#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dsc s GLN 15 N 0.00 3.47 0.24 1.64 -0.21 -1.26 -4.74 119.66 118.80 2dsc s GLN 15 Ca 0.00 -0.26 -0.20 0.00 0.02 0.00 0.00 55.36 54.92 2dsc s GLN 15 Cb 0.00 -3.10 0.02 0.00 1.00 0.00 0.00 33.01 30.94 2dsc s GLN 15 CO 0.00 0.67 0.64 1.52 -2.12 0.00 0.00 175.29 176.00 2dsc s TYR 16 N -1.31 -0.15 0.04 0.91 -0.85 -1.20 -4.99 117.35 109.80 2dsc s TYR 16 Ca 0.27 -0.24 -0.28 0.00 -0.52 0.00 0.00 57.07 56.30 2dsc s TYR 16 Cb -0.13 0.56 -0.05 0.00 0.38 0.00 0.00 41.96 42.73 2dsc s TYR 16 CO 0.17 -1.10 0.87 0.42 -1.52 0.00 0.00 175.55 174.40 2dsc s ILE 17 N -3.90 4.75 -0.22 -3.49 -1.09 -1.26 -1.53 121.20 114.45 2dsc s ILE 17 Ca 0.11 1.85 -0.07 0.00 -2.23 0.00 0.00 60.65 60.30 2dsc s ILE 17 Cb -0.04 -4.22 -0.18 0.00 -1.58 0.00 0.00 42.46 36.44 2dsc s ILE 17 CO 0.03 0.28 -0.06 -0.38 -1.23 0.00 0.00 174.94 173.58 2dsc n ILE 18 N 3.23 1.58 -3.49 2.92 5.41 0.17 -4.93 119.36 124.25 2dsc n ILE 18 Ca 0.01 -0.47 -0.09 0.00 1.00 0.00 0.00 62.75 63.20 2dsc n ILE 18 Cb 0.50 -1.69 -0.02 0.00 -0.71 0.00 0.00 39.64 37.72 2dsc n ILE 18 CO 0.00 0.00 0.00 -0.94 0.00 0.00 0.00 176.55 175.61 2dsc s SER 19 N -6.93 -0.40 -0.23 4.38 1.04 -0.84 -4.99 113.70 105.74 2dsc s SER 19 Ca -0.32 -0.00 -0.02 0.00 0.48 0.00 0.00 55.95 56.09 2dsc s SER 19 Cb 0.09 0.42 0.07 0.00 0.10 0.00 0.00 66.02 66.70 2dsc s SER 19 CO 0.61 -0.68 0.03 -1.61 0.98 0.00 0.00 173.24 172.57 2dsc s GLU 20 N -3.22 0.90 -0.29 4.02 2.02 -1.26 -0.19 118.70 120.67 2dsc s GLU 20 Ca 0.04 -0.68 -0.17 0.00 0.02 0.00 0.00 54.97 54.18 2dsc s GLU 20 Cb -0.01 -2.21 -0.02 0.00 0.10 0.00 0.00 34.13 31.99 2dsc s GLU 20 CO -0.10 -0.70 0.48 -2.00 0.02 0.00 0.00 175.26 172.97 2dsc s GLU 21 N 1.70 3.91 0.17 1.61 2.12 0.15 -4.90 118.70 123.47 2dsc s GLU 21 Ca -0.00 0.10 -0.32 0.00 0.36 0.00 0.00 54.97 55.12 2dsc s GLU 21 Cb -0.18 -3.70 -0.10 0.00 0.26 0.00 0.00 34.13 30.41 2dsc s GLU 21 CO -0.11 -0.43 1.60 -1.17 -0.54 0.00 0.00 175.26 174.61 2dsc s LEU 22 N 2.29 4.37 -0.20 2.70 1.98 -1.26 0.65 118.68 129.20 2dsc s LEU 22 Ca 0.19 2.67 -0.04 0.00 -2.89 0.00 0.00 54.13 54.06 2dsc s LEU 22 Cb -0.16 -3.59 -0.11 0.00 0.66 0.00 0.00 46.19 42.99 2dsc s LEU 22 CO 0.11 -0.85 -0.22 -0.38 -1.89 0.00 0.00 176.35 173.11 2dsc n ILE 23 N 3.97 1.15 -3.64 6.68 5.41 0.69 -4.83 119.36 128.79 2dsc n ILE 23 Ca 0.14 -0.37 -0.08 0.00 1.00 0.00 0.00 62.75 63.44 2dsc n ILE 23 Cb 0.38 -1.46 -0.07 0.00 -0.71 0.00 0.00 39.64 37.77 2dsc n ILE 23 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 176.55 176.00 2dsc s SER 24 N -6.36 -0.78 -0.08 4.38 0.15 -0.48 -4.98 113.70 105.55 2dsc s SER 24 Ca -0.28 1.32 0.02 0.00 0.70 0.00 0.00 55.95 57.71 2dsc s SER 24 Cb 0.09 1.33 0.01 0.00 -1.71 0.00 0.00 66.02 65.74 2dsc s SER 24 CO 0.42 -0.21 -0.12 -0.70 1.20 0.00 0.00 173.24 173.82 2dsc s GLU 25 N 1.21 1.79 0.00 5.44 2.12 -1.26 0.59 118.70 128.59 2dsc s GLU 25 Ca -0.07 -0.43 0.00 0.00 0.36 0.00 0.00 54.97 54.83 2dsc s GLU 25 Cb -0.05 -1.52 0.00 0.00 0.26 0.00 0.00 34.13 32.82 2dsc s GLU 25 CO -0.14 -0.02 0.00 0.41 -0.54 0.00 0.00 175.26 174.98 2dsc n GLY 26 N 3.99 2.85 0.20 -1.50 0.00 0.16 -4.98 105.19 105.91 2dsc n GLY 26 Ca -0.21 -2.11 0.09 0.00 0.00 0.00 0.00 46.02 43.79 2dsc n GLY 26 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2dsc h LYS 27 N 0.00 0.00 0.00 1.61 3.64 -2.02 -3.38 116.57 116.42 2dsc h LYS 27 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2dsc h LYS 27 Cb 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.82 2dsc h LYS 27 CO 0.00 0.25 -0.82 0.91 -2.27 0.00 0.00 179.45 177.52 2dsc n TRP 28 N -3.25 0.00 -4.15 1.91 7.02 -1.26 -4.80 117.44 112.91 2dsc n TRP 28 Ca 0.02 0.00 -0.17 0.00 -1.02 0.00 0.00 57.50 56.32 2dsc n TRP 28 Cb 0.54 0.00 -0.12 0.00 -2.42 0.00 0.00 31.31 29.31 2dsc n TRP 28 CO 0.00 0.00 0.00 0.08 -2.02 0.00 0.00 177.69 175.75 2dsc s VAL 29 N -1.80 0.99 0.06 -0.99 1.01 -1.26 -0.39 120.40 118.02 2dsc s VAL 29 Ca 0.00 -1.27 0.03 0.00 0.00 0.00 0.00 61.98 60.74 2dsc s VAL 29 Cb 0.00 -0.98 -0.03 0.00 0.00 0.00 0.00 36.38 35.37 2dsc s VAL 29 CO 0.00 -0.26 -0.09 -1.59 0.00 0.00 0.00 175.10 173.16 2dsc s LYS 30 N -1.72 0.63 -0.06 2.72 -2.85 -0.20 0.39 119.74 118.65 2dsc s LYS 30 Ca -0.04 -0.89 0.05 0.00 -1.00 0.00 0.00 55.97 54.10 2dsc s LYS 30 Cb -0.10 -0.37 -0.01 0.00 -2.06 0.00 0.00 37.83 35.29 2dsc s LYS 30 CO 0.02 0.06 -0.22 -1.17 0.10 0.00 0.00 175.35 174.14 2dsc s LEU 31 N -1.86 2.24 0.06 2.77 2.96 0.20 -1.89 118.68 123.16 2dsc s LEU 31 Ca -0.05 -0.44 -0.07 0.00 -0.22 0.00 0.00 54.13 53.35 2dsc s LEU 31 Cb -0.07 -1.42 -0.01 0.00 0.50 0.00 0.00 46.19 45.19 2dsc s LEU 31 CO -0.00 0.26 0.15 -1.83 -1.32 0.00 0.00 176.35 173.60 2dsc s GLU 32 N -0.24 0.71 -0.31 1.98 -1.05 -0.22 -0.22 118.70 119.34 2dsc s GLU 32 Ca -0.01 -0.84 -0.16 0.00 -0.15 0.00 0.00 54.97 53.81 2dsc s GLU 32 Cb -0.13 0.29 -0.02 0.00 -0.44 0.00 0.00 34.13 33.82 2dsc s GLU 32 CO 0.03 -0.20 0.42 0.21 0.95 0.00 0.00 175.26 176.66 2dsc s LYS 33 N -3.19 3.77 -0.13 -4.83 2.20 0.21 -0.78 119.74 116.99 2dsc s LYS 33 Ca -0.00 -0.14 -0.10 0.00 -0.36 0.00 0.00 55.97 55.37 2dsc s LYS 33 Cb 0.02 -3.74 -0.05 0.00 -1.51 0.00 0.00 37.83 32.55 2dsc s LYS 33 CO -0.07 -0.46 0.21 0.99 -0.36 0.00 0.00 175.35 175.66 2dsc s THR 34 N 2.16 5.37 -0.13 3.43 2.01 0.21 0.32 115.64 129.01 2dsc s THR 34 Ca 0.15 0.37 0.01 0.00 0.31 0.00 0.00 61.69 62.54 2dsc s THR 34 Cb -0.16 -3.52 -0.01 0.00 0.01 0.00 0.00 72.50 68.83 2dsc s THR 34 CO 0.11 0.51 -0.17 -0.89 -0.69 0.00 0.00 174.62 173.49 2dsc s THR 35 N -0.32 2.64 0.15 -0.82 2.01 0.73 0.04 115.64 120.08 2dsc s THR 35 Ca 0.15 -0.80 -0.01 0.00 0.31 0.00 0.00 61.69 61.34 2dsc s THR 35 Cb -0.13 -2.08 -0.04 0.00 0.01 0.00 0.00 72.50 70.26 2dsc s THR 35 CO 0.04 0.53 0.07 -0.72 -0.69 0.00 0.00 174.62 173.85 2dsc s TYR 36 N 0.45 0.99 -0.23 4.92 -0.85 0.18 0.46 117.35 123.27 2dsc s TYR 36 Ca -0.12 -1.24 -0.09 0.00 -0.52 0.00 0.00 57.07 55.10 2dsc s TYR 36 Cb -0.16 -0.54 -0.04 0.00 0.38 0.00 0.00 41.96 41.59 2dsc s TYR 36 CO 0.06 -0.50 0.12 1.41 -1.52 0.00 0.00 175.55 175.12 2dsc s MET 37 N -4.05 3.96 0.55 -3.49 -2.45 -0.58 -1.32 119.30 111.91 2dsc s MET 37 Ca 0.28 -0.33 -0.07 0.00 -1.25 0.00 0.00 55.69 54.31 2dsc s MET 37 Cb 0.07 -3.42 0.12 0.00 1.25 0.00 0.00 34.83 32.86 2dsc s MET 37 CO 0.05 0.06 0.74 -0.40 1.05 0.00 0.00 175.02 176.52 2dsc n ASP 38 N 4.25 0.26 0.25 1.11 5.68 0.05 -3.28 116.55 124.87 2dsc n ASP 38 Ca -0.16 -1.39 0.11 0.00 -0.50 0.00 0.00 54.79 