#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dsd s GLN 15 N 0.00 1.41 0.09 -1.58 -0.21 -1.26 -4.28 119.66 113.83 2dsd s GLN 15 Ca 0.00 -0.26 0.06 0.00 0.02 0.00 0.00 55.36 55.18 2dsd s GLN 15 Cb 0.00 -1.36 -0.03 0.00 1.00 0.00 0.00 33.01 32.62 2dsd s GLN 15 CO 0.00 -0.13 -0.15 0.71 -2.12 0.00 0.00 175.29 173.59 2dsd s TYR 16 N 1.23 1.36 0.02 0.91 1.51 -1.22 -4.96 117.35 116.20 2dsd s TYR 16 Ca -0.05 -0.48 -0.30 0.00 -1.01 0.00 0.00 57.07 55.23 2dsd s TYR 16 Cb -0.14 -0.75 -0.04 0.00 -0.11 0.00 0.00 41.96 40.92 2dsd s TYR 16 CO -0.02 0.10 1.07 0.42 -1.11 0.00 0.00 175.55 176.02 2dsd s ILE 17 N -1.49 4.52 -0.19 2.71 -1.09 -1.26 -0.72 121.20 123.68 2dsd s ILE 17 Ca 0.02 1.81 -0.18 0.00 -2.23 0.00 0.00 60.65 60.07 2dsd s ILE 17 Cb -0.09 -4.16 -0.21 0.00 -1.58 0.00 0.00 42.46 36.43 2dsd s ILE 17 CO 0.03 0.13 0.23 -0.38 -1.23 0.00 0.00 174.94 173.72 2dsd n ILE 18 N 3.96 1.59 -3.57 2.92 5.41 0.21 -4.93 119.36 124.95 2dsd n ILE 18 Ca 0.07 -0.18 -0.10 0.00 1.00 0.00 0.00 62.75 63.54 2dsd n ILE 18 Cb 0.49 -1.97 -0.02 0.00 -0.71 0.00 0.00 39.64 37.43 2dsd n ILE 18 CO 0.00 0.00 0.00 -0.94 0.00 0.00 0.00 176.55 175.61 2dsd s SER 19 N -6.92 -0.45 -0.37 4.38 1.04 -1.01 -5.00 113.70 105.37 2dsd s SER 19 Ca -0.28 -0.20 0.01 0.00 0.48 0.00 0.00 55.95 55.96 2dsd s SER 19 Cb 0.06 0.62 0.12 0.00 0.10 0.00 0.00 66.02 66.92 2dsd s SER 19 CO 0.63 -1.05 0.18 -1.61 0.98 0.00 0.00 173.24 172.37 2dsd s GLU 20 N -3.74 0.92 -0.34 4.02 2.02 -1.26 -0.80 118.70 119.53 2dsd s GLU 20 Ca 0.05 -1.51 -0.23 0.00 0.02 0.00 0.00 54.97 53.29 2dsd s GLU 20 Cb -0.02 -1.99 0.00 0.00 0.10 0.00 0.00 34.13 32.22 2dsd s GLU 20 CO -0.06 -1.10 0.77 -2.00 0.02 0.00 0.00 175.26 172.88 2dsd s GLU 21 N 0.98 3.84 0.71 1.61 2.12 -0.26 -4.88 118.70 122.81 2dsd s GLU 21 Ca 0.15 0.41 -0.16 0.00 0.36 0.00 0.00 54.97 55.73 2dsd s GLU 21 Cb -0.21 -3.77 0.02 0.00 0.26 0.00 0.00 34.13 30.42 2dsd s GLU 21 CO -0.09 -0.76 1.23 -0.11 -0.54 0.00 0.00 175.26 174.98 2dsd n LEU 22 N 6.29 5.24 0.00 2.70 -0.00 -1.26 -0.38 117.00 129.59 2dsd n LEU 22 Ca 0.03 0.74 0.00 0.00 -0.00 0.00 0.00 56.01 56.77 2dsd n LEU 22 Cb 0.48 -1.52 0.00 0.00 -0.00 0.00 0.00 43.42 42.38 2dsd n LEU 22 CO 0.52 -1.34 -0.34 -0.38 -0.00 0.00 0.00 177.39 175.85 2dsd n ILE 23 N -2.41 0.00 -3.94 1.96 5.41 -0.42 -4.74 119.36 115.21 2dsd n ILE 23 Ca 0.15 0.00 -0.09 0.00 1.00 0.00 0.00 62.75 63.81 2dsd n ILE 23 Cb 0.49 -0.37 -0.03 0.00 -0.71 0.00 0.00 39.64 39.02 2dsd n ILE 23 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 176.55 176.00 2dsd s SER 24 N -3.56 -0.03 0.28 4.38 0.15 -0.72 -4.99 113.70 109.20 2dsd s SER 24 Ca 0.00 -0.92 0.02 0.00 0.70 0.00 0.00 55.95 55.75 2dsd s SER 24 Cb 0.00 0.67 -0.03 0.00 -1.71 0.00 0.00 66.02 64.95 2dsd s SER 24 CO 0.00 -1.28 0.27 -0.70 1.20 0.00 0.00 173.24 172.73 2dsd s GLU 25 N -3.69 1.58 0.03 5.44 2.56 -1.26 -2.89 118.70 120.46 2dsd s GLU 25 Ca 0.19 -1.81 -0.26 0.00 0.00 0.00 0.00 54.97 53.10 2dsd s GLU 25 Cb -0.03 0.33 0.09 0.00 2.00 0.00 0.00 34.13 36.52 2dsd s GLU 25 CO 0.10 -0.58 1.17 0.41 -0.56 0.00 0.00 175.26 175.80 2dsd n GLY 26 N -0.48 0.33 0.18 -1.50 0.00 -0.80 -4.85 105.19 98.06 2dsd n GLY 26 Ca 0.04 -1.06 0.05 0.00 0.00 0.00 0.00 46.02 45.05 2dsd n GLY 26 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2dsd h LYS 27 N 0.00 0.00 0.00 1.61 3.64 -2.02 -3.39 116.57 116.41 2dsd h LYS 27 Ca -0.22 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.16 2dsd h LYS 27 Cb 1.14 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.96 2dsd h LYS 27 CO 0.31 0.40 -0.45 0.91 -2.27 0.00 0.00 179.45 178.35 2dsd n TRP 28 N -3.50 0.00 -4.28 1.91 7.02 -1.26 -4.92 117.44 112.42 2dsd n TRP 28 Ca 0.00 0.00 -0.18 0.00 -1.02 0.00 0.00 57.50 56.30 2dsd n TRP 28 Cb 0.54 0.00 -0.11 0.00 -2.42 0.00 0.00 31.31 29.32 2dsd n TRP 28 CO 0.00 0.00 0.00 0.08 -2.02 0.00 0.00 177.69 175.75 2dsd s VAL 29 N -1.33 1.46 0.06 -0.99 1.01 -1.26 -2.32 120.40 117.03 2dsd s VAL 29 Ca 0.00 -1.93 -0.06 0.00 0.00 0.00 0.00 61.98 60.00 2dsd s VAL 29 Cb 0.00 -1.75 -0.02 0.00 0.00 0.00 0.00 36.38 34.61 2dsd s VAL 29 CO 0.00 -0.51 0.10 -1.59 0.00 0.00 0.00 175.10 173.10 2dsd s LYS 30 N -3.13 0.71 -0.03 2.72 -2.85 0.02 -1.90 119.74 115.28 2dsd s LYS 30 Ca 0.15 -0.99 0.02 0.00 -1.00 0.00 0.00 55.97 54.15 2dsd s LYS 30 Cb -0.03 0.28 0.01 0.00 -2.06 0.00 0.00 37.83 36.03 2dsd s LYS 30 CO 0.04 -0.19 -0.08 -1.17 0.10 0.00 0.00 175.35 174.05 2dsd s LEU 31 N -2.70 1.65 0.13 2.77 2.96 -1.14 -1.86 118.68 120.49 2dsd s LEU 31 Ca 0.03 -0.17 -0.01 0.00 -0.22 0.00 0.00 54.13 53.76 2dsd s LEU 31 Cb 0.04 -0.52 -0.04 0.00 0.50 0.00 0.00 46.19 46.17 2dsd s LEU 31 CO -0.09 0.03 0.04 -1.83 -1.32 0.00 0.00 176.35 173.18 2dsd s GLU 32 N 0.43 0.91 -0.21 1.98 -1.05 -0.32 -1.31 118.70 119.15 2dsd s GLU 32 Ca -0.07 -1.43 -0.09 0.00 -0.15 0.00 0.00 54.97 53.23 2dsd s GLU 32 Cb -0.11 0.19 -0.05 0.00 -0.44 0.00 0.00 34.13 33.73 2dsd s GLU 32 CO 0.01 -0.23 0.12 0.21 0.95 0.00 0.00 175.26 176.31 2dsd s LYS 33 N -4.02 4.09 -0.16 -4.83 2.20 0.49 -0.56 119.74 116.95 2dsd s LYS 33 Ca 0.23 -0.27 -0.03 0.00 -0.36 0.00 0.00 55.97 55.53 2dsd s LYS 33 Cb 0.07 -3.39 -0.02 0.00 -1.51 0.00 0.00 37.83 32.98 2dsd s LYS 33 CO 0.01 0.22 -0.05 0.99 -0.36 0.00 0.00 175.35 176.16 2dsd s THR 34 N 0.57 3.70 -0.14 3.43 2.01 0.17 -1.11 115.64 124.27 2dsd s THR 34 Ca 0.06 -0.42 -0.04 0.00 0.31 0.00 0.00 61.69 61.60 2dsd s THR 34 Cb -0.12 -2.62 -0.03 0.00 0.01 0.00 0.00 72.50 69.74 2dsd s THR 34 CO 0.00 0.49 -0.01 -0.89 -0.69 0.00 0.00 174.62 173.52 2dsd s THR 35 N 0.45 4.14 0.19 -0.82 2.01 0.02 -0.97 115.64 120.66 2dsd s THR 35 Ca -0.05 -0.28 -0.07 0.00 0.31 0.00 0.00 61.69 61.60 2dsd s THR 35 Cb -0.15 -2.80 -0.02 0.00 0.01 0.00 0.00 72.50 69.54 2dsd s THR 35 CO 0.03 0.52 0.27 -0.72 -0.69 0.00 0.00 174.62 174.03 2dsd s TYR 36 N 0.04 0.61 -0.26 4.92 -0.85 -0.42 0.65 117.35 122.03 2dsd s TYR 36 Ca 0.02 -0.94 -0.07 0.00 -0.52 0.00 0.00 57.07 55.56 2dsd s TYR 36 Cb -0.13 -0.16 -0.02 0.00 0.38 0.00 0.00 41.96 42.04 2dsd s TYR 36 CO 0.02 -0.74 0.07 1.41 -1.52 0.00 0.00 175.55 174.79 2dsd s MET 37 N -4.03 3.48 1.00 -3.49 -2.45 0.11 -0.88 119.30 113.04 2dsd s MET 37 Ca 0.24 -0.59 -0.15 0.00 -1.25 0.00 0.00 55.69 53.93 2dsd s MET 37 Cb 0.04 -3.34 0.19 0.00 1.25 0.00 0.00 34.83 32.97 2dsd s MET 37 CO 0.05 -0.27 1.18 0.16 1.05 0.00 0.00 175.02 177.19 2dsd s ASP 38 N 1.58 2.75 0.16 1.11 1.47 -0.35 -3.38 116.67 120.00 2dsd s ASP 38 Ca 0.05 0.71 -0.27 0.00 1.18 0.00 