.00 -0.22 3.04 -0.12 -3.25 116.94 116.56 2qov h PHE 119 Ca -0.00 -0.10 0.00 0.00 3.98 0.00 0.00 57.97 61.84 2qov h PHE 119 Cb 0.99 -0.01 0.00 0.00 2.56 0.00 0.00 35.95 39.49 2qov h PHE 119 CO 0.00 0.99 0.14 2.89 -2.02 0.00 0.00 178.31 180.31 2qov n ARG 120 N -4.52 0.00 0.08 1.11 1.85 -1.02 -0.61 116.66 113.54 2qov n ARG 120 Ca -0.10 0.33 -0.22 0.00 -1.00 0.00 0.00 57.85 56.86 2qov n ARG 120 Cb 0.52 -1.64 -0.13 0.00 -1.05 0.00 0.00 32.46 30.17 2qov n ARG 120 CO 0.00 0.00 0.00 0.87 -0.01 0.00 0.00 177.63 178.49 2qov h LYS 121 N 0.00 0.62 -6.82 2.89 1.57 -1.64 -3.45 116.57 109.74 2qov h LYS 121 Ca 0.00 -0.80 -0.49 0.00 -1.87 0.00 0.00 60.65 57.49 2qov h LYS 121 Cb 0.28 0.26 0.00 0.00 0.08 0.00 0.00 32.23 32.85 2qov h LYS 121 CO 0.00 1.36 0.41 -1.17 -0.57 0.00 0.00 179.45 179.48 2qov s LEU 122 N -7.94 4.50 0.00 2.94 0.20 0.22 -4.69 118.68 113.91 2qov s LEU 122 Ca -0.10 2.08 0.00 0.00 0.69 0.00 0.00 54.13 56.80 2qov s LEU 122 Cb 0.05 -3.75 0.00 0.00 -0.43 0.00 0.00 46.19 42.06 2qov s LEU 122 CO 0.92 -0.09 0.00 0.29 -0.29 0.00 0.00 176.35 177.19 2qov n LYS 123 N 1.02 1.47 0.00 1.98 4.01 -1.19 -5.03 118.16 120.42 2qov n LYS 123 Ca -0.00 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.80 2qov n LYS 123 Cb 0.47 0.00 0.00 0.00 -0.51 0.00 0.00 35.03 34.99 2qov n LYS 123 CO 0.00 0.00 0.00 1.33 -1.11 0.00 0.00 177.40 177.62 2qov n VAL 124 N -0.58 0.00 -0.10 -0.18 0.24 -1.26 -3.37 118.33 113.08 2qov n VAL 124 Ca 0.00 0.00 0.01 0.00 -2.04 0.00 0.00 64.34 62.31 2qov n VAL 124 Cb 0.00 0.00 -0.01 0.00 -1.47 0.00 0.00 33.84 32.36 2qov n VAL 124 CO 0.00 0.00 0.00 -1.22 -2.14 0.00 0.00 176.83 173.47 2qov n TYR 125 N -1.01 -0.27 -0.08 6.34 4.01 -1.26 -2.60 117.16 122.29 2qov n TYR 125 Ca 0.00 0.15 -0.13 0.00 -0.16 0.00 0.00 57.90 57.76 2qov n TYR 125 Cb 0.00 -0.25 -0.05 0.00 -0.31 0.00 0.00 39.34 38.73 2qov n TYR 125 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2qov h ALA 126 N -0.10 0.31 0.00 -0.72 0.00 -1.82 -3.39 119.26 113.53 2qov h ALA 126 Ca -0.01 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.57 2qov h ALA 126 Cb 0.10 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.82 2qov h ALA 126 CO 0.01 0.20 0.00 0.41 0.00 0.00 0.00 179.25 179.86 2qov n GLY 127 N 0.07 3.59 7.00 0.00 0.00 -1.24 -3.59 105.19 111.02 2qov n GLY 127 Ca -0.05 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.86 2qov n GLY 127 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2qov n ASN 128 N 0.00 0.00 -4.19 1.61 3.02 -1.26 -4.71 115.26 109.73 2qov n ASN 128 Ca 0.00 0.00 -0.35 0.00 -0.03 0.00 0.00 54.58 54.20 2qov n ASN 128 Cb 0.00 0.00 0.08 0.00 -0.61 0.00 0.00 39.78 39.25 2qov n ASN 128 CO 0.00 0.00 0.00 -1.84 -2.62 0.00 0.00 177.26 172.80 2qov n GLU 129 N 1.32 -0.28 -3.39 3.52 -0.00 -1.26 -4.89 120.64 115.65 2qov n GLU 129 Ca 0.00 -0.06 0.02 0.00 -0.00 0.00 0.00 57.16 57.11 2qov n GLU 129 Cb 0.00 -1.41 -0.04 0.00 -0.00 0.00 0.00 31.44 29.99 2qov n GLU 129 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.13 173.75 2qov s HIS 130 N -2.18 -0.57 -0.79 -1.84 -3.43 -1.26 -4.88 115.29 100.34 2qov s HIS 130 Ca 0.48 1.00 -0.05 0.00 -0.80 0.00 0.00 55.06 55.69 2qov s HIS 130 Cb -0.16 0.34 -0.05 