52.86 2dsc n ASP 38 Cb 0.52 -0.55 0.66 0.00 -1.14 0.00 0.00 41.12 40.61 2dsc n ASP 38 CO 0.00 0.00 0.00 -0.65 -1.33 0.00 0.00 177.20 175.22 2dsc h PRO 39 N 0.00 0.00 -0.15 0.11 0.11 -1.88 -2.79 132.00 127.40 2dsc h PRO 39 Ca -0.24 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.87 2dsc h PRO 39 Cb 0.71 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.82 2dsc h PRO 39 CO 0.19 0.15 0.00 0.25 -0.21 0.00 0.00 178.00 178.38 2dsc n THR 40 N -3.67 0.19 -0.83 -1.15 -2.24 -1.26 -4.89 114.28 100.44 2dsc n THR 40 Ca -0.02 -0.31 0.00 0.00 -2.27 0.00 0.00 64.05 61.46 2dsc n THR 40 Cb 0.27 0.28 0.00 0.00 -2.10 0.00 0.00 70.33 68.78 2dsc n THR 40 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2dsc n GLY 41 N 1.08 0.70 3.89 3.38 0.00 -1.05 -5.04 105.19 108.15 2dsc n GLY 41 Ca 0.16 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.88 2dsc n GLY 41 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2dsc s LYS 42 N -0.17 3.70 -0.09 1.61 2.20 -1.26 -4.84 119.74 120.88 2dsc s LYS 42 Ca 0.00 0.22 -0.12 0.00 -0.36 0.00 0.00 55.97 55.71 2dsc s LYS 42 Cb 0.00 -2.52 -0.05 0.00 -1.51 0.00 0.00 37.83 33.75 2dsc s LYS 42 CO 0.00 0.09 0.30 0.99 -0.36 0.00 0.00 175.35 176.37 2dsc s THR 43 N -2.23 5.25 0.05 3.43 2.01 -1.26 -0.77 115.64 122.13 2dsc s THR 43 Ca 0.47 0.57 -0.01 0.00 0.31 0.00 0.00 61.69 63.03 2dsc s THR 43 Cb -0.10 -3.60 -0.04 0.00 0.01 0.00 0.00 72.50 68.77 2dsc s THR 43 CO 0.31 0.53 -0.03 -0.13 -0.69 0.00 0.00 174.62 174.60 2dsc s ARG 44 N -0.54 0.60 0.34 4.92 0.52 -0.44 -4.97 118.95 119.39 2dsc s ARG 44 Ca 0.19 -1.20 0.09 0.00 -0.52 0.00 0.00 55.73 54.29 2dsc s ARG 44 Cb -0.14 0.20 -0.06 0.00 0.52 0.00 0.00 34.95 35.47 2dsc s ARG 44 CO 0.08 -0.11 -0.03 0.95 0.02 0.00 0.00 175.30 176.21 2dsc s THR 45 N -3.84 2.46 -0.09 0.02 -4.23 -1.26 -0.65 115.64 108.05 2dsc s THR 45 Ca 0.06 -2.06 -0.24 0.00 -1.18 0.00 0.00 61.69 58.28 2dsc s THR 45 Cb 0.07 -2.74 0.05 0.00 1.34 0.00 0.00 72.50 71.23 2dsc s THR 45 CO -0.10 -0.20 0.56 0.86 -0.54 0.00 0.00 174.62 175.20 2dsc s TRP 46 N -2.56 -0.53 -0.34 3.99 -0.11 0.11 -4.96 118.94 114.54 2dsc s TRP 46 Ca 0.34 1.05 -0.16 0.00 1.22 0.00 0.00 56.10 58.55 2dsc s TRP 46 Cb 0.01 0.27 -0.01 0.00 -1.50 0.00 0.00 33.47 32.24 2dsc s TRP 46 CO 0.18 -0.46 0.39 -1.21 -4.62 0.00 0.00 176.95 171.24 2dsc s GLU 47 N -0.75 3.61 0.10 5.86 2.02 -1.26 0.66 118.70 128.94 2dsc s GLU 47 Ca -0.08 -0.33 0.10 0.00 0.02 0.00 0.00 54.97 54.67 2dsc s GLU 47 Cb -0.03 -3.79 -0.04 0.00 0.10 0.00 0.00 34.13 30.37 2dsc s GLU 47 CO 0.06 -0.53 -0.22 -1.12 0.02 0.00 0.00 175.26 173.46 2dsc s SER 48 N 1.73 3.58 0.10 -0.19 0.01 0.04 -4.85 113.70 114.11 2dsc s SER 48 Ca 0.13 -0.62 0.06 0.00 1.31 0.00 0.00 55.95 56.84 2dsc s SER 48 Cb -0.16 -0.40 -0.04 0.00 0.21 0.00 0.00 66.02 65.63 2dsc s SER 48 CO 0.12 0.20 -0.06 -0.69 0.41 0.00 0.00 173.24 173.22 2dsc s VAL 49 N -1.04 3.65 -0.08 3.43 1.01 0.13 -1.06 120.40 126.44 2dsc s VAL 49 Ca 0.15 -1.14 -0.13 0.00 0.00 0.00 0.00 61.98 60.86 2dsc s VAL 49 Cb -0.10 -2.72 0.03 0.00 0.00 0.00 0.00 36.38 33.59 2dsc s VAL 49 CO 0.07 0.12 0.34 -0.54 0.00 0.00 0.00 175.10 175.09 2dsc s LYS 50 N -2.23 0.52 0.17 2.72 1.02 -0.79 -2.85 119.74 118.29 2dsc s LYS 50 Ca 0.23 0.21 -0.28 0.00 0.02 0.00 0.00 55.97 56.15 2dsc s LYS 50 Cb -0.11 0.24 -0.08 0.00 -0.52 0.00 0.00 37.83 37.36 2dsc s LYS 50 CO 0.16 -0.11 0.88 1.03 -0.92 0.00 0.00 175.35 176.39 2dsc s ARG 51 N -0.44 4.70 0.01 1.68 0.52 -1.26 -1.04 118.95 123.12 2dsc s ARG 51 Ca -0.06 1.34 0.29 0.00 -0.52 0.00 0.00 55.73 56.78 2dsc s ARG 51 Cb -0.04 -3.31 1.17 0.00 0.52 0.00 0.00 34.95 33.30 2dsc s ARG 51 CO 0.02 0.44 1.89 0.25 0.02 0.00 0.00 175.30 177.92 2dsc n THR 52 N 1.96 0.03 0.74 0.02 -2.24 0.47 -3.44 114.28 111.83 2dsc n THR 52 Ca -0.02 -0.02 0.07 0.00 -2.27 0.00 0.00 64.05 61.81 2dsc n THR 52 Cb 0.48 -0.46 0.19 0.00 -2.10 0.00 0.00 70.33 68.45 2dsc n THR 52 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2dsc n THR 53 N -1.54 0.52 -2.89 4.28 -2.24 -1.26 -4.93 114.28 106.21 2dsc n THR 53 Ca 0.07 -0.53 -0.41 0.00 -2.27 0.00 0.00 64.05 60.91 2dsc n THR 53 Cb 0.34 0.29 -0.04 0.00 -2.10 0.00 0.00 70.33 68.82 2dsc n THR 53 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 2dsc s ARG 54 N -1.48 4.48 0.55 -0.78 3.52 -1.22 -5.06 118.95 118.96 2dsc s ARG 54 Ca 0.28 1.12 0.08 0.00 -0.13 0.00 0.00 55.73 57.08 2dsc s ARG 54 Cb 0.14 -3.46 0.07 0.00 -1.56 0.00 0.00 34.95 30.14 2dsc s ARG 54 CO 0.19 -0.00 0.67 0.15 -0.81 0.00 0.00 175.30 175.50 2dsc s LYS 55 N 0.95 2.33 -0.32 5.12 3.01 -1.26 -4.99 119.74 124.58 2dsc s LYS 55 Ca 0.44 -1.71 -0.04 0.00 -1.01 0.00 0.00 55.97 53.65 2dsc s LYS 55 Cb -0.19 -2.51 0.02 0.00 -1.01 0.00 0.00 37.83 34.14 2dsc s LYS 55 CO 0.22 -0.75 2.77 0.39 0.51 0.00 0.00 175.35 178.50 2dsc n GLU 56 N -2.08 2.15 0.00 1.68 4.71 -1.26 -4.81 120.64 121.03 2dsc n GLU 56 Ca 0.11 -1.84 0.00 0.00 -0.01 0.00 0.00 57.16 55.42 2dsc n GLU 56 Cb 0.62 -1.97 0.00 0.00 -1.01 0.00 0.00 31.44 29.08 2dsc n GLU 56 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2dsc n GLN 57 N 1.13 2.17 -0.11 3.49 10.64 -1.26 -5.05 117.38 128.39 2dsc n GLN 57 Ca 0.42 0.00 -0.17 0.00 -1.83 0.00 0.00 57.00 55.42 2dsc n GLN 57 Cb 0.63 0.00 -0.13 0.00 -0.86 0.00 0.00 30.24 29.88 2dsc n GLN 57 CO 0.00 0.00 0.00 -2.37 -1.83 0.00 0.00 177.06 172.86 2dsc n THR 58 N 0.00 1.51 -3.67 -0.39 5.66 -1.26 -5.08 114.28 111.05 2dsc n THR 58 Ca 0.00 -0.62 -0.04 0.00 -3.05 0.00 0.00 64.05 60.34 2dsc n THR 58 Cb 0.00 -1.33 -0.01 0.00 -1.55 0.00 0.00 70.33 67.43 2dsc n THR 58 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2dsc s ALA 59 N -2.52 -1.78 0.35 1.79 0.00 -1.26 -4.80 121.76 113.53 2dsc s ALA 59 Ca -0.30 0.46 0.06 0.00 0.00 0.00 0.00 51.96 52.18 2dsc s ALA 59 Cb 0.08 0.52 0.64 0.00 0.00 0.00 0.00 23.12 24.37 2dsc s ALA 59 CO 0.65 -0.94 1.87 -0.44 0.00 0.00 0.00 175.76 176.90 2dsc h ASP 60 N 2.00 0.41 -0.11 0.00 5.19 -1.63 -3.43 116.42 118.85 2dsc h ASP 60 Ca -0.24 -0.08 0.00 0.00 -0.62 0.00 0.00 57.03 56.09 2dsc h ASP 60 Cb 1.23 -0.11 0.00 0.00 0.18 0.00 0.00 39.33 40.63 2dsc h ASP 60 CO 0.27 0.52 0.00 0.61 -3.12 0.00 0.00 179.24 177.52 2dsc n GLY 61 N -0.84 1.41 3.12 2.75 0.00 -1.17 -3.14 105.19 107.33 2dsc n GLY 61 Ca 0.01 -0.72 -0.12 0.00 0.00 0.00 0.00 46.02 45.18 2dsc n GLY 61 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2dsc s VAL 62 N -2.38 0.66 -0.03 1.61 -7.23 -0.03 -1.57 120.40 111.43 2dsc s VAL 62 Ca 0.00 -1.52 0.04 0.00 -1.81 0.00 