0.00 52.55 54.22 2dsd s ASP 38 Cb -0.16 -1.07 -0.01 0.00 -0.34 0.00 0.00 42.92 41.35 2dsd s ASP 38 CO 0.03 -3.00 1.57 -0.65 0.68 0.00 0.00 175.17 173.80 2dsd h PRO 39 N -1.81 -0.29 -0.48 2.11 0.11 -1.89 -2.29 132.00 127.45 2dsd h PRO 39 Ca -0.48 0.02 0.07 0.00 0.11 0.00 0.00 66.00 65.72 2dsd h PRO 39 Cb 1.30 0.07 -0.03 0.00 0.11 0.00 0.00 31.00 32.45 2dsd h PRO 39 CO 0.49 -0.20 0.33 1.79 -0.21 0.00 0.00 178.00 180.20 2dsd h THR 40 N -0.30 0.95 0.00 -1.15 1.35 -1.92 -3.46 112.91 108.37 2dsd h THR 40 Ca 0.14 -0.13 0.00 0.00 -0.55 0.00 0.00 66.41 65.87 2dsd h THR 40 Cb 0.58 0.54 0.00 0.00 -1.73 0.00 0.00 68.15 67.54 2dsd h THR 40 CO -0.62 0.07 0.00 0.61 -0.25 0.00 0.00 175.52 175.33 2dsd n GLY 41 N -1.52 1.16 3.76 5.82 0.00 -0.86 -5.12 105.19 108.43 2dsd n GLY 41 Ca 0.07 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.68 2dsd n GLY 41 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2dsd s LYS 42 N 0.00 4.38 0.07 1.61 2.20 -1.26 -4.71 119.74 122.03 2dsd s LYS 42 Ca 0.00 2.15 -0.23 0.00 -0.36 0.00 0.00 55.97 57.53 2dsd s LYS 42 Cb 0.00 -3.11 -0.06 0.00 -1.51 0.00 0.00 37.83 33.15 2dsd s LYS 42 CO 0.00 -0.18 0.69 0.99 -0.36 0.00 0.00 175.35 176.49 2dsd s THR 43 N -0.78 4.69 0.22 3.43 2.01 -1.26 -1.21 115.64 122.74 2dsd s THR 43 Ca 0.51 1.48 0.02 0.00 0.31 0.00 0.00 61.69 64.02 2dsd s THR 43 Cb -0.39 -4.04 -0.05 0.00 0.01 0.00 0.00 72.50 68.04 2dsd s THR 43 CO 0.48 0.45 0.03 -0.13 -0.69 0.00 0.00 174.62 174.76 2dsd s ARG 44 N -0.52 1.29 0.27 4.92 0.52 -0.05 -4.95 118.95 120.43 2dsd s ARG 44 Ca 0.34 -1.66 0.09 0.00 -0.52 0.00 0.00 55.73 53.99 2dsd s ARG 44 Cb -0.20 -0.39 -0.05 0.00 0.52 0.00 0.00 34.95 34.82 2dsd s ARG 44 CO 0.22 -0.17 -0.13 0.95 0.02 0.00 0.00 175.30 176.18 2dsd s THR 45 N -3.60 2.06 -0.23 0.02 -4.23 -1.26 -1.31 115.64 107.09 2dsd s THR 45 Ca 0.30 -2.26 -0.26 0.00 -1.18 0.00 0.00 61.69 58.29 2dsd s THR 45 Cb 0.07 -2.34 0.07 0.00 1.34 0.00 0.00 72.50 71.64 2dsd s THR 45 CO 0.09 -0.39 0.71 0.86 -0.54 0.00 0.00 174.62 175.35 2dsd s TRP 46 N -2.76 -0.76 -0.37 3.99 -0.11 -0.14 -4.98 118.94 113.80 2dsd s TRP 46 Ca 0.28 1.77 -0.18 0.00 1.22 0.00 0.00 56.10 59.19 2dsd s TRP 46 Cb -0.00 0.30 0.00 0.00 -1.50 0.00 0.00 33.47 32.26 2dsd s TRP 46 CO 0.13 -0.42 0.51 -1.21 -4.62 0.00 0.00 176.95 171.33 2dsd s GLU 47 N 0.08 3.48 -0.09 5.86 2.02 -1.26 0.43 118.70 129.22 2dsd s GLU 47 Ca -0.02 -0.30 0.00 0.00 0.02 0.00 0.00 54.97 54.67 2dsd s GLU 47 Cb -0.04 -3.85 -0.03 0.00 0.10 0.00 0.00 34.13 30.31 2dsd s GLU 47 CO 0.03 -0.72 -0.08 -1.12 0.02 0.00 0.00 175.26 173.38 2dsd s SER 48 N 1.80 4.49 -0.10 -0.19 0.01 0.28 -4.88 113.70 115.11 2dsd s SER 48 Ca 0.18 -0.12 -0.07 0.00 1.31 0.00 0.00 55.95 57.25 2dsd s SER 48 Cb -0.16 -1.33 -0.04 0.00 0.21 0.00 0.00 66.02 64.71 2dsd s SER 48 CO 0.14 0.29 0.17 -0.69 0.41 0.00 0.00 173.24 173.56 2dsd s VAL 49 N -0.36 5.46 0.01 3.43 1.01 -0.39 -1.17 120.40 128.39 2dsd s VAL 49 Ca 0.05 0.23 -0.03 0.00 0.00 0.00 0.00 61.98 62.22 2dsd s VAL 49 Cb -0.12 -3.44 -0.01 0.00 0.00 0.00 0.00 36.38 32.81 2dsd s VAL 49 CO 0.02 0.59 0.04 -0.54 0.00 0.00 0.00 175.10 175.21 2dsd s LYS 50 N -1.13 0.38 0.86 2.72 1.02 -0.78 -3.17 119.74 119.63 2dsd s LYS 50 Ca 0.17 -0.51 -0.09 0.00 0.02 0.00 0.00 55.97 55.56 2dsd s LYS 50 Cb -0.12 0.15 0.17 0.00 -0.52 0.00 0.00 37.83 37.50 2dsd s LYS 50 CO 0.06 -0.08 1.18 1.03 -0.92 0.00 0.00 175.35 176.62 2dsd s ARG 51 N -1.40 1.08 -0.01 1.68 0.52 -1.26 -0.80 118.95 118.77 2dsd s ARG 51 Ca -0.15 -0.76 0.01 0.00 -0.52 0.00 0.00 55.73 54.30 2dsd s ARG 51 Cb -0.09 -2.07 0.01 0.00 0.52 0.00 0.00 34.95 33.33 2dsd s ARG 51 CO 0.00 -1.99 0.82 0.25 0.02 0.00 0.00 175.30 174.40 2dsd n THR 52 N -3.35 0.65 -0.09 0.02 -2.24 -0.98 -4.69 114.28 103.59 2dsd n THR 52 Ca 0.15 -0.66 -0.10 0.00 -2.27 0.00 0.00 64.05 61.17 2dsd n THR 52 Cb 0.60 0.65 -0.15 0.00 -2.10 0.00 0.00 70.33 69.33 2dsd n THR 52 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2dsd n THR 53 N -0.35 1.30 -2.38 4.28 -2.24 -1.26 -4.99 114.28 108.65 2dsd n THR 53 Ca 0.01 -0.79 -0.39 0.00 -2.27 0.00 0.00 64.05 60.61 2dsd n THR 53 Cb 0.37 -0.54 -0.03 0.00 -2.10 0.00 0.00 70.33 68.04 2dsd n THR 53 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 2dsd s ARG 54 N -2.46 4.24 0.00 -0.78 3.52 -1.26 -4.99 118.95 117.23 2dsd s ARG 54 Ca -0.10 1.79 0.00 0.00 -0.13 0.00 0.00 55.73 57.29 2dsd s ARG 54 Cb 0.06 -2.81 0.00 0.00 -1.56 0.00 0.00 34.95 30.64 2dsd s ARG 54 CO 0.76 -0.14 0.00 1.17 -0.81 0.00 0.00 175.30 176.29 2dsd n LYS 55 N 0.38 0.00 -0.01 5.12 4.81 -1.26 -4.98 118.16 122.22 2dsd n LYS 55 Ca 0.03 0.00 0.09 0.00 -0.87 0.00 0.00 58.31 57.56 2dsd n LYS 55 Cb 0.46 0.00 -0.13 0.00 0.02 0.00 0.00 35.03 35.39 2dsd n LYS 55 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 2dsd n GLU 56 N -0.69 0.75 -1.83 1.64 1.02 -1.26 -5.01 120.64 115.26 2dsd n GLU 56 Ca 0.00 -0.11 -0.38 0.00 -0.02 0.00 0.00 57.16 56.65 2dsd n GLU 56 Cb 0.00 -1.40 0.04 0.00 -0.02 0.00 0.00 31.44 30.06 2dsd n GLU 56 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 2dsd s GLN 57 N -3.07 3.00 0.55 3.49 1.11 -1.26 -4.91 119.66 118.58 2dsd s GLN 57 Ca -0.02 2.11 0.34 0.00 0.01 0.00 0.00 55.36 57.79 2dsd s GLN 57 Cb 0.12 -2.12 1.44 0.00 -1.01 0.00 0.00 33.01 31.45 2dsd s GLN 57 CO 0.75 -1.26 2.02 1.79 0.01 0.00 0.00 175.29 178.60 2dsd h THR 58 N 1.17 0.09 -3.85 -0.19 1.35 -1.99 -3.44 112.91 106.06 2dsd h THR 58 Ca -0.51 -0.52 -0.15 0.00 -0.55 0.00 0.00 66.41 64.68 2dsd h THR 58 Cb 1.31 1.47 -0.20 0.00 -1.73 0.00 0.00 68.15 69.00 2dsd h THR 58 CO 0.56 0.03 -0.61 0.00 -0.25 0.00 0.00 175.52 175.25 2dsd s ALA 59 N -3.75 0.00 0.09 6.62 0.00 -1.26 -4.86 121.76 118.60 2dsd s ALA 59 Ca 0.00 -0.51 -0.33 0.00 0.00 0.00 0.00 51.96 51.12 2dsd s ALA 59 Cb 0.10 0.17 -0.15 0.00 0.00 0.00 0.00 23.12 23.24 2dsd s ALA 59 CO 0.54 -0.22 1.60 -0.44 0.00 0.00 0.00 175.76 177.24 2dsd h ASP 60 N 4.26 -1.06 -0.13 0.00 3.32 -0.54 -3.45 116.42 118.83 2dsd h ASP 60 Ca -0.32 0.08 0.00 0.00 0.02 0.00 0.00 57.03 56.82 2dsd h ASP 60 Cb 1.20 0.35 0.00 0.00 0.22 0.00 0.00 39.33 41.09 2dsd h ASP 60 CO 0.44 -0.56 0.00 0.61 -1.72 0.00 0.00 179.24 178.01 2dsd n GLY 61 N -1.50 4.32 3.51 2.75 0.00 -1.24 -2.54 105.19 110.48 2dsd n GLY 61 Ca -0.11 -1.20 -0.24 0.00 0.00 0.00 0.00 46.02 44.47 2dsd n GLY 61 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2dsd s VAL 62 N -1.77 1.54 -0.03 1.61 -7.23 0.19 -1.65 120.40 113.06 2dsd s VAL 62 Ca 0.00 -2.02 -0.00 0.00 -1.81 0.00 0.00 