0.00 -1.43 0.00 0.00 32.58 31.29 2qov s HIS 130 CO 0.73 -0.28 1.99 0.09 -2.00 0.00 0.00 174.74 175.27 2qov n ASN 131 N 4.78 4.36 0.00 7.38 3.02 -1.26 -3.41 115.26 130.13 2qov n ASN 131 Ca -0.10 -2.28 0.00 0.00 -0.03 0.00 0.00 54.58 52.18 2qov n ASN 131 Cb 0.53 -1.02 0.00 0.00 -0.61 0.00 0.00 39.78 38.68 2qov n ASN 131 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 2qov n HIS 132 N 4.24 0.00 0.01 3.10 8.25 -1.26 -4.88 115.22 124.69 2qov n HIS 132 Ca 0.39 0.00 0.23 0.00 -0.26 0.00 0.00 57.72 58.08 2qov n HIS 132 Cb 0.13 0.02 0.69 0.00 1.12 0.00 0.00 29.99 31.95 2qov n HIS 132 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2qov h ALA 133 N 0.00 2.32 0.00 -1.41 0.00 -2.02 -1.49 119.26 116.67 2qov h ALA 133 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2qov h ALA 133 Cb 0.84 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.67 2qov h ALA 133 CO 0.00 -0.89 0.09 0.00 0.00 0.00 0.00 179.25 178.44 2qov n ALA 134 N -2.35 0.83 0.36 0.00 0.00 -1.26 0.49 120.51 118.58 2qov n ALA 134 Ca 0.11 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.61 2qov n ALA 134 Cb 0.82 -0.67 -0.07 0.00 0.00 0.00 0.00 19.45 19.53 2qov n ALA 134 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2qov n GLN 135 N -1.09 2.45 -3.93 0.00 3.00 -0.56 -5.03 117.38 112.21 2qov n GLN 135 Ca 0.00 -0.03 -0.27 0.00 -0.01 0.00 0.00 57.00 56.69 2qov n GLN 135 Cb 0.09 -1.10 -0.01 0.00 0.00 0.00 0.00 30.24 29.22 2qov n GLN 135 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.06 178.10 2qov n GLN 136 N -1.45 -2.90 -2.10 -1.09 6.02 0.18 -4.88 117.38 111.15 2qov n GLN 136 Ca 0.01 0.39 -0.42 0.00 -0.01 0.00 0.00 57.00 56.97 2qov n GLN 136 Cb 0.21 -4.40 -0.03 0.00 1.02 0.00 0.00 30.24 27.04 2qov n GLN 136 CO 0.00 0.00 0.00 -2.14 -1.01 0.00 0.00 177.06 173.91 2qov s PRO 137 N -6.53 4.28 0.34 -1.09 0.02 -1.26 -4.97 135.00 125.80 2qov s PRO 137 Ca 0.07 2.15 -0.28 0.00 0.02 0.00 0.00 61.00 62.96 2qov s PRO 137 Cb -0.03 -3.28 -0.10 0.00 0.02 0.00 0.00 34.50 31.12 2qov s PRO 137 CO 0.89 -0.51 1.26 1.14 -0.33 0.00 0.00 177.00 179.46 2qov s GLN 138 N 1.32 4.30 0.73 5.54 -2.07 -1.22 -4.48 119.66 123.78 2qov s GLN 138 Ca 0.66 2.11 -0.15 0.00 -1.82 0.00 0.00 55.36 56.17 2qov s GLN 138 Cb -0.38 -3.00 0.04 0.00 -1.09 0.00 0.00 33.01 28.58 2qov s GLN 138 CO 0.30 -0.19 1.18 0.14 -1.32 0.00 0.00 175.29 175.40 2qov s VAL 139 N -1.19 2.48 -0.14 3.63 -7.23 -1.26 -2.47 120.40 114.22 2qov s VAL 139 Ca 0.50 0.23 -0.11 0.00 -1.81 0.00 0.00 61.98 60.80 2qov s VAL 139 Cb -0.37 -2.75 0.04 0.00 0.56 0.00 0.00 36.38 33.85 2qov s VAL 139 CO 0.49 -0.14 0.36 -0.22 -0.31 0.00 0.00 175.10 175.28 2qov s LEU 140 N -5.20 0.40 -0.41 1.32 0.20 -0.49 -4.77 118.68 109.74 2qov s LEU 140 Ca 0.72 0.74 -0.14 0.00 0.69 0.00 0.00 54.13 56.14 2qov s LEU 140 Cb -0.27 1.19 0.03 0.00 -0.43 0.00 0.00 46.19 46.71 2qov s LEU 140 CO 0.45 -0.15 0.29 -0.62 -0.29 0.00 0.00 176.35 176.03 2qov s ASP 141 N 0.68 6.02 0.00 3.68 2.15 -1.26 -4.44 116.67 123.49 2qov s ASP 141 Ca -0.04 -0.97 0.00 0.00 0.43 0.00 0.00 52.55 51.97 2qov s ASP 141 Cb -0.05 -2.13 0.00 0.00 -0.30 0.00 0.00 42.92 40.44 2qov s ASP 141 CO -0.04 -0.46 0.00 -0.38 -0.17 0.00 0.00 175.17 174.12