0.00 61.98 58.69 2dsc s VAL 62 Cb 0.00 -1.18 -0.00 0.00 0.56 0.00 0.00 36.38 35.76 2dsc s VAL 62 CO 0.00 -0.62 -0.16 0.00 -0.31 0.00 0.00 175.10 174.01 2dsc s ALA 63 N -2.49 1.44 -0.16 1.32 0.00 -0.26 -1.62 121.76 119.99 2dsc s ALA 63 Ca 0.01 -0.67 -0.03 0.00 0.00 0.00 0.00 51.96 51.28 2dsc s ALA 63 Cb -0.02 -0.45 -0.02 0.00 0.00 0.00 0.00 23.12 22.62 2dsc s ALA 63 CO -0.02 0.28 -0.05 0.08 0.00 0.00 0.00 175.76 176.05 2dsc s VAL 64 N -0.05 3.74 -0.60 0.00 1.01 0.77 -0.76 120.40 124.51 2dsc s VAL 64 Ca -0.01 -0.41 -0.15 0.00 0.00 0.00 0.00 61.98 61.41 2dsc s VAL 64 Cb -0.10 -2.64 0.15 0.00 0.00 0.00 0.00 36.38 33.79 2dsc s VAL 64 CO 0.01 0.49 0.54 -0.63 0.00 0.00 0.00 175.10 175.51 2dsc s ILE 65 N 0.45 5.16 -0.30 2.22 1.01 -0.58 -3.51 121.20 125.65 2dsc s ILE 65 Ca -0.04 -1.78 -0.17 0.00 0.00 0.00 0.00 60.65 58.66 2dsc s ILE 65 Cb -0.14 -4.29 -0.02 0.00 0.01 0.00 0.00 42.46 38.02 2dsc s ILE 65 CO 0.03 -0.90 0.47 -2.16 0.00 0.00 0.00 174.94 172.38 2dsc s PRO 66 N 1.22 3.89 -0.40 2.79 0.05 -1.26 -0.86 135.00 140.43 2dsc s PRO 66 Ca 0.07 0.05 -0.11 0.00 0.05 0.00 0.00 61.00 61.06 2dsc s PRO 66 Cb -0.25 -3.71 0.04 0.00 0.05 0.00 0.00 34.50 30.63 2dsc s PRO 66 CO -0.00 -0.43 0.25 0.08 0.05 0.00 0.00 177.00 176.94 2dsc s VAL 67 N 2.26 4.63 -0.38 -0.36 1.01 0.60 -1.71 120.40 126.45 2dsc s VAL 67 Ca 0.18 -0.99 -0.28 0.00 0.00 0.00 0.00 61.98 60.89 2dsc s VAL 67 Cb -0.16 -3.66 0.02 0.00 0.00 0.00 0.00 36.38 32.58 2dsc s VAL 67 CO 0.11 -0.35 1.03 -0.22 0.00 0.00 0.00 175.10 175.67 2dsc s LEU 68 N 1.55 3.89 -0.14 3.92 2.96 0.61 -0.09 118.68 131.38 2dsc s LEU 68 Ca 0.03 0.70 -0.02 0.00 -0.22 0.00 0.00 54.13 54.62 2dsc s LEU 68 Cb -0.21 -3.42 -0.03 0.00 0.50 0.00 0.00 46.19 43.04 2dsc s LEU 68 CO 0.06 -0.96 -0.06 -1.10 -1.32 0.00 0.00 176.35 172.97 2dsc s GLN 69 N 3.77 3.48 -0.02 1.98 -0.21 0.80 -1.74 119.66 127.73 2dsc s GLN 69 Ca 0.43 -0.55 -0.00 0.00 0.02 0.00 0.00 55.36 55.25 2dsc s GLN 69 Cb -0.11 -2.81 0.03 0.00 1.00 0.00 0.00 33.01 31.11 2dsc s GLN 69 CO 0.21 0.30 0.04 1.03 -2.12 0.00 0.00 175.29 174.75 2dsc s ARG 70 N 0.18 -0.01 0.51 2.91 3.00 -1.26 0.63 118.95 124.90 2dsc s ARG 70 Ca -0.03 0.18 -0.23 0.00 0.00 0.00 0.00 55.73 55.65 2dsc s ARG 70 Cb -0.14 -0.19 -0.06 0.00 0.00 0.00 0.00 34.95 34.55 2dsc s ARG 70 CO 0.03 -0.14 1.39 -0.08 0.00 0.00 0.00 175.30 176.50 2dsc s THR 71 N 0.89 2.07 -0.90 0.02 -1.32 -1.26 -1.93 115.64 113.21 2dsc s THR 71 Ca -0.07 0.05 0.00 0.00 -1.21 0.00 0.00 61.69 60.46 2dsc s THR 71 Cb -0.10 -3.03 0.00 0.00 -1.51 0.00 0.00 72.50 67.86 2dsc s THR 71 CO -0.03 0.00 0.00 0.18 -2.21 0.00 0.00 174.62 172.57 2dsc n LEU 72 N -0.68 -0.35 -4.17 9.08 4.77 -1.26 -4.99 117.00 119.40 2dsc n LEU 72 Ca 0.08 0.21 -0.13 0.00 -0.03 0.00 0.00 56.01 56.14 2dsc n LEU 72 Cb 0.44 -1.99 -0.11 0.00 -2.33 0.00 0.00 43.42 39.43 2dsc n LEU 72 CO 0.55 -0.71 -0.40 -1.00 -1.33 0.00 0.00 177.39 174.50 2dsc s HIS 73 N -2.05 0.98 0.64 -1.77 3.76 -0.81 -5.14 115.29 110.89 2dsc s HIS 73 Ca 0.00 -0.73 -0.14 0.00 -0.15 0.00 0.00 55.06 54.04 2dsc s HIS 73 Cb 0.00 -0.54 -0.02 0.00 1.11 0.00 0.00 32.58 33.13 2dsc s HIS 73 CO 0.00 -0.05 1.06 0.71 -0.85 0.00 0.00 174.74 175.61 2dsc s TYR 74 N -2.78 3.02 0.65 1.40 1.51 -1.26 -4.66 117.35 115.23 2dsc s TYR 74 Ca 0.07 1.48 -0.13 0.00 -1.01 0.00 0.00 57.07 57.48 2dsc s TYR 74 Cb -0.01 -2.96 -0.01 0.00 -0.11 0.00 0.00 41.96 38.87 2dsc s TYR 74 CO -0.01 -1.18 1.06 -1.21 -1.11 0.00 0.00 175.55 173.09 2dsc s GLU 75 N -4.47 3.07 0.05 -0.62 2.02 -1.26 -4.72 118.70 112.77 2dsc s GLU 75 Ca 0.61 1.08 0.06 0.00 0.02 0.00 0.00 54.97 56.75 2dsc s GLU 75 Cb -0.15 -2.00 -0.02 0.00 0.10 0.00 0.00 34.13 32.05 2dsc s GLU 75 CO 0.44 -1.00 -0.17 0.00 0.02 0.00 0.00 175.26 174.55 2dsc s ILE 77 N -0.88 4.48 -0.21 0.00 -1.09 0.16 -0.29 121.20 123.38 2dsc s ILE 77 Ca 0.04 -0.12 -0.22 0.00 -2.23 0.00 0.00 60.65 58.12 2dsc s ILE 77 Cb -0.08 -3.07 -0.02 0.00 -1.58 0.00 0.00 42.46 37.70 2dsc s ILE 77 CO 0.02 0.37 0.72 -0.69 -1.23 0.00 0.00 174.94 174.12 2dsc s VAL 78 N 1.24 4.94 0.32 2.92 1.01 -0.70 -1.27 120.40 128.87 2dsc s VAL 78 Ca 0.05 1.35 0.06 0.00 0.00 0.00 0.00 61.98 63.44 2dsc s VAL 78 Cb -0.14 -4.02 -0.06 0.00 0.00 0.00 0.00 36.38 32.15 2dsc s VAL 78 CO 0.04 0.04 -0.01 -0.76 0.00 0.00 0.00 175.10 174.41 2dsc s LEU 79 N 2.26 2.45 0.05 3.92 1.43 0.12 -4.44 118.68 124.47 2dsc s LEU 79 Ca 0.32 -1.29 0.07 0.00 -1.03 0.00 0.00 54.13 52.20 2dsc s LEU 79 Cb -0.16 -0.60 -0.03 0.00 0.03 0.00 0.00 46.19 45.43 2dsc s LEU 79 CO 0.10 -0.45 -0.19 0.68 0.23 0.00 0.00 176.35 176.71 2dsc s VAL 80 N -3.05 1.56 -0.07 -1.59 -7.23 0.30 -0.60 120.40 109.71 2dsc s VAL 80 Ca 0.33 -1.21 0.05 0.00 -1.81 0.00 0.00 61.98 59.34 2dsc s VAL 80 Cb 0.07 -1.37 -0.01 0.00 0.56 0.00 0.00 36.38 35.63 2dsc s VAL 80 CO 0.14 0.12 -0.24 -0.75 -0.31 0.00 0.00 175.10 174.06 2dsc s LYS 81 N -1.29 2.71 0.11 4.82 2.20 0.87 -0.62 119.74 128.54 2dsc s LYS 81 Ca 0.06 -0.87 -0.25 0.00 -0.36 0.00 0.00 55.97 54.55 2dsc s LYS 81 Cb -0.09 -2.18 0.07 0.00 -1.51 0.00 0.00 37.83 34.13 2dsc s LYS 81 CO 0.02 0.28 0.65 1.14 -0.36 0.00 0.00 175.35 177.09 2dsc s GLN 82 N 0.07 1.18 0.12 4.03 -2.07 -0.97 -0.90 119.66 121.14 2dsc s GLN 82 Ca -0.10 -0.34 -0.30 0.00 -1.82 0.00 0.00 55.36 52.79 2dsc s GLN 82 Cb -0.15 0.55 -0.06 0.00 -1.09 0.00 0.00 33.01 32.25 2dsc s GLN 82 CO 0.06 -0.50 1.10 0.12 -1.32 0.00 0.00 175.29 174.75 2dsc s PHE 83 N -3.30 3.58 -0.32 9.60 5.36 -1.26 -1.15 117.98 130.50 2dsc s PHE 83 Ca -0.00 1.55 0.04 0.00 -0.96 0.00 0.00 56.93 57.56 2dsc s PHE 83 Cb -0.01 -3.27 0.09 0.00 -0.34 0.00 0.00 43.02 39.48 2dsc s PHE 83 CO -0.09 -0.64 0.00 1.03 -1.46 0.00 0.00 175.22 174.06 2dsc s ARG 84 N 0.16 1.69 0.29 10.12 1.81 -0.43 -4.95 118.95 127.64 2dsc s ARG 84 Ca 0.52 -1.71 -0.02 0.00 -1.72 0.00 0.00 55.73 52.80 2dsc s ARG 84 Cb -0.28 -3.10 0.62 0.00 -0.45 0.00 0.00 34.95 31.75 2dsc s ARG 84 CO 0.32 -0.83 1.58 -1.35 -0.68 0.00 0.00 175.30 174.34 2dsc h PRO 85 N 7.67 0.02 -0.30 3.54 0.11 -1.95 0.28 132.00 141.35 2dsc h PRO 85 Ca -0.09 -0.00 0.01 0.00 0.11 0.00 0.00 66.00 66.03 2dsc h PRO 85 Cb 1.03 -0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.12 2dsc h PRO 85 CO 0.50 0.01 0.20 -1.35 -0.21 0.00 0.00 178.00 177.15 2dsc h PRO 86 N 0.02 0.36 0.00 1.05 0.11 -1.95 -1.84 132.00 129.74 2dsc h PRO 86 Ca 0.54 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.63 2dsc h PRO 86 Cb 1.01 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.04 2dsc h PRO 