61.98 58.15 2dsd s VAL 62 Cb 0.00 -2.82 0.03 0.00 0.56 0.00 0.00 36.38 34.15 2dsd s VAL 62 CO 0.00 -0.04 0.04 0.00 -0.31 0.00 0.00 175.10 174.79 2dsd s ALA 63 N -3.05 0.09 -0.14 1.32 0.00 -0.62 -2.18 121.76 117.18 2dsd s ALA 63 Ca 0.35 0.31 -0.05 0.00 0.00 0.00 0.00 51.96 52.57 2dsd s ALA 63 Cb 0.08 -0.32 -0.03 0.00 0.00 0.00 0.00 23.12 22.85 2dsd s ALA 63 CO 0.16 -0.18 0.01 0.08 0.00 0.00 0.00 175.76 175.84 2dsd s VAL 64 N 1.27 4.38 -0.67 0.00 1.01 0.55 -1.33 120.40 125.61 2dsd s VAL 64 Ca -0.07 -0.19 -0.12 0.00 0.00 0.00 0.00 61.98 61.60 2dsd s VAL 64 Cb -0.13 -2.92 0.17 0.00 0.00 0.00 0.00 36.38 33.51 2dsd s VAL 64 CO -0.03 0.52 0.58 -0.63 0.00 0.00 0.00 175.10 175.54 2dsd s ILE 65 N -0.05 4.99 -0.19 2.22 1.01 -0.48 -3.77 121.20 124.93 2dsd s ILE 65 Ca 0.04 -2.20 -0.23 0.00 0.00 0.00 0.00 60.65 58.26 2dsd s ILE 65 Cb -0.13 -4.16 -0.02 0.00 0.01 0.00 0.00 42.46 38.16 2dsd s ILE 65 CO 0.02 -0.92 0.75 -2.84 0.00 0.00 0.00 174.94 171.94 2dsd s PRO 66 N 0.68 4.25 -0.34 2.79 0.02 -1.26 -1.32 135.00 139.81 2dsd s PRO 66 Ca 0.12 0.84 -0.03 0.00 0.02 0.00 0.00 61.00 61.95 2dsd s PRO 66 Cb -0.19 -3.59 0.06 0.00 0.02 0.00 0.00 34.50 30.81 2dsd s PRO 66 CO -0.04 -0.32 0.09 0.08 -0.33 0.00 0.00 177.00 176.48 2dsd s VAL 67 N 2.16 3.31 -0.20 3.83 1.01 -0.22 -2.17 120.40 128.11 2dsd s VAL 67 Ca 0.34 -1.49 -0.29 0.00 0.00 0.00 0.00 61.98 60.54 2dsd s VAL 67 Cb -0.16 -2.99 0.00 0.00 0.00 0.00 0.00 36.38 33.23 2dsd s VAL 67 CO 0.11 -0.29 1.08 -0.22 0.00 0.00 0.00 175.10 175.78 2dsd s LEU 68 N 1.27 4.13 -0.19 3.92 2.96 0.04 -0.95 118.68 129.85 2dsd s LEU 68 Ca -0.01 1.46 -0.00 0.00 -0.22 0.00 0.00 54.13 55.36 2dsd s LEU 68 Cb -0.21 -3.54 0.01 0.00 0.50 0.00 0.00 46.19 42.96 2dsd s LEU 68 CO -0.01 -0.67 -0.16 -1.10 -1.32 0.00 0.00 176.35 173.09 2dsd s GLN 69 N 3.14 3.09 0.06 1.98 -0.21 0.65 -1.88 119.66 126.50 2dsd s GLN 69 Ca 0.47 -0.78 0.07 0.00 0.02 0.00 0.00 55.36 55.14 2dsd s GLN 69 Cb -0.17 -2.68 -0.03 0.00 1.00 0.00 0.00 33.01 31.14 2dsd s GLN 69 CO 0.09 -0.20 -0.19 1.03 -2.12 0.00 0.00 175.29 173.90 2dsd s ARG 70 N 1.32 1.16 0.34 2.91 0.52 -1.26 -1.13 118.95 122.80 2dsd s ARG 70 Ca 0.05 -0.98 0.26 0.00 -0.52 0.00 0.00 55.73 54.55 2dsd s ARG 70 Cb -0.13 -1.29 1.06 0.00 0.52 0.00 0.00 34.95 35.11 2dsd s ARG 70 CO -0.10 0.32 1.79 1.79 0.02 0.00 0.00 175.30 179.11 2dsd h THR 71 N 4.29 0.00 -0.25 0.02 1.35 -1.99 -2.94 112.91 113.39 2dsd h THR 71 Ca -0.43 -0.33 0.00 0.00 -0.55 0.00 0.00 66.41 65.10 2dsd h THR 71 Cb 1.17 1.16 0.00 0.00 -1.73 0.00 0.00 68.15 68.75 2dsd h THR 71 CO 0.42 0.00 0.00 0.18 -0.25 0.00 0.00 175.52 175.87 2dsd n LEU 72 N -2.48 2.88 -4.06 3.87 4.77 -1.26 -5.02 117.00 115.70 2dsd n LEU 72 Ca 0.02 -2.23 -0.08 0.00 -0.03 0.00 0.00 56.01 53.69 2dsd n LEU 72 Cb 0.27 -0.25 -0.09 0.00 -2.33 0.00 0.00 43.42 41.02 2dsd n LEU 72 CO 0.23 0.68 -0.28 -1.00 -1.33 0.00 0.00 177.39 175.69 2dsd s HIS 73 N -1.40 0.53 0.27 -1.77 3.76 -1.11 -5.14 115.29 110.43 2dsd s HIS 73 Ca 0.22 -1.01 -0.18 0.00 -0.15 0.00 0.00 55.06 53.95 2dsd s HIS 73 Cb 0.14 -0.33 -0.09 0.00 1.11 0.00 0.00 32.58 33.41 2dsd s HIS 73 CO 0.11 -0.47 0.74 0.71 -0.85 0.00 0.00 174.74 174.99 2dsd s TYR 74 N -3.95 3.52 0.31 1.40 4.12 -1.26 -4.42 117.35 117.07 2dsd s TYR 74 Ca 0.12 1.33 -0.27 0.00 0.02 0.00 0.00 57.07 58.27 2dsd s TYR 74 Cb 0.07 -2.60 -0.14 0.00 -1.52 0.00 0.00 41.96 37.77 2dsd s TYR 74 CO -0.07 0.22 0.90 0.39 0.02 0.00 0.00 175.55 177.01 2dsd n GLU 75 N 0.22 1.11 -4.21 -0.62 1.02 -1.26 -4.81 120.64 112.09 2dsd n GLU 75 Ca 0.01 0.39 -0.29 0.00 -0.02 0.00 0.00 57.16 57.25 2dsd n GLU 75 Cb 0.52 -1.73 -0.09 0.00 -0.02 0.00 0.00 31.44 30.12 2dsd n GLU 75 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2dsd s ILE 77 N -1.43 4.11 -0.22 0.00 -1.09 0.25 -0.78 121.20 122.04 2dsd s ILE 77 Ca 0.24 -0.26 -0.21 0.00 -2.23 0.00 0.00 60.65 58.19 2dsd s ILE 77 Cb -0.10 -2.87 -0.02 0.00 -1.58 0.00 0.00 42.46 37.88 2dsd s ILE 77 CO 0.16 0.41 0.67 -0.69 -1.23 0.00 0.00 174.94 174.26 2dsd s VAL 78 N 1.05 4.98 0.40 2.92 1.01 -0.92 -0.88 120.40 128.96 2dsd s VAL 78 Ca 0.03 1.24 0.05 0.00 0.00 0.00 0.00 61.98 63.30 2dsd s VAL 78 Cb -0.14 -3.97 -0.06 0.00 0.00 0.00 0.00 36.38 32.20 2dsd s VAL 78 CO 0.02 0.06 0.03 -0.76 0.00 0.00 0.00 175.10 174.45 2dsd s LEU 79 N 2.21 2.55 -0.03 3.92 1.43 0.28 -4.48 118.68 124.56 2dsd s LEU 79 Ca 0.29 -1.43 0.03 0.00 -1.03 0.00 0.00 54.13 51.98 2dsd s LEU 79 Cb -0.16 -0.69 0.00 0.00 0.03 0.00 0.00 46.19 45.38 2dsd s LEU 79 CO 0.10 -0.58 -0.09 0.68 0.23 0.00 0.00 176.35 176.68 2dsd s VAL 80 N -2.92 0.81 -0.21 -1.59 -7.23 -0.33 -0.67 120.40 108.25 2dsd s VAL 80 Ca 0.30 -0.38 -0.08 0.00 -1.81 0.00 0.00 61.98 60.01 2dsd s VAL 80 Cb 0.08 -0.72 -0.04 0.00 0.56 0.00 0.00 36.38 36.26 2dsd s VAL 80 CO 0.15 0.25 0.09 -0.75 -0.31 0.00 0.00 175.10 174.53 2dsd s LYS 81 N 0.16 3.94 -0.26 4.82 2.20 0.10 -1.21 119.74 129.49 2dsd s LYS 81 Ca -0.03 -0.35 -0.19 0.00 -0.36 0.00 0.00 55.97 55.04 2dsd s LYS 81 Cb -0.08 -3.33 0.07 0.00 -1.51 0.00 0.00 37.83 32.98 2dsd s LYS 81 CO 0.00 0.12 0.66 1.14 -0.36 0.00 0.00 175.35 176.91 2dsd s GLN 82 N 0.81 0.72 0.22 4.03 -2.07 -0.82 -1.50 119.66 121.05 2dsd s GLN 82 Ca 0.05 1.03 -0.32 0.00 -1.82 0.00 0.00 55.36 54.30 2dsd s GLN 82 Cb -0.13 0.26 -0.12 0.00 -1.09 0.00 0.00 33.01 31.92 2dsd s GLN 82 CO 0.02 -0.12 1.68 0.34 -1.32 0.00 0.00 175.29 175.90 2dsd n PHE 83 N 3.45 2.72 -4.07 9.60 7.35 -1.26 -1.85 117.46 133.40 2dsd n PHE 83 Ca -0.17 0.11 -0.32 0.00 -0.76 0.00 0.00 57.45 56.31 2dsd n PHE 83 Cb 0.57 -2.64 -0.15 0.00 0.35 0.00 0.00 39.48 37.60 2dsd n PHE 83 CO 0.00 0.00 0.00 1.03 -0.76 0.00 0.00 176.76 177.03 2dsd s ARG 84 N 0.81 2.40 0.21 -4.13 1.81 0.15 -4.91 118.95 115.29 2dsd s ARG 84 Ca 0.73 -1.12 -0.12 0.00 -1.72 0.00 0.00 55.73 53.50 2dsd s ARG 84 Cb -0.52 -2.72 0.26 0.00 -0.45 0.00 0.00 34.95 31.52 2dsd s ARG 84 CO 0.36 -0.45 1.63 -1.35 -0.68 0.00 0.00 175.30 174.82 2dsd h PRO 85 N 7.85 0.03 -0.20 3.54 0.11 -1.94 -1.37 132.00 140.02 2dsd h PRO 85 Ca -0.28 -0.00 0.06 0.00 0.11 0.00 0.00 66.00 65.89 2dsd h PRO 85 Cb 1.08 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.17 2dsd h PRO 85 CO 0.51 0.02 0.22 -1.35 -0.21 0.00 0.00 178.00 177.19 2dsd h PRO 86 N 0.03 0.00 -0.00 1.05 0.11 -1.96 0.61 132.00 131.84 2dsd h PRO 86 Ca 0.32 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.43 2dsd h PRO 86 Cb 0.50 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.61 2dsd h PRO 86 CO -0.63 0.00 -0.89 -1.33 -0.21 0.00 0.00 178.00 174.95 2dsd n MET 87 N -3.85 0.09 -2.66 1.05 2.81 -0.60 -4.95 117.12 109.01 2dsd n MET 87 Ca 0.02 -0.07 -0.21 0.00 -1.81 0.00 0.00 57.70 55.63 2dsd n MET 87 Cb 0.35 -1.50 0.01 0.00 -0.71 0.00 0.00 33.22 31.36 2dsd n MET 87 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2dsd n GLY 88 N 1.49 -0.51 2.42 3.03 0.00 0.21 -4.91 105.19 106.92 2dsd n GLY 88 Ca 0.05 0.05 -0.01 0.00 0.00 0.00 0.00 46.02 46.10 2dsd n GLY 88 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dsd n GLY 89 N -1.19 0.80 3.79 -0.02 0.00 -1.16 -5.02 105.19 102.39 2dsd n GLY 89 Ca -0.19 -1.05 -0.38 0.00 0.00 0.00 0.00 46.02 44.40 2dsd n GLY 89 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2dsd s TYR 90 N -3.43 3.71 0.00 1.61 1.51 -1.26 0.33 117.35 119.83 2dsd s TYR 90 Ca 0.15 1.13 0.07 0.00 -1.01 0.00 0.00 57.07 57.41 2dsd s TYR 90 Cb -0.02 -2.48 -0.02 0.00 -0.11 0.00 0.00 41.96 39.33 2dsd s TYR 90 CO 0.03 0.48 -0.21 0.00 -1.11 0.00 0.00 175.55 174.74 2dsd s ILE 92 N -0.59 5.14 0.42 0.00 1.01 0.57 -1.95 121.20 125.79 2dsd s ILE 92 Ca 0.08 -0.17 0.04 0.00 0.00 0.00 0.00 60.65 60.60 2dsd s ILE 92 Cb -0.08 -3.92 -0.02 0.00 0.01 0.00 0.00 42.46 38.44 2dsd s ILE 92 CO 0.00 -0.25 0.13 -1.61 0.00 0.00 0.00 174.94 173.20 2dsd s GLU 93 N 2.05 1.96 0.28 2.79 2.02 -0.35 -1.86 118.70 125.60 2dsd s GLU 93 Ca 0.11 -2.21 -0.14 0.00 0.02 0.00 0.00 54.97 52.76 2dsd s GLU 93 Cb -0.17 -0.66 -0.08 0.00 0.10 0.00 0.00 34.13 33.32 2dsd s GLU 93 CO 0.12 -0.48 0.68 -0.06 0.02 0.00 0.00 175.26 175.54 2dsd s PHE 94 N -3.18 3.42 0.22 1.61 2.99 -1.26 -1.19 117.98 120.60 2dsd s PHE 94 Ca 0.22 1.15 -0.32 0.00 0.00 0.00 0.00 56.93 57.98 2dsd s PHE 94 Cb 0.02 -2.47 -0.14 0.00 0.00 0.00 0.00 43.02 40.43 2dsd s PHE 94 CO 0.14 0.18 1.44 -2.30 -0.00 0.00 0.00 175.22 174.67 2dsd n PRO 95 N -0.14 2.04 -3.81 0.24 -0.02 -1.25 -4.72 135.00 127.33 2dsd n PRO 95 Ca 0.02 0.73 -0.10 0.00 -2.02 0.00 0.00 63.50 62.12 2dsd n PRO 95 Cb 0.53 -2.41 -0.08 0.00 -0.02 0.00 0.00 33.50 31.53 2dsd n PRO 95 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2dsd s ALA 96 N 0.15 -0.43 0.20 3.55 0.00 -1.26 -0.33 121.76 123.64 2dsd s ALA 96 Ca 0.71 -0.31 -0.12 0.00 0.00 0.00 0.00 51.96 52.24 2dsd s ALA 96 Cb -0.66 0.38 0.04 0.00 0.00 0.00 0.00 23.12 22.88 2dsd s ALA 96 CO 0.47 -0.44 0.60 0.41 0.00 0.00 0.00 175.76 176.80 2dsd n GLY 97 N 0.37 1.11 3.92 0.00 0.00 -0.93 -5.00 105.19 104.66 2dsd n GLY 97 Ca -0.17 -1.13 -0.29 0.00 0.00 0.00 0.00 46.02 44.43 2dsd n GLY 97 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2dsd s LEU 98 N 0.00 4.30 -0.28 0.99 1.43 -1.26 -0.64 118.68 123.21 2dsd s LEU 98 Ca 0.13 0.19 -0.14 0.00 -1.03 0.00 0.00 54.13 53.28 2dsd s LEU 98 Cb -0.03 -2.89 -0.03 0.00 0.03 0.00 0.00 46.19 43.27 2dsd s LEU 98 CO 0.06 0.11 0.34 -0.63 0.23 0.00 0.00 176.35 176.46 2dsd s ILE 99 N -1.62 5.19 0.62 -0.59 1.01 -1.05 -4.83 121.20 119.92 2dsd s ILE 99 Ca 0.34 0.41 -0.16 0.00 0.00 0.00 0.00 60.65 61.25 2dsd s ILE 99 Cb -0.12 -3.70 -0.02 0.00 0.01 0.00 0.00 42.46 38.63 2dsd s ILE 99 CO 0.28 0.12 1.09 -1.81 0.00 0.00 0.00 174.94 174.62 2dsd s ASP 100 N 1.68 5.44 0.19 3.58 -0.00 -1.26 -4.93 116.67 121.38 2dsd s ASP 100 Ca 0.13 1.96 -0.33 0.00 -0.00 0.00 0.00 52.55 54.31 2dsd s ASP 100 Cb -0.16 -2.55 -0.13 0.00 -0.00 0.00 0.00 42.92 40.08 2dsd s ASP 100 CO 0.10 -1.40 1.60 0.47 -0.00 0.00 0.00 175.17 175.94 2dsd n ASP 101 N -2.11 3.37 0.00 0.27 8.00 -1.26 -1.26 116.55 123.56 2dsd n ASP 101 Ca 0.10 1.09 0.00 0.00 0.71 0.00 0.00 54.79 56.69 2dsd n ASP 101 Cb 0.52 -1.48 0.00 0.00 -0.02 0.00 0.00 41.12 40.14 2dsd n ASP 101 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2dsd n GLY 102 N 3.33 3.13 3.75 0.44 0.00 -1.26 -5.02 105.19 109.56 2dsd n GLY 102 Ca 0.15 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.78 2dsd n GLY 102 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2dsd s GLU 103 N -0.47 4.82 0.17 1.61 2.12 -0.39 -5.05 118.70 121.51 2dsd s GLU 103 Ca 0.00 1.46 -0.22 0.00 0.36 0.00 0.00 54.97 56.56 2dsd s GLU 103 Cb 0.00 -3.25 -0.08 0.00 0.26 0.00 0.00 34.13 31.06 2dsd s GLU 103 CO 0.00 0.51 0.72 -0.08 -0.54 0.00 0.00 175.26 175.87 2dsd s THR 104 N -1.20 4.50 0.31 -1.70 -1.32 -1.26 -4.76 115.64 110.21 2dsd s THR 104 Ca 0.41 1.48 0.07 0.00 -1.21 0.00 0.00 61.69 62.44 2dsd s THR 104 Cb -0.25 -4.01 0.34 0.00 -1.51 0.00 0.00 72.50 67.07 2dsd s THR 104 CO 0.31 0.43 1.63 -0.65 -2.21 0.00 0.00 174.62 174.13 2dsd h PRO 105 N 4.08 0.16 -0.69 7.08 0.11 -1.97 0.45 132.00 141.23 2dsd h PRO 105 Ca -0.48 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 65.59 2dsd h PRO 105 Cb 1.20 -0.04 -0.03 0.00 0.11 0.00 0.00 31.00 32.25 2dsd h PRO 105 CO 0.65 0.11 0.28 0.93 -0.21 0.00 0.00 178.00 179.76 2dsd h GLU 106 N 0.16 1.02 -0.11 1.05 3.07 -1.98 -0.67 114.58 117.13 2dsd h GLU 106 Ca 0.64 -0.18 -0.02 0.00 -0.50 0.00 0.00 59.36 59.30 2dsd h GLU 106 Cb 1.40 -0.17 -0.00 0.00 -0.84 0.00 0.00 28.75 29.14 2dsd h GLU 106 CO -0.71 0.84 -0.01 0.00 -1.40 0.00 0.00 179.01 177.73 2dsd h ALA 107 N 1.13 0.15 -0.82 3.43 0.00 -0.57 -2.49 119.26 120.08 2dsd h ALA 107 Ca 0.23 -0.20 0.07 0.00 0.00 0.00 0.00 54.91 55.00 2dsd h ALA 107 Cb 0.19 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 17.89 2dsd h ALA 107 CO -0.02 -0.14 0.54 0.00 0.00 0.00 0.00 179.25 179.63 2dsd h ALA 108 N 0.71 1.60 -0.32 0.00 0.00 -0.97 0.06 119.26 120.36 2dsd h ALA 108 Ca 0.03 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 2dsd h ALA 108 Cb 0.40 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 2dsd h ALA 108 CO 0.01 0.27 0.10 0.00 0.00 0.00 0.00 179.25 179.62 2dsd h ALA 109 N 1.55 0.41 -0.50 0.00 0.00 -0.95 -0.19 119.26 119.59 2dsd h ALA 109 Ca 0.36 -0.15 -0.12 0.00 0.00 0.00 0.00 54.91 55.00 2dsd h ALA 109 Cb 0.24 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 2dsd h ALA 109 CO -0.13 0.05 -0.15 -0.07 0.00 0.00 0.00 179.25 178.95 2dsd h LEU 110 N 0.35 0.97 -0.10 0.00 3.38 -0.90 -1.48 115.31 117.54 2dsd h LEU 110 Ca 0.10 -0.34 -0.01 0.00 0.09 0.00 0.00 57.88 57.73 2dsd h LEU 110 Cb 0.25 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.73 2dsd h LEU 110 CO -0.00 1.11 0.03 -0.09 0.09 0.00 0.00 178.44 179.58 2dsd h ARG 111 N 0.85 0.16 0.00 1.13 2.43 -0.86 -2.14 114.38 115.95 2dsd h ARG 111 Ca 0.13 -0.04 -0.05 0.00 -0.81 0.00 0.00 59.98 59.21 2dsd h ARG 111 Cb 0.71 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.23 2dsd h ARG 111 CO 0.05 0.32 -0.25 1.49 -1.51 0.00 0.00 179.97 