86 CO -0.92 0.24 -0.55 0.52 -0.21 0.00 0.00 178.00 177.08 2dsc h MET 87 N 0.37 0.00 -0.42 1.05 2.86 -0.95 -3.47 114.93 114.37 2dsc h MET 87 Ca 0.11 0.00 -0.18 0.00 -2.06 0.00 0.00 59.70 57.57 2dsc h MET 87 Cb 0.01 0.00 -0.07 0.00 0.06 0.00 0.00 31.60 31.60 2dsc h MET 87 CO -0.02 0.00 -0.16 0.41 1.06 0.00 0.00 176.91 178.19 2dsc n GLY 88 N 1.17 1.01 2.75 8.32 0.00 -0.41 -4.93 105.19 113.10 2dsc n GLY 88 Ca 0.02 -0.35 -0.05 0.00 0.00 0.00 0.00 46.02 45.64 2dsc n GLY 88 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dsc n GLY 89 N -1.30 1.11 3.83 -0.02 0.00 -1.24 -5.00 105.19 102.56 2dsc n GLY 89 Ca -0.09 -1.16 -0.34 0.00 0.00 0.00 0.00 46.02 44.43 2dsc n GLY 89 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2dsc s TYR 90 N -3.77 3.51 0.06 1.61 1.51 -1.26 -1.32 117.35 117.69 2dsc s TYR 90 Ca 0.13 1.37 0.05 0.00 -1.01 0.00 0.00 57.07 57.61 2dsc s TYR 90 Cb -0.03 -2.63 -0.03 0.00 -0.11 0.00 0.00 41.96 39.16 2dsc s TYR 90 CO 0.07 0.18 -0.15 0.00 -1.11 0.00 0.00 175.55 174.55 2dsc s ILE 92 N -1.15 4.66 0.19 0.00 -1.09 0.33 -2.29 121.20 121.84 2dsc s ILE 92 Ca -0.01 -0.24 0.01 0.00 -2.23 0.00 0.00 60.65 58.18 2dsc s ILE 92 Cb -0.09 -3.29 -0.04 0.00 -1.58 0.00 0.00 42.46 37.45 2dsc s ILE 92 CO 0.02 0.18 0.06 -1.61 -1.23 0.00 0.00 174.94 172.36 2dsc s GLU 93 N 1.64 1.16 0.36 2.79 2.02 0.21 -1.07 118.70 125.81 2dsc s GLU 93 Ca 0.06 -1.59 -0.25 0.00 0.02 0.00 0.00 54.97 53.21 2dsc s GLU 93 Cb -0.16 -0.05 -0.09 0.00 0.10 0.00 0.00 34.13 33.92 2dsc s GLU 93 CO 0.06 -0.25 1.01 -0.06 0.02 0.00 0.00 175.26 176.04 2dsc s PHE 94 N -3.86 3.46 0.50 1.61 2.99 -1.26 -0.54 117.98 120.88 2dsc s PHE 94 Ca 0.30 1.70 -0.22 0.00 0.00 0.00 0.00 56.93 58.71 2dsc s PHE 94 Cb 0.07 -3.04 -0.07 0.00 0.00 0.00 0.00 43.02 39.97 2dsc s PHE 94 CO 0.07 -0.26 1.15 -2.30 -0.00 0.00 0.00 175.22 173.88 2dsc n PRO 95 N 0.25 1.47 -3.55 0.24 -0.02 -1.23 -4.70 135.00 127.46 2dsc n PRO 95 Ca 0.03 0.54 -0.11 0.00 -2.02 0.00 0.00 63.50 61.94 2dsc n PRO 95 Cb 0.50 -2.29 -0.02 0.00 -0.02 0.00 0.00 33.50 31.66 2dsc n PRO 95 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2dsc s ALA 96 N -1.32 -1.41 -0.25 3.55 0.00 -1.26 -0.17 121.76 120.91 2dsc s ALA 96 Ca 0.68 0.22 -0.37 0.00 0.00 0.00 0.00 51.96 52.49 2dsc s ALA 96 Cb -0.47 0.86 0.15 0.00 0.00 0.00 0.00 23.12 23.66 2dsc s ALA 96 CO 0.53 -0.82 1.30 0.20 0.00 0.00 0.00 175.76 176.98 2dsc s GLY 97 N -2.80 -0.23 0.57 0.00 0.00 -0.64 -5.00 107.32 99.22 2dsc s GLY 97 Ca 0.04 1.82 -0.18 0.00 0.00 0.00 0.00 44.72 46.40 2dsc s GLY 97 CO -0.08 0.61 1.11 1.08 0.00 0.00 0.00 173.10 175.83 2dsc s LEU 98 N -2.04 3.65 0.34 0.66 1.43 -1.26 -0.85 118.68 120.60 2dsc s LEU 98 Ca 0.11 2.09 -0.06 0.00 -1.03 0.00 0.00 54.13 55.23 2dsc s LEU 98 Cb -0.01 -4.57 -0.05 0.00 0.03 0.00 0.00 46.19 41.59 2dsc s LEU 98 CO -0.03 -1.29 0.63 -0.63 0.23 0.00 0.00 176.35 175.26 2dsc s ILE 99 N -1.98 4.95 0.09 -0.59 1.01 -1.19 -4.84 121.20 118.67 2dsc s ILE 99 Ca 0.70 0.20 -0.01 0.00 0.00 0.00 0.00 60.65 61.54 2dsc s ILE 99 Cb -0.22 -3.75 -0.04 0.00 0.01 0.00 0.00 42.46 38.46 2dsc s ILE 99 CO 0.31 -0.43 0.27 -1.81 0.00 0.00 0.00 174.94 173.28 2dsc s ASP 100 N -3.27 6.39 0.28 3.58 -0.00 -1.26 -5.00 116.67 117.40 2dsc s ASP 100 Ca 0.46 0.36 -0.30 0.00 -0.00 0.00 0.00 52.55 53.07 2dsc s ASP 100 Cb -0.10 -1.99 -0.13 0.00 -0.00 0.00 0.00 42.92 40.69 2dsc s ASP 100 CO 0.32 0.12 1.32 0.47 -0.00 0.00 0.00 175.17 177.40 2dsc n ASP 101 N 0.13 2.61 0.00 0.27 8.00 -1.26 -1.42 116.55 124.89 2dsc n ASP 101 Ca -0.04 1.17 0.00 0.00 0.71 0.00 0.00 54.79 56.63 2dsc n ASP 101 Cb 0.52 -1.44 0.00 0.00 -0.02 0.00 0.00 41.12 40.18 2dsc n ASP 101 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2dsc n GLY 102 N 1.51 1.08 3.77 0.44 0.00 -1.26 -4.97 105.19 105.76 2dsc n GLY 102 Ca 0.09 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.71 2dsc n GLY 102 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2dsc s GLU 103 N -0.22 4.48 0.45 1.61 2.12 -0.51 -5.06 118.70 121.56 2dsc s GLU 103 Ca 0.00 1.05 -0.17 0.00 0.36 0.00 0.00 54.97 56.21 2dsc s GLU 103 Cb 0.00 -3.28 -0.09 0.00 0.26 0.00 0.00 34.13 31.02 2dsc s GLU 103 CO 0.00 0.51 0.91 -0.08 -0.54 0.00 0.00 175.26 176.07 2dsc s THR 104 N -0.87 4.54 0.25 -1.70 -1.32 -1.26 -4.81 115.64 110.47 2dsc s THR 104 Ca 0.35 1.19 -0.04 0.00 -1.21 0.00 0.00 61.69 61.98 2dsc s THR 104 Cb -0.22 -3.67 0.21 0.00 -1.51 0.00 0.00 72.50 67.32 2dsc s THR 104 CO 0.24 -0.48 1.75 -0.65 -2.21 0.00 0.00 174.62 173.26 2dsc h PRO 105 N 1.45 0.51 -0.76 7.08 0.11 -1.97 -0.60 132.00 137.81 2dsc h PRO 105 Ca -0.48 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 65.58 2dsc h PRO 105 Cb 1.18 -0.11 -0.04 0.00 0.11 0.00 0.00 31.00 32.14 2dsc h PRO 105 CO 0.62 0.33 0.39 0.93 -0.21 0.00 0.00 178.00 180.06 2dsc h GLU 106 N 0.52 1.07 -0.47 1.05 3.07 -1.99 -0.51 114.58 117.33 2dsc h GLU 106 Ca 0.41 -0.14 -0.06 0.00 -0.50 0.00 0.00 59.36 59.07 2dsc h GLU 106 Cb 0.58 -0.20 -0.02 0.00 -0.84 0.00 0.00 28.75 28.27 2dsc h GLU 106 CO -0.36 0.81 0.04 0.00 -1.40 0.00 0.00 179.01 178.10 2dsc h ALA 107 N 1.35 0.63 -0.63 3.43 0.00 -1.53 -2.34 119.26 120.17 2dsc h ALA 107 Ca 0.27 -0.25 -0.08 0.00 0.00 0.00 0.00 54.91 54.85 2dsc h ALA 107 Cb 0.07 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 2dsc h ALA 107 CO -0.04 0.39 0.08 0.00 0.00 0.00 0.00 179.25 179.68 2dsc h ALA 108 N 0.94 0.94 -0.12 0.00 0.00 -0.83 -2.09 119.26 118.10 2dsc h ALA 108 Ca 0.14 -0.27 0.01 0.00 0.00 0.00 0.00 54.91 54.78 2dsc h ALA 108 Cb 0.44 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 2dsc h ALA 108 CO 0.02 0.65 0.05 0.00 0.00 0.00 0.00 179.25 179.97 2dsc h ALA 109 N 1.09 0.13 -0.51 0.00 0.00 -0.89 0.34 119.26 119.42 2dsc h ALA 109 Ca 0.19 0.01 -0.07 0.00 0.00 0.00 0.00 54.91 55.04 2dsc h ALA 109 Cb 0.45 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 2dsc h ALA 109 CO 0.02 -0.40 0.04 -0.07 0.00 0.00 0.00 179.25 178.84 2dsc h LEU 110 N 0.11 0.79 -0.09 0.00 3.38 -1.35 -0.91 115.31 117.25 2dsc h LEU 110 Ca 0.05 -0.18 -0.02 0.00 0.09 0.00 0.00 57.88 57.82 2dsc h LEU 110 Cb 0.02 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.56 2dsc h LEU 110 CO -0.04 0.83 -0.03 -0.09 0.09 0.00 0.00 178.44 179.19 2dsc h ARG 111 N 0.78 0.18 -0.72 1.13 2.43 -0.96 -1.56 114.38 115.66 2dsc h ARG 111 Ca 0.16 -0.07 -0.04 0.00 -0.81 0.00 0.00 59.98 59.22 2dsc h ARG 111 Cb 0.41 -0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 29.92 2dsc h ARG 111 CO 0.01 0.53 0.31 1.49 -1.51 0.00 0.00 179.97 180.80 2dsc h GLU 112 N -0.18 1.06 -0.07 0.20 4.57 -0.23 -1.05 114.58 118.88 2dsc h GLU 112 Ca 0.02 -0.18 -0.00 0.00 -1.18 0.00 0.00 59.36 58.02 2dsc h GLU 112 Cb 0.47 -0.18 -0.00 0.00 -0.16 0.00 0.00 28.75 28.88 2dsc h GLU 112 CO 0.01 0.86 0.04 1.25 -1.18 0.00 0.00 179.01 179.99 2dsc h LEU 113 N 1.02 0.09 -1.08 1.64 5.85 -1.13 -0.79 115.31 120.91 2dsc h LEU 113 Ca 0.24 -0.06 -0.06 0.00 0.84 0.00 0.00 57.88 58.84 2dsc h LEU 113 Cb 0.17 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.16 2dsc h LEU 113 CO -0.02 0.12 -0.00 -0.08 -0.34 0.00 0.00 178.44 178.11 2dsc h GLU 114 N 0.04 0.65 -0.21 1.25 4.81 -1.14 0.26 114.58 120.25 2dsc h GLU 114 Ca 0.03 -0.16 -0.13 0.00 -0.13 0.00 0.00 59.36 58.97 2dsc h GLU 114 Cb 0.05 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.35 2dsc h GLU 114 CO -0.00 0.67 -0.38 0.93 -0.73 0.00 0.00 179.01 179.49 2dsc h GLU 115 N 0.61 0.63 0.00 1.92 5.08 -0.96 0.16 114.58 122.02 2dsc h GLU 115 Ca 0.13 -0.40 -0.18 0.00 -1.00 0.00 0.00 59.36 57.91 2dsc h GLU 115 Cb 0.39 0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.66 2dsc h GLU 115 CO 0.01 1.01 -1.08 0.93 -1.00 0.00 0.00 179.01 178.89 2dsc h GLU 116 N 0.31 0.00 0.00 2.33 5.08 -1.09 0.29 114.58 121.51 2dsc h GLU 116 Ca 0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 2dsc h GLU 116 Cb 0.98 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.23 2dsc h GLU 116 CO 0.09 0.60 -0.57 0.25 -1.00 0.00 0.00 179.01 178.37 2dsc n THR 117 N -3.15 0.00 0.00 1.13 -2.24 0.07 -4.74 114.28 105.35 2dsc n THR 117 Ca -0.05 -0.16 0.00 0.00 -2.27 0.00 0.00 64.05 61.57 2dsc n THR 117 Cb 0.88 0.65 0.00 0.00 -2.10 0.00 0.00 70.33 69.76 2dsc n THR 117 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2dsc n GLY 118 N 1.76 2.32 3.78 3.38 0.00 0.56 -4.18 105.19 112.82 2dsc n GLY 118 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 2dsc n GLY 118 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2dsc s TYR 119 N -2.57 3.33 -0.31 1.61 2.02 -1.26 -4.27 117.35 115.91 2dsc s TYR 119 Ca 0.00 1.66 -0.04 0.00 -0.37 0.00 0.00 57.07 58.32 2dsc s TYR 119 Cb 0.00 -3.14 0.04 0.00 -0.40 0.00 0.00 41.96 38.46 2dsc s TYR 119 CO 0.00 -0.57 0.04 0.15 -1.57 0.00 0.00 175.55 173.60 2dsc s LYS 120 N -2.33 2.60 0.38 -0.62 1.02 -1.26 -3.16 119.74 116.37 2dsc s LYS 120 Ca 0.56 -1.17 0.04 0.00 0.02 0.00 0.00 55.97 55.41 2dsc s LYS 120 Cb -0.23 -3.29 0.04 0.00 -0.52 0.00 0.00 37.83 33.83 2dsc s LYS 120 CO 0.29 -0.60 0.30 0.41 -0.92 0.00 0.00 175.35 174.83 2dsc n GLY 121 N 4.72 2.78 3.15 -3.33 0.00 -1.26 -4.56 105.19 106.68 2dsc n GLY 121 Ca -0.13 -2.25 -0.26 0.00 0.00 0.00 0.00 46.02 43.37 2dsc n GLY 121 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2dsc s ASP 122 N -3.22 2.21 0.20 1.61 1.01 -0.02 -4.96 116.67 113.50 2dsc s ASP 122 Ca 0.23 -0.36 -0.31 0.00 0.71 0.00 0.00 52.55 52.82 2dsc s ASP 122 Cb -0.02 -0.59 -0.10 0.00 1.01 0.00 0.00 42.92 43.22 2dsc s ASP 122 CO 0.14 0.16 1.52 -0.63 0.21 0.00 0.00 175.17 176.58 2dsc s ILE 123 N -0.01 2.60 -0.21 0.77 -1.09 -1.26 -1.19 121.20 120.80 2dsc s ILE 123 Ca -0.03 0.46 -0.05 0.00 -2.23 0.00 0.00 60.65 58.79 2dsc s ILE 123 Cb -0.11 -3.29 -0.11 0.00 -1.58 0.00 0.00 42.46 37.36 2dsc s ILE 123 CO 0.02 0.05 -0.24 0.00 -1.23 0.00 0.00 174.94 173.54 2dsc n ALA 124 N 3.25 1.58 -3.57 9.38 0.00 -0.00 -4.86 120.51 126.29 2dsc n ALA 124 Ca 0.11 -0.87 -0.06 0.00 0.00 0.00 0.00 53.44 52.62 2dsc n ALA 124 Cb 0.39 0.13 -0.02 0.00 0.00 0.00 0.00 19.45 19.96 2dsc n ALA 124 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 2dsc s GLU 125 N -2.40 0.65 0.03 0.00 -1.05 -1.14 -5.02 118.70 109.76 2dsc s GLU 125 Ca -0.29 -0.27 0.02 0.00 -0.15 0.00 0.00 54.97 54.29 2dsc s GLU 125 Cb 0.10 0.28 -0.02 0.00 -0.44 0.00 0.00 34.13 34.05 2dsc s GLU 125 CO 0.42 -0.29 -0.08 0.00 0.95 0.00 0.00 175.26 176.27 2dsc s SER 127 N -1.27 5.96 1.07 0.00 1.04 -0.51 -5.00 113.70 115.00 2dsc s SER 127 Ca -0.06 -0.10 -0.18 0.00 0.48 0.00 0.00 55.95 56.09 2dsc s SER 127 Cb -0.08 -1.30 0.25 0.00 0.10 0.00 0.00 66.02 64.98 2dsc s SER 127 CO 0.00 -0.46 1.27 -2.16 0.98 0.00 0.00 173.24 172.87 2dsc s PRO 128 N -4.23 -0.23 0.14 4.02 0.04 -1.26 -4.51 135.00 128.97 2dsc s PRO 128 Ca 0.45 -0.38 -0.31 0.00 0.04 0.00 0.00 61.00 60.80 2dsc s PRO 128 Cb -0.10 -1.74 -0.09 0.00 0.04 0.00 0.00 34.50 32.61 2dsc s PRO 128 CO 0.32 -3.00 1.49 0.00 0.04 0.00 0.00 177.00 175.85 2dsc s ALA 129 N -3.63 3.70 0.13 8.56 0.00 -1.26 -4.52 121.76 124.74 2dsc s ALA 129 Ca 0.75 1.26 0.10 0.00 0.00 0.00 0.00 51.96 54.07 2dsc s ALA 129 Cb -0.04 -3.59 -0.04 0.00 0.00 0.00 0.00 23.12 19.45 2dsc s ALA 129 CO 0.54 -0.71 -0.25 0.14 0.00 0.00 0.00 175.76 175.49 2dsc s VAL 130 N 1.12 2.09 0.08 0.00 -7.23 0.92 -4.88 120.40 112.50 2dsc s VAL 130 Ca 0.68 -1.71 -0.26 0.00 -1.81 0.00 0.00 61.98 58.88 2dsc s VAL 130 Cb -0.41 -1.87 -0.06 0.00 0.56 0.00 0.00 36.38 34.60 2dsc s VAL 130 CO 0.31 0.03 0.79 0.00 -0.31 0.00 0.00 175.10 175.91 2dsc h MET 132 N 5.34 0.41 -0.72 0.00 2.86 -1.58 -3.43 114.93 117.82 2dsc h MET 132 Ca -0.45 -0.35 -0.14 0.00 -2.06 0.00 0.00 59.70 56.70 2dsc h MET 132 Cb 1.21 0.08 -0.16 0.00 0.06 0.00 0.00 31.60 32.79 2dsc h MET 132 CO 0.70 0.99 -0.44 -3.47 1.06 0.00 0.00 176.91 175.75 2dsc n ASP 133 N -4.33 -3.10 0.18 1.22 2.03 -1.26 -5.05 116.55 106.24 2dsc n ASP 133 Ca -0.09 -2.74 0.19 0.00 0.52 0.00 0.00 54.79 52.67 2dsc n ASP 133 Cb 0.56 1.63 0.79 0.00 -0.72 0.00 0.00 41.12 43.39 2dsc n ASP 133 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 2dsc h PRO 134 N 4.69 0.00 -0.00 -0.67 0.13 -1.83 0.77 132.00 135.09 2dsc h PRO 134 Ca 0.01 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.14 2dsc h PRO 134 Cb 1.11 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.24 2dsc h PRO 134 CO 0.05 0.00 -0.17 0.41 -0.23 0.00 0.00 178.00 178.06 2dsc n GLY 135 N -1.40 -1.24 0.17 1.56 0.00 -1.26 -4.35 105.19 98.67 2dsc n GLY 135 Ca 0.04 -0.22 0.00 0.00 0.00 0.00 0.00 46.02 45.83 2dsc n GLY 135 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2dsc n LEU 136 N -1.31 2.27 -4.27 0.99 7.94 -0.43 -4.98 117.00 117.21 2dsc n LEU 136 Ca 0.09 0.00 -0.18 0.00 -1.11 0.00 0.00 56.01 54.82 2dsc n LEU 136 Cb 0.31 0.00 -0.09 0.00 0.53 0.00 0.00 43.42 44.18 2dsc n LEU 136 CO 0.28 0.37 -0.15 -0.94 -1.11 0.00 0.00 177.39 175.84 2dsc s SER 137 N -4.06 1.32 0.00 1.96 1.04 0.13 -0.70 113.70 113.40 2dsc s SER 137 Ca 0.00 -1.66 0.21 0.00 0.48 0.00 0.00 55.95 54.98 2dsc s SER 137 Cb 