180.07 2dsd h GLU 112 N -0.02 0.00 -0.13 0.20 4.57 -0.99 -1.29 114.58 116.91 2dsd h GLU 112 Ca 0.03 0.00 -0.19 0.00 -1.18 0.00 0.00 59.36 58.02 2dsd h GLU 112 Cb 0.22 0.00 0.01 0.00 -0.16 0.00 0.00 28.75 28.82 2dsd h GLU 112 CO -0.00 0.25 -0.67 1.25 -1.18 0.00 0.00 179.01 178.67 2dsd h LEU 113 N 0.00 0.81 -0.79 1.64 5.85 -1.07 -1.95 115.31 119.81 2dsd h LEU 113 Ca -0.00 -0.64 -0.12 0.00 0.84 0.00 0.00 57.88 57.96 2dsd h LEU 113 Cb 0.55 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.32 2dsd h LEU 113 CO 0.03 1.32 -0.34 -0.08 -0.34 0.00 0.00 178.44 179.03 2dsd h GLU 114 N 0.36 0.51 -0.18 1.25 4.81 -1.11 -0.73 114.58 119.50 2dsd h GLU 114 Ca -0.05 -0.23 -0.04 0.00 -0.13 0.00 0.00 59.36 58.91 2dsd h GLU 114 Cb 1.30 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.67 2dsd h GLU 114 CO 0.14 0.79 -0.06 0.93 -0.73 0.00 0.00 179.01 180.08 2dsd h GLU 115 N 0.43 0.35 0.00 1.92 5.08 -1.21 -1.20 114.58 119.95 2dsd h GLU 115 Ca 0.05 -0.14 0.00 0.00 -1.00 0.00 0.00 59.36 58.27 2dsd h GLU 115 Cb 0.81 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.04 2dsd h GLU 115 CO 0.07 0.63 -0.41 0.39 -1.00 0.00 0.00 179.01 178.68 2dsd n GLU 116 N -4.64 0.18 0.00 2.33 1.02 -0.74 -0.54 120.64 118.26 2dsd n GLU 116 Ca -0.05 0.07 0.00 0.00 -0.02 0.00 0.00 57.16 57.16 2dsd n GLU 116 Cb 0.28 -1.64 0.00 0.00 -0.02 0.00 0.00 31.44 30.07 2dsd n GLU 116 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 2dsd n THR 117 N -1.91 0.00 -0.19 2.62 -2.24 -0.29 -4.83 114.28 107.45 2dsd n THR 117 Ca 0.05 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.83 2dsd n THR 117 Cb 0.40 -0.23 0.00 0.00 -2.10 0.00 0.00 70.33 68.40 2dsd n THR 117 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2dsd n GLY 118 N 1.32 0.69 3.73 3.38 0.00 -0.45 -4.00 105.19 109.85 2dsd n GLY 118 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 2dsd n GLY 118 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2dsd s TYR 119 N -2.46 3.59 -0.16 1.61 2.02 -1.26 -4.38 117.35 116.31 2dsd s TYR 119 Ca 0.00 1.13 -0.14 0.00 -0.37 0.00 0.00 57.07 57.69 2dsd s TYR 119 Cb 0.00 -2.68 -0.05 0.00 -0.40 0.00 0.00 41.96 38.84 2dsd s TYR 119 CO 0.00 0.18 0.30 0.15 -1.57 0.00 0.00 175.55 174.61 2dsd s LYS 120 N 0.48 4.26 0.40 -0.62 1.02 -1.26 -3.51 119.74 120.51 2dsd s LYS 120 Ca 0.32 0.10 0.05 0.00 0.02 0.00 0.00 55.97 56.46 2dsd s LYS 120 Cb -0.17 -3.42 -0.02 0.00 -0.52 0.00 0.00 37.83 33.69 2dsd s LYS 120 CO 0.16 0.24 0.17 0.20 -0.92 0.00 0.00 175.35 175.19 2dsd s GLY 121 N 0.47 2.63 0.11 -3.33 0.00 -1.26 -4.51 107.32 101.42 2dsd s GLY 121 Ca 0.17 -1.32 0.10 0.00 0.00 0.00 0.00 44.72 43.67 2dsd s GLY 121 CO 0.04 -1.77 -0.26 0.99 0.00 0.00 0.00 173.10 172.10 2dsd s ASP 122 N -3.58 3.23 0.25 1.64 1.01 0.69 -4.92 116.67 114.99 2dsd s ASP 122 Ca 0.26 -0.71 -0.30 0.00 0.71 0.00 0.00 52.55 52.51 2dsd s ASP 122 Cb 0.02 -0.23 -0.09 0.00 1.01 0.00 0.00 42.92 43.63 2dsd s ASP 122 CO 0.17 0.19 1.22 -0.63 0.21 0.00 0.00 175.17 176.33 2dsd s ILE 123 N -1.01 3.24 -0.15 0.77 -1.09 -1.26 -0.06 121.20 121.64 2dsd s ILE 123 Ca 0.13 1.14 -0.03 0.00 -2.23 0.00 0.00 60.65 59.66 2dsd s ILE 123 Cb -0.10 -3.73 -0.08 0.00 -1.58 0.00 0.00 42.46 36.97 2dsd s ILE 123 CO 0.05 0.23 -0.16 0.00 -1.23 0.00 0.00 174.94 173.83 2dsd n ALA 124 N 1.71 1.84 -3.52 9.38 0.00 0.78 -4.80 120.51 125.89 2dsd n ALA 124 Ca 0.02 -0.61 -0.08 0.00 0.00 0.00 0.00 53.44 52.77 2dsd n ALA 124 Cb 0.43 0.23 -0.02 0.00 0.00 0.00 0.00 19.45 20.09 2dsd n ALA 124 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 2dsd s GLU 125 N -2.28 0.75 0.47 0.00 -1.05 -0.89 -4.99 118.70 110.72 2dsd s GLU 125 Ca -0.20 -0.24 0.05 0.00 -0.15 0.00 0.00 54.97 54.43 2dsd s GLU 125 Cb 0.06 0.35 -0.02 0.00 -0.44 0.00 0.00 34.13 34.08 2dsd s GLU 125 CO 0.30 -0.32 0.14 0.00 0.95 0.00 0.00 175.26 176.33 2dsd s SER 127 N -3.94 0.14 1.11 0.00 1.04 -1.21 -4.92 113.70 105.92 2dsd s SER 127 Ca 0.27 -1.31 -0.17 0.00 0.48 0.00 0.00 55.95 55.21 2dsd s SER 127 Cb 0.03 0.42 0.25 0.00 0.10 0.00 0.00 66.02 66.82 2dsd s SER 127 CO 0.15 -0.90 1.15 -2.16 0.98 0.00 0.00 173.24 172.45 2dsd s PRO 128 N -4.11 -0.51 -0.11 4.02 0.04 -1.26 -4.67 135.00 128.40 2dsd s PRO 128 Ca 0.36 -0.03 -0.30 0.00 0.04 0.00 0.00 61.00 61.07 2dsd s PRO 128 Cb 0.05 -1.68 -0.03 0.00 0.04 0.00 0.00 34.50 32.89 2dsd s PRO 128 CO 0.12 -3.24 1.28 0.00 0.04 0.00 0.00 177.00 175.19 2dsd s ALA 129 N -3.18 3.60 -0.02 8.56 0.00 -1.26 -4.50 121.76 124.95 2dsd s ALA 129 Ca 0.70 0.58 0.04 0.00 0.00 0.00 0.00 51.96 53.28 2dsd s ALA 129 Cb -0.10 -3.59 -0.03 0.00 0.00 0.00 0.00 23.12 19.40 2dsd s ALA 129 CO 0.55 -1.03 -0.14 0.14 0.00 0.00 0.00 175.76 175.28 2dsd s VAL 130 N 3.01 3.08 0.20 0.00 -7.23 0.63 -4.85 120.40 115.24 2dsd s VAL 130 Ca 0.57 -0.83 -0.30 0.00 -1.81 0.00 0.00 61.98 59.61 2dsd s VAL 130 Cb -0.24 -2.24 -0.08 0.00 0.56 0.00 0.00 36.38 34.38 2dsd s VAL 130 CO 0.19 0.51 0.95 0.00 -0.31 0.00 0.00 175.10 176.44 2dsd h MET 132 N 4.59 0.48 -0.41 0.00 2.86 -1.02 -3.43 114.93 118.00 2dsd h MET 132 Ca -0.44 -0.73 -0.18 0.00 -2.06 0.00 0.00 59.70 56.29 2dsd h MET 132 Cb 1.20 0.26 -0.15 0.00 0.06 0.00 0.00 31.60 32.97 2dsd h MET 132 CO 0.69 1.33 -0.46 -3.47 1.06 0.00 0.00 176.91 176.07 2dsd n ASP 133 N -3.69 -3.01 -0.21 1.22 -0.08 -1.26 -5.03 116.55 104.49 2dsd n ASP 133 Ca -0.13 -2.99 0.24 0.00 -1.51 0.00 0.00 54.79 50.40 2dsd n ASP 133 Cb 1.02 1.71 0.63 0.00 2.34 0.00 0.00 41.12 46.83 2dsd n ASP 133 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 2dsd h PRO 134 N 4.37 0.18 0.00 -0.67 0.13 -1.84 0.60 132.00 134.77 2dsd h PRO 134 Ca -0.06 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.06 2dsd h PRO 134 Cb 1.08 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 32.17 2dsd h PRO 134 CO 0.16 0.12 0.00 0.41 -0.23 0.00 0.00 178.00 178.46 2dsd n GLY 135 N -1.62 -0.99 0.89 1.56 0.00 -1.26 -4.26 105.19 99.51 2dsd n GLY 135 Ca 0.19 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 46.05 2dsd n GLY 135 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2dsd n LEU 136 N -0.90 0.31 -4.22 0.99 7.94 -0.03 -5.02 117.00 116.07 2dsd n LEU 136 Ca 0.19 0.00 -0.13 0.00 -1.11 0.00 0.00 56.01 54.97 2dsd n LEU 136 Cb 0.09 0.00 -0.10 0.00 0.53 0.00 0.00 43.42 43.94 2dsd n LEU 136 CO 0.14 -0.14 -0.37 -0.94 -1.11 0.00 0.00 177.39 174.97 2dsd s SER 137 N -4.10 1.32 -0.05 1.96 1.04 0.19 -1.26 113.70 112.80 2dsd s SER 137 Ca 0.00 -1.08 0.09 0.00 0.48 0.00 0.00 55.95 55.43 2dsd s SER 137 Cb 0.00 0.08 