0.00 0.51 0.52 0.00 0.10 0.00 0.00 66.02 67.15 2dsc s SER 137 CO 0.00 -1.00 1.44 -0.46 0.98 0.00 0.00 173.24 174.20 2dsc n ASN 138 N -1.21 3.64 -4.72 7.02 6.94 -1.13 -4.11 115.26 121.68 2dsc n ASN 138 Ca 0.06 -1.98 -0.43 0.00 -0.02 0.00 0.00 54.58 52.21 2dsc n ASN 138 Cb 0.63 -0.38 -0.02 0.00 -2.36 0.00 0.00 39.78 37.66 2dsc n ASN 138 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2dsc s THR 140 N -0.00 0.40 0.18 0.00 -4.23 -1.26 -1.39 115.64 109.33 2dsc s THR 140 Ca 0.65 -1.85 -0.11 0.00 -1.18 0.00 0.00 61.69 59.20 2dsc s THR 140 Cb -0.54 -1.57 0.00 0.00 1.34 0.00 0.00 72.50 71.73 2dsc s THR 140 CO 0.49 -0.95 0.36 0.27 -0.54 0.00 0.00 174.62 174.25 2dsc s ILE 141 N -3.78 0.05 -0.14 2.99 -4.36 -0.18 -1.43 121.20 114.34 2dsc s ILE 141 Ca 0.09 -1.25 -0.04 0.00 -0.26 0.00 0.00 60.65 59.19 2dsc s ILE 141 Cb 0.07 -1.83 -0.03 0.00 1.25 0.00 0.00 42.46 41.92 2dsc s ILE 141 CO -0.08 -0.22 0.00 -1.00 0.24 0.00 0.00 174.94 173.89 2dsc s HIS 142 N -3.95 3.13 -0.31 1.37 3.76 -0.61 -0.06 115.29 118.62 2dsc s HIS 142 Ca 0.16 -0.03 -0.12 0.00 -0.15 0.00 0.00 55.06 54.93 2dsc s HIS 142 Cb 0.02 -1.93 -0.03 0.00 1.11 0.00 0.00 32.58 31.75 2dsc s HIS 142 CO 0.00 0.20 0.22 0.42 -0.85 0.00 0.00 174.74 174.73 2dsc s ILE 143 N -0.09 5.28 -0.23 0.60 1.01 -1.26 -1.10 121.20 125.41 2dsc s ILE 143 Ca 0.04 -0.06 -0.04 0.00 0.00 0.00 0.00 60.65 60.59 2dsc s ILE 143 Cb -0.13 -3.63 0.00 0.00 0.01 0.00 0.00 42.46 38.71 2dsc s ILE 143 CO 0.02 0.10 -0.04 -0.69 0.00 0.00 0.00 174.94 174.33 2dsc s VAL 144 N 1.74 3.29 -0.19 2.92 1.01 0.06 -1.42 120.40 127.80 2dsc s VAL 144 Ca 0.06 -0.63 -0.26 0.00 0.00 0.00 0.00 61.98 61.15 2dsc s VAL 144 Cb -0.17 -2.54 -0.01 0.00 0.00 0.00 0.00 36.38 33.66 2dsc s VAL 144 CO 0.11 0.35 0.90 -0.89 0.00 0.00 0.00 175.10 175.57 2dsc s THR 145 N 1.45 4.81 -0.10 3.92 2.01 0.02 -1.53 115.64 126.22 2dsc s THR 145 Ca 0.04 1.76 0.02 0.00 0.31 0.00 0.00 61.69 63.83 2dsc s THR 145 Cb -0.15 -4.19 0.01 0.00 0.01 0.00 0.00 72.50 68.18 2dsc s THR 145 CO -0.03 -0.05 -0.16 -0.69 -0.69 0.00 0.00 174.62 173.00 2dsc s VAL 146 N 2.55 1.50 0.00 3.82 1.01 -0.04 -0.82 120.40 128.43 2dsc s VAL 146 Ca 0.40 -0.66 -0.12 0.00 0.00 0.00 0.00 61.98 61.60 2dsc s VAL 146 Cb -0.16 -1.35 -0.05 0.00 0.00 0.00 0.00 36.38 34.81 2dsc s VAL 146 CO 0.10 0.44 0.36 0.42 0.00 0.00 0.00 175.10 176.42 2dsc s THR 147 N 0.80 5.13 -0.19 3.92 -4.23 -0.34 -0.29 115.64 120.44 2dsc s THR 147 Ca -0.11 0.62 0.01 0.00 -1.18 0.00 0.00 61.69 61.03 2dsc s THR 147 Cb -0.16 -3.64 0.02 0.00 1.34 0.00 0.00 72.50 70.06 2dsc s THR 147 CO 0.02 0.50 -0.19 -0.63 -0.54 0.00 0.00 174.62 173.78 2dsc s ILE 148 N -1.16 2.11 -0.72 2.99 1.01 0.87 -0.84 121.20 125.46 2dsc s ILE 148 Ca 0.25 -0.96 -0.27 0.00 0.00 0.00 0.00 60.65 59.67 2dsc s ILE 148 Cb -0.15 -1.90 0.02 0.00 0.01 0.00 0.00 42.46 40.43 2dsc s ILE 148 CO 0.13 0.51 1.43 0.21 0.00 0.00 0.00 174.94 177.22 2dsc s ASN 149 N 1.29 5.94 0.00 3.58 3.84 -1.26 -0.14 114.94 128.18 2dsc s ASN 149 Ca 0.04 -0.28 0.17 0.00 0.21 0.00 0.00 52.86 53.00 2dsc s ASN 149 Cb -0.13 -2.55 0.80 0.00 -0.55 0.00 0.00 41.25 38.81 2dsc s ASN 149 CO -0.12 -1.97 1.51 0.61 -2.79 0.00 0.00 177.10 174.33 2dsc n GLY 150 N 5.50 -0.94 0.27 1.21 0.00 0.21 -2.41 105.19 109.04 2dsc n GLY 150 Ca 0.08 -0.07 0.12 0.00 0.00 0.00 0.00 46.02 46.15 2dsc n GLY 150 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2dsc n ASP 151 N -1.37 1.33 -4.72 1.61 8.00 -1.25 -4.71 116.55 115.43 2dsc n ASP 151 Ca 0.06 -1.06 -0.42 0.00 0.71 0.00 0.00 54.79 54.09 2dsc n ASP 151 Cb 0.16 0.40 -0.04 0.00 -0.02 0.00 0.00 41.12 41.63 2dsc n ASP 151 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2dsc s ASP 152 N -2.63 7.40 0.54 -2.24 -1.08 -1.01 -4.90 116.67 112.74 2dsc s ASP 152 Ca 0.18 1.74 0.26 0.00 -0.52 0.00 0.00 52.55 54.22 2dsc s ASP 152 Cb 0.18 -2.58 1.42 0.00 -1.46 0.00 0.00 42.92 40.48 2dsc s ASP 152 CO 0.61 -0.20 1.98 0.00 0.52 0.00 0.00 175.17 178.08 2dsc h ALA 153 N 6.30 2.52 -0.63 3.66 0.00 -1.90 0.30 119.26 129.51 2dsc h ALA 153 Ca -0.42 -0.02 0.17 0.00 0.00 0.00 0.00 54.91 54.64 2dsc h ALA 153 Cb 1.22 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 19.02 2dsc h ALA 153 CO 0.74 -0.71 0.44 1.49 0.00 0.00 0.00 179.25 181.22 2dsc h GLU 154 N 0.00 0.07 -0.23 0.00 4.81 -1.92 -1.09 114.58 116.22 2dsc h GLU 154 Ca 0.27 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.50 2dsc h GLU 154 Cb 1.10 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.47 2dsc h GLU 154 CO -0.00 0.05 0.00 0.09 -0.73 0.00 0.00 179.01 178.41 2dsc n ASN 155 N -4.38 3.56 0.26 1.04 3.02 0.11 -4.75 115.26 114.12 2dsc n ASN 155 Ca 0.12 -2.89 -0.13 0.00 -0.03 0.00 0.00 54.58 51.65 2dsc n ASN 155 Cb 0.65 -0.49 -0.06 0.00 -0.61 0.00 0.00 39.78 39.27 2dsc n ASN 155 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2dsc h ALA 156 N 1.58 -1.12 -2.97 5.41 0.00 -1.05 -3.38 119.26 117.74 2dsc h ALA 156 Ca 0.00 -0.16 -0.61 0.00 0.00 0.00 0.00 54.91 54.14 2dsc h ALA 156 Cb 1.29 0.46 -0.40 0.00 0.00 0.00 0.00 17.79 19.14 2dsc h ALA 156 CO 0.17 -1.10 -0.72 -0.98 0.00 0.00 0.00 179.25 176.62 2dsc s ARG 157 N -4.86 1.54 0.18 0.00 1.70 -1.26 -5.11 118.95 111.14 2dsc s ARG 157 Ca -0.12 -2.35 -0.31 0.00 -0.47 0.00 0.00 55.73 52.48 2dsc s ARG 157 Cb 0.02 -2.54 -0.09 0.00 -0.57 0.00 0.00 34.95 31.77 2dsc s ARG 157 CO 0.38 -1.21 1.46 -1.25 -1.08 0.00 0.00 175.30 173.61 2dsc s PRO 158 N -0.10 4.27 -0.20 3.89 0.04 -1.26 -5.03 135.00 136.61 2dsc s PRO 158 Ca 0.21 2.25 -0.00 0.00 0.04 0.00 0.00 61.00 63.49 2dsc s PRO 158 Cb -0.17 -3.17 0.02 0.00 0.04 0.00 0.00 34.50 31.21 2dsc s PRO 158 CO -0.06 -0.48 -0.15 0.15 0.04 0.00 0.00 177.00 176.51 2dsc s LYS 159 N 0.61 3.04 0.25 4.56 1.02 -1.26 -4.80 119.74 123.16 2dsc s LYS 159 Ca 0.65 -0.81 -0.30 0.00 0.02 0.00 0.00 55.97 55.53 2dsc s LYS 159 Cb -0.41 -2.73 -0.09 0.00 -0.52 0.00 0.00 37.83 34.08 2dsc s LYS 159 CO 0.35 -0.24 0.97 -1.25 -0.92 0.00 0.00 175.35 174.27 2dsc s PRO 160 N 1.33 4.80 -0.77 -1.68 0.04 -1.26 -4.05 135.00 133.41 2dsc s PRO 160 Ca 0.04 1.55 -0.11 0.00 0.04 0.00 0.00 61.00 62.52 2dsc s PRO 160 Cb -0.14 -3.23 0.20 0.00 0.04 0.00 0.00 34.50 31.37 2dsc s PRO 160 CO -0.10 0.44 0.67 0.15 0.04 0.00 0.00 177.00 178.21 2dsc s LYS 161 N -1.29 3.30 0.11 4.56 3.01 0.10 -4.94 119.74 124.59 2dsc s LYS 161 Ca 0.42 -2.49 -0.18 0.00 -1.01 0.00 0.00 55.97 52.71 2dsc s LYS 161 Cb -0.27 -4.22 -0.07 0.00 -1.01 0.00 0.00 37.83 32.26 2dsc s LYS 161 CO 0.33 -1.26 0.59 -1.25 0.51 0.00 0.00 175.35 174.27 2dsc s PRO 162 N 0.09 4.17 0.68 -1.68 0.04 -1.26 -4.60 135.00 132.44 2dsc s PRO 162 Ca 0.18 0.71 -0.05 0.00 0.04 0.00 0.00 61.00 61.87 2dsc s PRO 162 Cb -0.13 -3.13 0.14 0.00 0.04 0.00 0.00 34.50 31.42 2dsc s PRO 162 CO -0.07 0.58 0.93 0.41 0.04 0.00 0.00 177.00 178.88 2dsc n GLY 163 N 1.40 -0.13 3.77 0.56 0.00 -1.26 -4.99 105.19 104.54 2dsc n GLY 163 Ca -0.08 -1.90 -0.39 0.00 0.00 0.00 0.00 46.02 43.64 2dsc n GLY 163 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2dsc s ASP 164 N -4.61 6.95 0.00 1.61 -1.08 -1.26 -2.67 116.67 115.61 2dsc s ASP 164 Ca 0.58 2.34 0.00 0.00 -0.52 0.00 0.00 52.55 54.95 2dsc s ASP 164 Cb -0.03 -2.62 0.00 0.00 -1.46 0.00 0.00 42.92 38.81 2dsc s ASP 164 CO 0.39 -0.37 0.00 0.61 0.52 0.00 0.00 175.17 176.32 2dsc n GLY 165 N 0.90 0.40 3.19 2.66 0.00 -1.26 -4.98 105.19 106.10 2dsc n GLY 165 Ca 0.01 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.68 2dsc n GLY 165 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2dsc s GLU 166 N -0.54 2.54 -0.43 1.61 2.12 -1.09 -5.04 118.70 117.86 2dsc s GLU 166 Ca 0.00 -1.19 0.03 0.00 0.36 0.00 0.00 54.97 54.17 2dsc s GLU 166 Cb 0.00 -3.17 0.12 0.00 0.26 0.00 0.00 34.13 31.34 2dsc s GLU 166 CO 0.00 -0.58 0.19 -0.06 -0.54 0.00 0.00 175.26 174.27 2dsc s PHE 167 N 1.28 2.82 -0.05 5.30 0.40 -1.26 -4.62 117.98 121.86 2dsc s PHE 167 Ca -0.04 -2.77 0.04 0.00 -0.60 0.00 0.00 56.93 53.56 2dsc s PHE 167 Cb -0.19 -2.47 -0.02 0.00 0.51 0.00 0.00 43.02 40.85 2dsc s PHE 167 CO -0.01 -0.81 -0.17 0.08 0.70 0.00 0.00 175.22 175.00 2dsc s VAL 168 N 0.37 2.84 -0.12 -0.44 1.01 -1.26 -4.56 120.40 118.24 2dsc s VAL 168 Ca 0.15 -0.80 -0.02 0.00 0.00 0.00 0.00 61.98 61.30 2dsc s VAL 168 Cb -0.23 -2.09 -0.03 0.00 0.00 0.00 0.00 36.38 34.03 2dsc s VAL 168 CO -0.05 0.59 -0.03 -0.70 0.00 0.00 0.00 175.10 174.91 2dsc s GLU 169 N -0.64 3.26 -0.15 2.72 2.12 -0.07 -4.95 118.70 120.98 2dsc s GLU 169 Ca 0.10 -0.49 -0.16 0.00 0.36 0.00 0.00 54.97 54.78 2dsc s GLU 169 Cb -0.11 -2.81 -0.04 0.00 0.26 0.00 0.00 34.13 31.43 2dsc s GLU 169 CO 0.01 0.48 0.41 0.08 -0.54 0.00 0.00 175.26 175.70 2dsc s VAL 170 N -0.28 5.22 -0.09 3.70 1.01 -1.26 -0.09 120.40 128.60 2dsc s VAL 170 Ca 0.05 0.78 -0.00 0.00 0.00 0.00 0.00 61.98 62.81 2dsc s VAL 170 Cb -0.12 -3.75 0.02 0.00 0.00 0.00 0.00 36.38 32.53 2dsc s VAL 170 CO 0.02 0.32 -0.05 -0.63 0.00 0.00 0.00 175.10 174.76 2dsc s ILE 171 N 0.81 0.79 -0.18 2.22 1.01 0.23 -4.97 121.20 121.10 2dsc s ILE 171 Ca 0.22 -0.16 -0.04 0.00 0.00 0.00 0.00 60.65 60.66 2dsc s ILE 171 Cb -0.14 -0.85 -0.02 0.00 0.01 0.00 0.00 42.46 41.45 2dsc s ILE 171 CO 0.08 0.32 -0.01 -0.44 0.00 0.00 0.00 174.94 174.89 2dsc s SER 172 N 1.66 4.81 0.07 3.58 0.01 -1.26 0.14 113.70 122.71 2dsc s SER 172 Ca 0.03 -0.18 0.09 0.00 1.31 0.00 0.00 55.95 57.20 2dsc s SER 172 Cb -0.13 -1.81 -0.03 0.00 0.21 0.00 0.00 66.02 64.26 2dsc s SER 172 CO -0.06 0.10 -0.24 -0.76 0.41 0.00 0.00 173.24 172.69 2dsc s LEU 173 N 0.77 2.22 0.18 2.44 1.43 -0.39 -4.90 118.68 120.43 2dsc s LEU 173 Ca -0.00 -0.62 -0.32 0.00 -1.03 0.00 0.00 54.13 52.15 2dsc s LEU 173 Cb -0.14 -1.13 -0.12 0.00 0.03 0.00 0.00 46.19 44.83 2dsc s LEU 173 CO 0.02 0.18 1.70 -2.65 0.23 0.00 0.00 176.35 175.84 2dsc n PRO 174 N 1.50 2.63 0.09 1.29 -0.02 -1.26 0.38 135.00 139.60 2dsc n PRO 174 Ca -0.18 0.95 -0.03 0.00 -2.02 0.00 0.00 63.50 62.23 2dsc n PRO 174 Cb 0.53 -2.78 0.21 0.00 -0.02 0.00 0.00 33.50 31.43 2dsc n PRO 174 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 2dsc h LYS 175 N 6.79 0.25 0.00 -0.52 3.64 -1.49 -1.80 116.57 123.44 2dsc h LYS 175 Ca -0.44 -0.13 0.00 0.00 -1.27 0.00 0.00 60.65 58.82 2dsc h LYS 175 Cb 1.22 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.04 2dsc h LYS 175 CO 0.94 0.64 0.00 0.27 -2.27 0.00 0.00 179.45 179.03 2dsc n ASN 176 N -4.01 0.29 -1.21 4.20 6.94 -1.26 -3.16 115.26 117.05 2dsc n ASN 176 Ca -0.02 0.58 0.01 0.00 -0.02 0.00 0.00 54.58 55.14 2dsc n ASN 176 Cb 0.49 -0.64 -0.00 0.00 -2.36 0.00 0.00 39.78 37.27 2dsc n ASN 176 CO 0.00 0.00 0.00 -0.67 -1.03 0.00 0.00 177.26 175.56 2dsc n ASP 177 N -1.84 0.43 -0.15 0.53 4.64 -1.13 -4.99 116.55 114.05 2dsc n ASP 177 Ca 0.02 -1.96 -0.06 0.00 -1.38 0.00 0.00 54.79 51.41 2dsc n ASP 177 Cb 0.16 -0.16 -0.00 0.00 -1.04 0.00 0.00 41.12 40.08 2dsc n ASP 177 CO 0.00 0.00 0.00 0.25 -0.82 0.00 0.00 177.20 176.63 2dsc h LEU 178 N 0.62 -1.04 -0.24 -2.67 5.85 -1.28 -1.15 115.31 115.40 2dsc h LEU 178 Ca -0.25 0.20 0.04 0.00 0.84 0.00 0.00 57.88 58.71 2dsc h LEU 178 Cb 1.69 0.51 -0.04 0.00 0.37 0.00 0.00 40.66 43.19 2dsc h LEU 178 CO 0.01 -0.30 -0.03 0.25 -0.34 0.00 0.00 178.44 178.03 2dsc h LEU 179 N -0.20 -0.15 -0.83 2.25 5.85 -1.89 0.87 115.31 121.21 2dsc h LEU 179 Ca 0.20 0.06 -0.10 0.00 0.84 0.00 0.00 57.88 58.89 2dsc h LEU 179 Cb 0.53 0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.66 2dsc h LEU 179 CO -0.58 -0.05 -0.17 1.56 -0.34 0.00 0.00 178.44 178.85 2dsc h GLN 180 N 0.04 0.69 -0.04 1.25 7.50 -1.90 -1.42 115.11 121.23 2dsc h GLN 180 Ca 0.12 -0.25 -0.10 0.00 0.50 0.00 0.00 58.65 58.92 2dsc h GLN 180 Cb 0.16 -0.05 -0.01 0.00 0.05 0.00 0.00 27.48 27.63 2dsc h GLN 180 CO -0.22 0.82 -0.44 0.00 -1.50 0.00 0.00 178.83 177.49 2dsc h ARG 181 N 0.61 0.08 -0.33 1.46 2.47 -0.64 -0.36 114.38 117.68 2dsc h ARG 181 Ca 0.10 -0.04 -0.16 0.00 -1.26 0.00 0.00 59.98 58.61 2dsc h ARG 181 Cb 0.64 -0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 28.96 2dsc h ARG 181 CO 0.05 0.51 -0.43 -0.07 0.56 0.00 0.00 179.97 180.59 2dsc h LEU 182 N 0.07 0.95 -0.87 3.04 3.38 -0.48 -2.14 115.31 119.26 2dsc h LEU 182 Ca 0.00 -0.49 -0.02 0.00 0.09 0.00 0.00 57.88 57.46 2dsc h LEU 182 Cb 0.81 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 41.25 2dsc h LEU 182 CO 0.06 1.26 0.47 0.44 0.09 0.00 0.00 178.44 180.76 2dsc h ASP 183 N 0.67 1.09 -0.66 -0.43 3.32 -0.82 -1.46 116.42 118.12 2dsc h ASP 183 Ca 0.04 -0.10 -0.02 0.00 0.02 0.00 0.00 57.03 56.96 2dsc h ASP 183 Cb 1.03 -0.28 -0.03 0.00 0.22 0.00 0.00 39.33 40.27 2dsc h ASP 183 CO 0.10 0.88 0.32 0.00 -1.72 0.00 0.00 179.24 178.82 2dsc h ALA 184 N 1.25 0.85 -0.72 3.45 0.00 -0.90 -0.81 119.26 122.38 2dsc h ALA 184 Ca 0.30 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 55.03 2dsc h ALA 184 Cb 0.04 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.54 2dsc h ALA 184 CO -0.05 0.40 0.26 -0.07 0.00 0.00 0.00 179.25 179.80 2dsc h LEU 185 N 0.91 1.00 -1.22 0.00 3.38 -0.96 -2.34 115.31 116.08 