0.33 0.00 0.10 0.00 0.00 66.02 66.53 2dsd s SER 137 CO 0.00 -0.48 1.17 -0.46 0.98 0.00 0.00 173.24 174.44 2dsd n ASN 138 N -0.17 2.43 -4.66 7.02 6.94 -1.19 -3.99 115.26 121.64 2dsd n ASN 138 Ca -0.09 -2.19 -0.42 0.00 -0.02 0.00 0.00 54.58 51.85 2dsd n ASN 138 Cb 0.62 -0.39 -0.03 0.00 -2.36 0.00 0.00 39.78 37.62 2dsd n ASN 138 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2dsd s THR 140 N 4.05 1.72 0.29 0.00 -4.23 -1.26 -0.36 115.64 115.86 2dsd s THR 140 Ca 0.71 -1.82 0.02 0.00 -1.18 0.00 0.00 61.69 59.43 2dsd s THR 140 Cb -0.32 -1.74 -0.03 0.00 1.34 0.00 0.00 72.50 71.76 2dsd s THR 140 CO 0.28 -0.29 0.28 0.27 -0.54 0.00 0.00 174.62 174.63 2dsd s ILE 141 N -1.90 0.00 -0.14 2.99 -4.36 0.49 0.21 121.20 118.48 2dsd s ILE 141 Ca 0.13 -1.90 0.02 0.00 -0.26 0.00 0.00 60.65 58.64 2dsd s ILE 141 Cb -0.06 -2.51 0.01 0.00 1.25 0.00 0.00 42.46 41.14 2dsd s ILE 141 CO 0.06 0.00 -0.21 -1.00 0.24 0.00 0.00 174.94 174.02 2dsd s HIS 142 N -3.59 2.67 -0.41 1.37 3.76 -0.66 -0.27 115.29 118.17 2dsd s HIS 142 Ca 0.38 -1.30 -0.19 0.00 -0.15 0.00 0.00 55.06 53.80 2dsd s HIS 142 Cb 0.03 -1.82 0.02 0.00 1.11 0.00 0.00 32.58 31.92 2dsd s HIS 142 CO 0.21 -0.59 0.55 0.42 -0.85 0.00 0.00 174.74 174.48 2dsd s ILE 143 N 0.78 4.96 -0.23 0.60 1.01 -1.26 -1.59 121.20 125.47 2dsd s ILE 143 Ca -0.08 0.02 -0.08 0.00 0.00 0.00 0.00 60.65 60.52 2dsd s ILE 143 Cb -0.16 -4.09 -0.03 0.00 0.01 0.00 0.00 42.46 38.19 2dsd s ILE 143 CO -0.01 -0.45 0.08 -0.69 0.00 0.00 0.00 174.94 173.87 2dsd s VAL 144 N 2.50 4.52 -0.16 2.92 1.01 -0.44 -3.29 120.40 127.46 2dsd s VAL 144 Ca 0.18 -0.11 -0.21 0.00 0.00 0.00 0.00 61.98 61.84 2dsd s VAL 144 Cb -0.15 -3.09 -0.03 0.00 0.00 0.00 0.00 36.38 33.10 2dsd s VAL 144 CO 0.16 0.37 0.63 -0.89 0.00 0.00 0.00 175.10 175.36 2dsd s THR 145 N 1.23 5.05 0.01 3.92 2.01 -0.11 -1.39 115.64 126.36 2dsd s THR 145 Ca 0.05 1.21 0.05 0.00 0.31 0.00 0.00 61.69 63.31 2dsd s THR 145 Cb -0.14 -3.95 -0.02 0.00 0.01 0.00 0.00 72.50 68.40 2dsd s THR 145 CO 0.04 0.17 -0.16 -0.69 -0.69 0.00 0.00 174.62 173.28 2dsd s VAL 146 N 1.49 1.29 0.00 3.82 1.01 -0.44 -0.16 120.40 127.43 2dsd s VAL 146 Ca 0.30 -0.82 0.01 0.00 0.00 0.00 0.00 61.98 61.46 2dsd s VAL 146 Cb -0.16 -1.10 -0.04 0.00 0.00 0.00 0.00 36.38 35.08 2dsd s VAL 146 CO 0.12 0.26 0.05 0.42 0.00 0.00 0.00 175.10 175.95 2dsd s THR 147 N -0.53 4.49 -0.07 3.92 -4.23 0.91 -1.06 115.64 119.07 2dsd s THR 147 Ca 0.05 -0.51 0.03 0.00 -1.18 0.00 0.00 61.69 60.08 2dsd s THR 147 Cb -0.07 -3.05 0.01 0.00 1.34 0.00 0.00 72.50 70.73 2dsd s THR 147 CO 0.00 0.34 -0.16 -0.63 -0.54 0.00 0.00 174.62 173.64 2dsd s ILE 148 N -1.17 1.40 -0.66 2.99 1.01 -0.13 -0.23 121.20 124.42 2dsd s ILE 148 Ca 0.22 -0.64 -0.21 0.00 0.00 0.00 0.00 60.65 60.02 2dsd s ILE 148 Cb -0.12 -1.25 0.09 0.00 0.01 0.00 0.00 42.46 41.19 2dsd s ILE 148 CO 0.13 0.41 0.89 0.21 0.00 0.00 0.00 174.94 176.58 2dsd s ASN 149 N 0.53 6.21 0.57 3.58 2.47 -1.26 -0.25 114.94 126.79 2dsd s ASN 149 Ca -0.15 -1.22 0.35 0.00 0.42 0.00 0.00 52.86 52.26 2dsd s ASN 149 Cb -0.16 -2.38 1.61 0.00 -1.45 0.00 0.00 41.25 38.87 2dsd s ASN 149 CO 0.05 -1.30 2.08 1.23 -3.72 0.00 0.00 177.10 175.43 2dsd h GLY 150 N 10.81 0.00 1.98 1.21 0.00 -1.48 -2.66 103.07 112.93 2dsd h GLY 150 Ca -0.26 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.07 2dsd h GLY 150 CO 1.15 0.00 -0.02 -0.55 0.00 0.00 0.00 176.54 177.12 2dsd h ASP 151 N 0.00 0.00 -3.94 0.19 3.32 -1.91 -3.43 116.42 110.65 2dsd h ASP 151 Ca -0.00 -0.00 -0.53 0.00 0.02 0.00 0.00 57.03 56.52 2dsd h ASP 151 Cb 0.39 0.00 0.09 0.00 0.22 0.00 0.00 39.33 40.02 2dsd h ASP 151 CO 0.00 0.00 0.65 -0.62 -1.72 0.00 0.00 179.24 177.55 2dsd s ASP 152 N -6.17 6.36 0.57 6.45 -1.08 -1.00 -4.91 116.67 116.88 2dsd s ASP 152 Ca 0.07 2.74 0.34 0.00 -0.52 0.00 0.00 52.55 55.18 2dsd s ASP 152 Cb 0.05 -2.65 1.65 0.00 -1.46 0.00 0.00 42.92 40.52 2dsd s ASP 152 CO 0.67 -0.83 2.10 0.00 0.52 0.00 0.00 175.17 177.64 2dsd h ALA 153 N 2.81 1.08 0.00 3.66 0.00 -1.89 -2.51 119.26 122.42 2dsd h ALA 153 Ca -0.50 -0.05 -0.11 0.00 0.00 0.00 0.00 54.91 54.26 2dsd h ALA 153 Cb 1.24 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 19.01 2dsd h ALA 153 CO 0.63 0.06 -0.53 0.93 0.00 0.00 0.00 179.25 180.34 2dsd h GLU 154 N 0.00 0.00 -0.64 0.00 5.08 -1.92 -2.99 114.58 114.10 2dsd h GLU 154 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2dsd h GLU 154 Cb 0.34 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.59 2dsd h GLU 154 CO 0.01 0.53 0.00 0.09 -1.00 0.00 0.00 179.01 178.64 2dsd n ASN 155 N -3.50 3.87 0.52 1.42 3.02 -0.95 -4.54 115.26 115.09 2dsd n ASN 155 Ca 0.00 -2.22 -0.20 0.00 -0.03 0.00 0.00 54.58 52.12 2dsd n ASN 155 Cb 0.63 -0.49 -0.10 0.00 -0.61 0.00 0.00 39.78 39.21 2dsd n ASN 155 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2dsd h ALA 156 N 4.04 -1.33 -3.28 5.41 0.00 -1.48 -3.37 119.26 119.24 2dsd h ALA 156 Ca 0.00 -0.29 -0.63 0.00 0.00 0.00 0.00 54.91 53.99 2dsd h ALA 156 Cb 1.11 0.51 -0.41 0.00 0.00 0.00 0.00 17.79 19.00 2dsd h ALA 156 CO 0.12 -1.24 -0.66 1.03 0.00 0.00 0.00 179.25 178.50 2dsd s ARG 157 N -5.84 1.76 -0.25 0.00 0.52 -1.26 -5.08 118.95 108.80 2dsd s ARG 157 Ca -0.19 -2.41 -0.29 0.00 -0.52 0.00 0.00 55.73 52.31 2dsd s ARG 157 Cb 0.02 -3.03 -0.02 0.00 0.52 0.00 0.00 34.95 32.44 2dsd s ARG 157 CO 0.58 -1.12 1.50 -2.14 0.02 0.00 0.00 175.30 174.14 2dsd s PRO 158 N -0.06 3.84 -0.47 3.54 0.02 -1.26 -5.00 135.00 135.62 2dsd s PRO 158 Ca 0.17 1.52 -0.10 0.00 0.02 0.00 0.00 61.00 62.60 2dsd s PRO 158 Cb -0.25 -3.98 0.11 0.00 0.02 0.00 0.00 34.50 30.40 2dsd s PRO 158 CO -0.00 -1.23 0.35 0.15 -0.33 0.00 0.00 177.00 175.94 2dsd s LYS 159 N 4.48 2.60 0.67 5.54 3.01 -1.26 -4.82 119.74 129.97 2dsd s LYS 159 Ca 0.66 -1.66 -0.17 0.00 -1.01 0.00 0.00 55.97 53.79 2dsd s LYS 159 Cb -0.22 -3.95 -0.04 0.00 -1.01 0.00 0.00 37.83 32.61 2dsd s LYS 159 CO 0.27 -1.15 0.75 -2.30 0.51 0.00 0.00 175.35 173.44 2dsd n PRO 160 N 4.97 0.54 -3.21 -1.68 -0.02 -1.26 -4.51 135.00 129.83 2dsd n PRO 160 Ca -0.09 0.23 -0.23 0.00 -2.02 0.00 0.00 63.50 61.38 2dsd n PRO 160 Cb 0.41 -2.00 -0.06 0.00 -0.02 0.00 0.00 33.50 31.84 2dsd n PRO 160 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 2dsd n LYS 161 N -1.00 1.32 -1.47 -0.52 4.81 0.30 -4.91 118.16 116.69 2dsd n LYS 161 Ca 0.12 -3.66 -0.34 0.00 -0.87 0.00 0.00 58.31 53.56 2dsd n LYS 161 Cb 0.49 -1.60 0.09 0.00 0.02 0.00 0.00 35.03 34.02 2dsd n LYS 161 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 