2dsc h LEU 185 Ca 0.23 -0.16 -0.05 0.00 0.09 0.00 0.00 57.88 57.98 2dsc h LEU 185 Cb 0.11 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.59 2dsc h LEU 185 CO -0.03 0.91 -0.25 0.58 0.09 0.00 0.00 178.44 179.74 2dsc h VAL 186 N 1.05 0.67 0.00 1.22 2.07 -0.79 -2.82 116.25 117.66 2dsc h VAL 186 Ca 0.24 -1.13 0.00 0.00 0.82 0.00 0.00 66.70 66.63 2dsc h VAL 186 Cb 0.24 1.73 0.00 0.00 -1.52 0.00 0.00 31.29 31.74 2dsc h VAL 186 CO -0.02 0.25 0.00 0.00 0.02 0.00 0.00 177.57 177.82 2dsc h ALA 187 N 1.75 1.00 0.09 1.67 0.00 -0.61 -3.30 119.26 119.87 2dsc h ALA 187 Ca -0.00 0.00 -0.26 0.00 0.00 0.00 0.00 54.91 54.65 2dsc h ALA 187 Cb 0.71 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.50 2dsc h ALA 187 CO 0.03 0.00 -1.15 0.93 0.00 0.00 0.00 179.25 179.06 2dsc h GLU 188 N 0.00 0.30 -2.74 0.00 5.08 -1.29 -3.49 114.58 112.44 2dsc h GLU 188 Ca 0.00 -0.44 0.10 0.00 -1.00 0.00 0.00 59.36 58.01 2dsc h GLU 188 Cb 0.87 0.16 -0.07 0.00 0.50 0.00 0.00 28.75 30.20 2dsc h GLU 188 CO 0.00 1.18 0.32 -1.83 -1.00 0.00 0.00 179.01 177.68 2dsc s GLU 189 N -2.83 1.48 -0.14 2.33 -1.05 -1.24 -5.11 118.70 112.14 2dsc s GLU 189 Ca -0.04 -0.78 -0.29 0.00 -0.15 0.00 0.00 54.97 53.71 2dsc s GLU 189 Cb 0.08 0.53 -0.04 0.00 -0.44 0.00 0.00 34.13 34.25 2dsc s GLU 189 CO 0.88 -0.67 1.71 -1.58 0.95 0.00 0.00 175.26 176.54 2dsc s HIS 190 N -3.65 1.91 -0.04 4.83 5.65 -1.26 -4.63 115.29 118.11 2dsc s HIS 190 Ca 0.10 0.35 -0.12 0.00 0.25 0.00 0.00 55.06 55.63 2dsc s HIS 190 Cb -0.04 -3.98 0.02 0.00 -1.18 0.00 0.00 32.58 27.41 2dsc s HIS 190 CO 0.02 -3.56 0.27 -0.51 -0.65 0.00 0.00 174.74 170.32 2dsc s LEU 191 N 5.03 0.98 -0.16 8.88 1.43 -1.26 -4.67 118.68 128.91 2dsc s LEU 191 Ca 0.76 0.19 0.00 0.00 -1.03 0.00 0.00 54.13 54.05 2dsc s LEU 191 Cb -0.30 1.08 -0.00 0.00 0.03 0.00 0.00 46.19 47.00 2dsc s LEU 191 CO 0.31 -0.33 -0.15 -0.89 0.23 0.00 0.00 176.35 175.52 2dsc s THR 192 N -0.88 2.65 0.05 5.49 2.01 -0.87 -4.93 115.64 119.16 2dsc s THR 192 Ca -0.10 -0.77 -0.20 0.00 0.31 0.00 0.00 61.69 60.93 2dsc s THR 192 Cb -0.05 -2.12 -0.06 0.00 0.01 0.00 0.00 72.50 70.28 2dsc s THR 192 CO 0.03 0.51 0.58 -0.69 -0.69 0.00 0.00 174.62 174.36 2dsc s VAL 193 N 0.83 4.78 0.36 3.82 1.01 -1.26 -0.52 120.40 129.42 2dsc s VAL 193 Ca -0.05 1.24 -0.27 0.00 0.00 0.00 0.00 61.98 62.90 2dsc s VAL 193 Cb -0.15 -3.92 -0.09 0.00 0.00 0.00 0.00 36.38 32.22 2dsc s VAL 193 CO -0.00 0.51 1.27 -0.62 0.00 0.00 0.00 175.10 176.26 2dsc s ASP 194 N -0.82 6.64 0.50 3.32 2.15 -0.23 -4.87 116.67 123.35 2dsc s ASP 194 Ca 0.30 2.60 0.15 0.00 0.43 0.00 0.00 52.55 56.02 2dsc s ASP 194 Cb -0.19 -2.64 1.20 0.00 -0.30 0.00 0.00 42.92 40.98 2dsc s ASP 194 CO 0.19 -0.62 2.12 0.00 -0.17 0.00 0.00 175.17 176.69 2dsc h ALA 195 N 3.09 1.98 -0.16 3.66 0.00 -1.96 -0.37 119.26 125.50 2dsc h ALA 195 Ca -0.49 -0.01 -0.20 0.00 0.00 0.00 0.00 54.91 54.21 2dsc h ALA 195 Cb 1.23 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 19.00 2dsc h ALA 195 CO 0.64 0.00 -0.68 0.00 0.00 0.00 0.00 179.25 179.22 2dsc h ARG 196 N 0.12 0.75 -0.29 0.00 3.08 -1.97 -0.11 114.38 115.96 2dsc h ARG 196 Ca 0.05 -0.59 -0.02 0.00 0.07 0.00 0.00 59.98 59.50 2dsc h ARG 196 Cb 0.07 0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.22 2dsc h ARG 196 CO -0.01 1.20 0.11 0.28 -1.07 0.00 0.00 179.97 180.48 2dsc h VAL 197 N 0.46 1.18 -0.65 2.04 2.07 -1.73 -1.64 116.25 117.98 2dsc h VAL 197 Ca -0.04 -0.54 -0.07 0.00 0.82 0.00 0.00 66.70 66.87 2dsc h VAL 197 Cb 1.31 1.01 -0.03 0.00 -1.52 0.00 0.00 31.29 32.06 2dsc h VAL 197 CO 0.14 0.19 0.14 0.22 0.02 0.00 0.00 177.57 178.28 2dsc h TYR 198 N 0.31 1.12 -0.87 1.57 3.20 -1.07 -0.55 116.97 120.67 2dsc h TYR 198 Ca 0.10 -0.14 0.01 0.00 3.14 0.00 0.00 58.73 61.83 2dsc h TYR 198 Cb 0.18 -0.31 -0.04 0.00 1.54 0.00 0.00 36.73 38.10 2dsc h TYR 198 CO -0.01 0.93 0.57 0.77 -1.64 0.00 0.00 178.16 178.79 2dsc h SER 199 N 0.98 1.01 0.19 -2.11 0.02 -0.91 0.57 113.55 113.30 2dsc h SER 199 Ca 0.20 -0.03 -0.01 0.00 -0.84 0.00 0.00 61.79 61.11 2dsc h SER 199 Cb 0.39 -0.25 0.00 0.00 0.14 0.00 0.00 62.40 62.68 2dsc h SER 199 CO 0.01 0.74 -0.09 0.22 -1.14 0.00 0.00 176.83 176.57 2dsc h TYR 200 N 1.19 -0.23 -0.88 3.45 3.20 -0.86 -1.48 116.97 121.35 2dsc h TYR 200 Ca 0.32 -0.01 0.05 0.00 3.14 0.00 0.00 58.73 62.23 2dsc h TYR 200 Cb -0.12 0.08 -0.06 0.00 1.54 0.00 0.00 36.73 38.17 2dsc h TYR 200 CO -0.01 -0.06 0.56 0.00 -1.64 0.00 0.00 178.16 177.01 2dsc h ALA 201 N 0.44 1.19 -0.03 1.82 0.00 -0.78 -2.12 119.26 119.78 2dsc h ALA 201 Ca -0.03 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 2dsc h ALA 201 Cb 0.28 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 2dsc h ALA 201 CO 0.04 0.36 0.02 -0.07 0.00 0.00 0.00 179.25 179.60 2dsc h LEU 202 N 1.05 0.04 -1.49 0.00 3.38 -0.73 -2.83 115.31 114.72 2dsc h LEU 202 Ca 0.37 -0.04 0.02 0.00 0.09 0.00 0.00 57.88 58.32 2dsc h LEU 202 Cb 0.09 -0.01 -0.03 0.00 0.09 0.00 0.00 40.66 40.80 2dsc h LEU 202 CO -0.15 0.06 0.36 0.00 0.09 0.00 0.00 178.44 178.81 2dsc h ALA 203 N 0.97 1.67 -0.52 1.53 0.00 -0.86 -0.03 119.26 122.02 2dsc h ALA 203 Ca 0.01 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 54.91 2dsc h ALA 203 Cb 0.03 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 2dsc h ALA 203 CO -0.00 0.29 0.34 -0.07 0.00 0.00 0.00 179.25 179.81 2dsc h LEU 204 N 0.68 0.55 0.15 0.00 3.38 -1.15 0.19 115.31 119.11 2dsc h LEU 204 Ca 0.21 -0.01 -0.22 0.00 0.09 0.00 0.00 57.88 57.95 2dsc h LEU 204 Cb 0.00 -0.13 0.02 0.00 0.09 0.00 0.00 40.66 40.64 2dsc h LEU 204 CO -0.05 0.39 -0.98 0.50 0.09 0.00 0.00 178.44 178.39 2dsc h LYS 205 N 0.65 0.32 0.00 1.13 3.64 -1.13 -3.34 116.57 117.84 2dsc h LYS 205 Ca 0.20 -0.55 -0.05 0.00 -1.27 0.00 0.00 60.65 58.98 2dsc h LYS 205 Cb 0.00 0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 32.02 2dsc h LYS 205 CO -0.05 1.26 -0.23 0.45 -2.27 0.00 0.00 179.45 178.61 2dsc h HIS 206 N -0.30 0.00 0.19 1.91 3.86 -0.70 -3.20 115.15 116.91 2dsc h HIS 206 Ca -0.18 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.02 2dsc h HIS 206 Cb 1.72 0.00 0.00 0.00 1.06 0.00 0.00 27.41 30.19 2dsc h HIS 206 CO 0.18 0.23 -0.09 0.00 0.86 0.00 0.00 177.93 179.11 2dsc h ALA 207 N 1.77 -0.26 0.00 2.45 0.00 -0.75 -3.50 119.26 118.96 2dsc h ALA 207 Ca -0.00 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2dsc h ALA 207 Cb 0.48 0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.37 2dsc h ALA 207 CO 0.03 -0.65 0.00 0.27 0.00 0.00 0.00 179.25 178.90