2dsd s PRO 162 N -1.91 2.22 0.00 1.64 0.04 -1.11 -4.68 135.00 131.20 2dsd s PRO 162 Ca 0.38 1.73 0.00 0.00 0.04 0.00 0.00 61.00 63.15 2dsd s PRO 162 Cb 0.22 -1.85 0.00 0.00 0.04 0.00 0.00 34.50 32.91 2dsd s PRO 162 CO -0.09 -1.77 0.00 0.41 0.04 0.00 0.00 177.00 175.59 2dsd n GLY 163 N 0.31 -0.70 3.58 0.56 0.00 -1.26 -4.87 105.19 102.80 2dsd n GLY 163 Ca 0.13 -1.62 -0.41 0.00 0.00 0.00 0.00 46.02 44.12 2dsd n GLY 163 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2dsd s ASP 164 N -1.01 5.52 -0.21 1.61 1.01 -1.26 -2.82 116.67 119.50 2dsd s ASP 164 Ca 0.00 1.14 0.00 0.00 0.71 0.00 0.00 52.55 54.40 2dsd s ASP 164 Cb 0.00 -2.52 0.00 0.00 1.01 0.00 0.00 42.92 41.41 2dsd s ASP 164 CO 0.00 -2.03 0.00 0.61 0.21 0.00 0.00 175.17 173.96 2dsd n GLY 165 N 5.60 0.54 3.61 0.21 0.00 -1.26 -5.03 105.19 108.86 2dsd n GLY 165 Ca 0.25 -0.87 -0.36 0.00 0.00 0.00 0.00 46.02 45.03 2dsd n GLY 165 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2dsd s GLU 166 N -1.97 3.96 -0.23 1.61 2.12 -1.13 -5.06 118.70 118.01 2dsd s GLU 166 Ca 0.00 -0.33 0.01 0.00 0.36 0.00 0.00 54.97 55.02 2dsd s GLU 166 Cb 0.00 -3.48 0.06 0.00 0.26 0.00 0.00 34.13 30.97 2dsd s GLU 166 CO 0.00 0.00 -0.08 -0.06 -0.54 0.00 0.00 175.26 174.59 2dsd s PHE 167 N 1.18 2.61 -0.07 5.30 0.40 -1.26 -4.59 117.98 121.55 2dsd s PHE 167 Ca 0.06 -1.86 0.04 0.00 -0.60 0.00 0.00 56.93 54.57 2dsd s PHE 167 Cb -0.14 -1.67 0.00 0.00 0.51 0.00 0.00 43.02 41.72 2dsd s PHE 167 CO 0.05 -0.79 -0.18 0.08 0.70 0.00 0.00 175.22 175.08 2dsd s VAL 168 N 1.33 1.55 -0.10 -0.44 1.01 -1.26 -4.62 120.40 117.87 2dsd s VAL 168 Ca -0.06 -0.75 -0.03 0.00 0.00 0.00 0.00 61.98 61.14 2dsd s VAL 168 Cb -0.19 -1.35 -0.04 0.00 0.00 0.00 0.00 36.38 34.81 2dsd s VAL 168 CO -0.06 0.45 0.04 -0.70 0.00 0.00 0.00 175.10 174.82 2dsd s GLU 169 N 0.29 3.14 -0.19 2.72 2.12 -0.57 -4.95 118.70 121.27 2dsd s GLU 169 Ca -0.11 -0.33 -0.09 0.00 0.36 0.00 0.00 54.97 54.80 2dsd s GLU 169 Cb -0.15 -2.91 -0.04 0.00 0.26 0.00 0.00 34.13 31.29 2dsd s GLU 169 CO 0.05 0.70 0.09 0.08 -0.54 0.00 0.00 175.26 175.64 2dsd s VAL 170 N -0.86 5.05 -0.18 3.70 1.01 -1.26 0.03 120.40 127.89 2dsd s VAL 170 Ca 0.13 0.06 0.00 0.00 0.00 0.00 0.00 61.98 62.17 2dsd s VAL 170 Cb -0.12 -3.29 0.04 0.00 0.00 0.00 0.00 36.38 33.01 2dsd s VAL 170 CO 0.03 0.45 -0.08 -0.63 0.00 0.00 0.00 175.10 174.86 2dsd s ILE 171 N 0.41 1.36 -0.24 2.22 1.01 0.15 -4.97 121.20 121.14 2dsd s ILE 171 Ca 0.05 -0.77 -0.14 0.00 0.00 0.00 0.00 60.65 59.79 2dsd s ILE 171 Cb -0.12 -1.47 -0.04 0.00 0.01 0.00 0.00 42.46 40.84 2dsd s ILE 171 CO -0.00 0.17 0.30 -0.44 0.00 0.00 0.00 174.94 174.97 2dsd s SER 172 N 1.53 6.25 0.04 3.58 0.01 -1.26 -0.55 113.70 123.30 2dsd s SER 172 Ca 0.00 0.28 0.08 0.00 1.31 0.00 0.00 55.95 57.63 2dsd s SER 172 Cb -0.15 -2.18 -0.03 0.00 0.21 0.00 0.00 66.02 63.87 2dsd s SER 172 CO -0.08 -0.06 -0.22 -0.76 0.41 0.00 0.00 173.24 172.53 2dsd s LEU 173 N 1.49 2.42 0.03 2.44 1.43 -0.05 -4.89 118.68 121.55 2dsd s LEU 173 Ca 0.13 -0.50 -0.30 0.00 -1.03 0.00 0.00 54.13 52.43 2dsd s LEU 173 Cb -0.15 -1.42 -0.08 0.00 0.03 0.00 0.00 46.19 44.57 2dsd s LEU 173 CO 0.08 0.26 1.83 -2.84 0.23 0.00 0.00 176.35 175.91 2dsd s PRO 174 N -1.37 4.16 0.34 1.29 0.02 -1.26 0.85 135.00 139.03 2dsd s PRO 174 Ca 0.13 2.47 0.07 0.00 0.02 0.00 0.00 61.00 63.70 2dsd s PRO 174 Cb -0.10 -3.97 0.75 0.00 0.02 0.00 0.00 34.50 31.19 2dsd s PRO 174 CO 0.04 -0.89 1.88 -0.22 -0.33 0.00 0.00 177.00 177.48 2dsd h LYS 175 N 9.79 0.74 -0.29 5.54 3.64 -1.37 0.53 116.57 135.16 2dsd h LYS 175 Ca -0.46 -0.04 -0.04 0.00 -1.27 0.00 0.00 60.65 58.84 2dsd h LYS 175 Cb 1.22 -0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 32.85 2dsd h LYS 175 CO 0.94 0.49 0.02 -0.91 -2.27 0.00 0.00 179.45 177.72 2dsd h ASN 176 N 0.77 0.40 0.00 4.20 4.21 -1.91 -3.18 115.58 120.07 2dsd h ASN 176 Ca 0.43 -0.06 -0.01 0.00 1.21 0.00 0.00 56.30 57.87 2dsd h ASN 176 Cb 0.59 -0.10 -0.03 0.00 -1.12 0.00 0.00 38.32 37.66 2dsd h ASN 176 CO -0.19 0.45 -0.28 -0.67 -1.29 0.00 0.00 177.43 175.45 2dsd n ASP 177 N -4.32 1.77 -0.21 5.81 2.03 -0.61 -4.86 116.55 116.16 2dsd n ASP 177 Ca 0.01 -3.11 0.01 0.00 0.52 0.00 0.00 54.79 52.23 2dsd n ASP 177 Cb 0.21 -0.42 0.12 0.00 -0.72 0.00 0.00 41.12 40.31 2dsd n ASP 177 CO 0.00 0.00 0.00 0.25 -1.92 0.00 0.00 177.20 175.53 2dsd h LEU 178 N 0.36 0.06 -0.09 -2.67 5.85 0.05 -1.57 115.31 117.29 2dsd h LEU 178 Ca -0.02 0.11 -0.00 0.00 0.84 0.00 0.00 57.88 58.81 2dsd h LEU 178 Cb 1.11 0.14 -0.00 0.00 0.37 0.00 0.00 40.66 42.28 2dsd h LEU 178 CO 0.01 0.03 0.05 0.25 -0.34 0.00 0.00 178.44 178.44 2dsd h LEU 179 N 0.29 0.11 -0.53 2.25 5.85 -1.86 -1.15 115.31 120.27 2dsd h LEU 179 Ca 0.33 -0.07 -0.02 0.00 0.84 0.00 0.00 57.88 58.95 2dsd h LEU 179 Cb 0.48 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.46 2dsd h LEU 179 CO -0.40 0.15 0.26 1.56 -0.34 0.00 0.00 178.44 179.68 2dsd h GLN 180 N 0.06 0.76 0.00 1.25 7.50 -1.88 -1.91 115.11 120.89 2dsd h GLN 180 Ca 0.03 -0.11 -0.03 0.00 0.50 0.00 0.00 58.65 59.04 2dsd h GLN 180 Cb 0.07 -0.14 -0.00 0.00 0.05 0.00 0.00 27.48 27.45 2dsd h GLN 180 CO -0.01 0.62 -0.15 0.00 -1.50 0.00 0.00 178.83 177.80 2dsd h ARG 181 N 0.71 0.00 0.10 1.46 2.47 -1.21 -2.27 114.38 115.64 2dsd h ARG 181 Ca 0.18 0.00 -0.27 0.00 -1.26 0.00 0.00 59.98 58.64 2dsd h ARG 181 Cb 0.11 0.00 0.01 0.00 -1.65 0.00 0.00 29.97 28.44 2dsd h ARG 181 CO -0.02 0.15 -1.17 -0.07 0.56 0.00 0.00 179.97 179.42 2dsd h LEU 182 N 0.00 0.52 -1.42 3.04 3.38 -0.65 -3.14 115.31 117.04 2dsd h LEU 182 Ca -0.00 -0.51 -0.06 0.00 0.09 0.00 0.00 57.88 57.40 2dsd h LEU 182 Cb 0.40 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 2dsd h LEU 182 CO 0.02 1.36 -0.29 0.44 0.09 0.00 0.00 178.44 180.06 2dsd h ASP 183 N 0.14 0.00 -0.16 -0.43 3.32 -0.88 -2.99 116.42 115.42 2dsd h ASP 183 Ca -0.13 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 56.88 2dsd h ASP 183 Cb 1.87 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 41.41 2dsd h ASP 183 CO 0.20 0.29 -0.04 0.00 -1.72 0.00 0.00 179.24 177.98 2dsd h ALA 184 N 1.71 0.22 0.00 3.45 0.00 -1.39 -3.24 119.26 120.00 2dsd h ALA 184 Ca -0.00 -0.24 -0.05 0.00 0.00 0.00 0.00 54.91 54.63 2dsd h ALA 184 Cb 0.52 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 2dsd h ALA 184 CO 0.04 -0.02 -0.22 -0.07 0.00 0.00 0.00 179.25 178.98 2dsd h LEU 185 N 0.02 0.00 -0.44 0.00 3.38 -1.49 -3.23 115.31 113.55 2dsd h LEU 185 Ca 0.04 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.84 2dsd h LEU 185 Cb 0.46 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.21 2dsd h LEU 185 CO 0.02 0.22 -0.62 0.58 0.09 0.00 0.00 178.44 178.72 2dsd h VAL 186 N 0.00 1.33 -0.00 1.22 2.07 -1.55 -3.25 116.25 116.06 2dsd h VAL 186 Ca -0.00 -1.90 -0.06 0.00 0.82 0.00 0.00 66.70 65.55 2dsd h VAL 186 Cb 0.64 1.88 0.01 0.00 -1.52 0.00 0.00 31.29 32.29 2dsd h VAL 186 CO 0.03 0.59 -0.25 0.00 0.02 0.00 0.00 177.57 177.96 2dsd h ALA 187 N 0.90 0.03 -0.06 1.67 0.00 -1.62 -2.73 119.26 117.45 2dsd h ALA 187 Ca -0.01 -0.47 -0.09 0.00 0.00 0.00 0.00 54.91 54.34 2dsd h ALA 187 Cb 1.19 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 2dsd h ALA 187 CO 0.12 0.08 -0.37 1.05 0.00 0.00 0.00 179.25 180.13 2dsd h GLU 188 N -0.51 0.11 -0.21 0.00 4.11 -1.70 -3.26 114.58 113.13 2dsd h GLU 188 Ca -0.03 -0.05 0.00 0.00 0.07 0.00 0.00 59.36 59.35 2dsd h GLU 188 Cb 1.01 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.25 2dsd h GLU 188 CO 0.05 0.48 0.00 0.39 0.07 0.00 0.00 179.01 180.00 2dsd n GLU 189 N -4.07 2.88 -1.91 1.06 1.02 -1.23 -4.94 120.64 113.44 2dsd n GLU 189 Ca -0.02 -1.91 -0.19 0.00 -0.02 0.00 0.00 57.16 55.03 2dsd n GLU 189 Cb 0.43 -1.21 -0.05 0.00 -0.02 0.00 0.00 31.44 30.59 2dsd n GLU 189 CO 0.00 0.00 0.00 1.58 1.18 0.00 0.00 177.13 179.89 2dsd n HIS 190 N 0.06 -0.50 -1.04 -0.32 -0.00 -1.15 -4.94 115.22 107.32 2dsd n HIS 190 Ca 0.08 0.00 -0.29 0.00 -0.00 0.00 0.00 57.72 57.51 2dsd n HIS 190 Cb 0.39 -3.49 0.20 0.00 -0.00 0.00 0.00 29.99 27.09 2dsd n HIS 190 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.34 175.83 2dsd s LEU 191 N -5.14 1.28 -0.02 0.27 1.43 -1.04 -4.84 118.68 110.63 2dsd s LEU 191 Ca 0.00 1.16 0.01 0.00 -1.03 0.00 0.00 54.13 54.27 2dsd s LEU 191 Cb 0.00 -3.23 0.01 0.00 0.03 0.00 0.00 46.19 43.00 2dsd s LEU 191 CO 0.00 -3.48 -0.02 -0.89 0.23 0.00 0.00 176.35 172.18 2dsd s THR 192 N -2.88 0.27 0.10 5.49 2.01 -0.89 -4.70 115.64 115.03 2dsd s THR 192 Ca 0.66 -0.06 -0.03 0.00 0.31 0.00 0.00 61.69 62.57 2dsd s THR 192 Cb -0.19 -0.28 -0.05 0.00 0.01 0.00 0.00 72.50 71.99 2dsd s THR 192 CO 0.59 0.12 0.29 -0.69 -0.69 0.00 0.00 174.62 174.24 2dsd s VAL 193 N 0.40 5.27 0.44 3.82 1.01 -1.26 -0.32 120.40 129.77 2dsd s VAL 193 Ca -0.04 -0.16 -0.22 0.00 0.00 0.00 0.00 61.98 61.55 2dsd s VAL 193 Cb -0.07 -3.62 -0.08 0.00 0.00 0.00 0.00 36.38 32.60 2dsd s VAL 193 CO -0.01 0.09 1.06 -0.62 0.00 0.00 0.00 175.10 175.63 2dsd s ASP 194 N -2.45 6.49 0.36 3.32 -1.08 -0.77 -4.87 116.67 117.66 2dsd s ASP 194 Ca 0.38 2.04 0.03 0.00 -0.52 0.00 0.00 52.55 54.48 2dsd s ASP 194 Cb -0.13 -2.58 0.66 0.00 -1.46 0.00 0.00 42.92 39.42 2dsd s ASP 194 CO 0.26 -0.68 1.98 0.00 0.52 0.00 0.00 175.17 177.25 2dsd h ALA 195 N 2.05 1.52 -0.40 3.66 0.00 -1.98 -1.47 119.26 122.63 2dsd h ALA 195 Ca -0.49 -0.08 -0.14 0.00 0.00 0.00 0.00 54.91 54.19 2dsd h ALA 195 Cb 1.22 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.79 2dsd h ALA 195 CO 0.61 0.40 -0.31 0.00 0.00 0.00 0.00 179.25 179.94 2dsd h ARG 196 N 0.72 0.93 -0.45 0.00 3.08 -1.98 -0.67 114.38 116.01 2dsd h ARG 196 Ca 0.19 -0.46 -0.07 0.00 0.07 0.00 0.00 59.98 59.71 2dsd h ARG 196 Cb 0.02 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.05 2dsd h ARG 196 CO -0.03 1.11 -0.00 0.28 -1.07 0.00 0.00 179.97 180.26 2dsd h VAL 197 N 0.75 1.23 -0.17 2.04 2.07 -1.83 -2.22 116.25 118.12 2dsd h VAL 197 Ca 0.08 -0.96 -0.21 0.00 0.82 0.00 0.00 66.70 66.42 2dsd h VAL 197 Cb 0.90 0.89 0.01 0.00 -1.52 0.00 0.00 31.29 31.57 2dsd h VAL 197 CO 0.08 0.34 -0.72 0.22 0.02 0.00 0.00 177.57 177.51 2dsd h TYR 198 N 0.69 1.00 -0.00 1.57 3.20 -1.05 -2.15 116.97 120.23 2dsd h TYR 198 Ca 0.14 -0.42 -0.06 0.00 3.14 0.00 0.00 58.73 61.53 2dsd h TYR 198 Cb 0.43 -0.16 -0.01 0.00 1.54 0.00 0.00 36.73 38.53 2dsd h TYR 198 CO 0.02 1.24 -0.29 0.77 -1.64 0.00 0.00 178.16 178.26 2dsd h SER 199 N 0.53 0.00 -0.13 -2.11 0.02 -1.00 0.17 113.55 111.04 2dsd h SER 199 Ca -0.03 -0.00 -0.12 0.00 -0.84 0.00 0.00 61.79 60.80 2dsd h SER 199 Cb 1.33 -0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.87 2dsd h SER 199 CO 0.15 0.30 -0.37 0.22 -1.14 0.00 0.00 176.83 175.98 2dsd h TYR 200 N 0.00 0.62 0.00 3.45 3.20 -1.32 -2.44 116.97 120.48 2dsd h TYR 200 Ca -0.00 -0.25 -0.09 0.00 3.14 0.00 0.00 58.73 61.53 2dsd h TYR 200 Cb 0.52 -0.11 -0.01 0.00 1.54 0.00 0.00 36.73 38.67 2dsd h TYR 200 CO 0.00 0.99 -0.43 0.00 -1.64 0.00 0.00 178.16 177.08 2dsd h ALA 201 N 0.51 1.29 -0.39 1.82 0.00 -0.75 -2.18 119.26 119.56 2dsd h ALA 201 Ca -0.01 -0.39 -0.15 0.00 0.00 0.00 0.00 54.91 54.36 2dsd h ALA 201 Cb 0.99 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.70 2dsd h ALA 201 CO 0.08 0.54 -0.34 -0.07 0.00 0.00 0.00 179.25 179.45 2dsd h LEU 202 N 0.00 0.94 -0.67 0.00 3.38 -0.64 -2.62 115.31 115.70 2dsd h LEU 202 Ca -0.00 -0.41 -0.12 0.00 0.09 0.00 0.00 57.88 57.44 2dsd h LEU 202 Cb 0.76 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.23 2dsd h LEU 202 CO 0.06 1.18 -0.20 0.00 0.09 0.00 0.00 178.44 179.56 2dsd h ALA 203 N 0.86 0.85 -0.56 1.53 0.00 -1.18 -0.93 119.26 119.84 2dsd h ALA 203 Ca 0.07 -0.37 0.02 0.00 0.00 0.00 0.00 54.91 54.63 2dsd h ALA 203 Cb 0.92 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.52 2dsd h ALA 203 CO 0.08 0.64 0.37 -0.07 0.00 0.00 0.00 179.25 180.27 2dsd h LEU 204 N 0.72 0.59 -0.02 0.00 3.38 -1.26 0.49 115.31 119.21 2dsd h LEU 204 Ca 0.10 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.03 2dsd h LEU 204 Cb 0.73 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.34 2dsd h LEU 204 CO 0.06 0.41 -0.09 0.50 0.09 0.00 0.00 178.44 179.41 2dsd h LYS 205 N 0.69 0.09 -0.74 1.13 3.64 -1.08 -1.63 116.57 118.67 2dsd h LYS 205 Ca 0.22 -0.08 0.07 0.00 -1.27 0.00 0.00 60.65 59.59 2dsd h LYS 205 Cb 0.02 0.02 -0.06 0.00 -0.41 0.00 0.00 32.23 31.79 2dsd h LYS 205 CO -0.05 0.75 0.42 0.45 -2.27 0.00 0.00 179.45 178.75 2dsd h HIS 206 N -0.54 0.77 -0.08 1.91 3.86 -0.74 -2.76 115.15 117.57 2dsd h HIS 206 Ca -0.01 0.03 -0.07 0.00 -1.16 0.00 0.00 60.37 59.16 2dsd h HIS 206 Cb 0.77 -0.24 0.00 0.00 1.06 0.00 0.00 27.41 29.00 2dsd h HIS 206 CO 0.16 0.36 -0.23 0.00 0.86 0.00 0.00 177.93 179.08 2dsd h ALA 207 N 1.39 0.13 0.00 2.45 0.00 -0.98 -3.51 119.26 118.74 2dsd h ALA 207 Ca 0.34 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2dsd h ALA 207 Cb 0.23 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.01 2dsd h ALA 207 CO -0.20 0.11 0.00 0.09 0.00 0.00 0.00 179.25 179.25