#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 2.36 0.16 1.64 -0.21 -1.26 -4.33 119.66 118.02 2dsd s GLN 15 Ca 0.00 -0.83 -0.13 0.00 0.02 0.00 0.00 55.36 54.42 2dsd s GLN 15 Cb 0.00 -2.01 0.01 0.00 1.00 0.00 0.00 33.01 32.01 2dsd s GLN 15 CO 0.00 0.35 0.37 1.52 -2.12 0.00 0.00 175.29 175.41 2dsd s TYR 16 N -0.12 0.11 0.29 0.91 -0.85 -1.22 -5.00 117.35 111.47 2dsd s TYR 16 Ca -0.04 -0.47 -0.29 0.00 -0.52 0.00 0.00 57.07 55.76 2dsd s TYR 16 Cb -0.13 0.14 -0.09 0.00 0.38 0.00 0.00 41.96 42.26 2dsd s TYR 16 CO 0.03 -0.77 1.09 0.42 -1.52 0.00 0.00 175.55 174.80 2dsd s ILE 17 N -3.90 3.52 -0.07 -3.49 -1.09 -1.26 -2.29 121.20 112.62 2dsd s ILE 17 Ca 0.11 1.49 0.05 0.00 -2.23 0.00 0.00 60.65 60.07 2dsd s ILE 17 Cb 0.02 -3.93 -0.08 0.00 -1.58 0.00 0.00 42.46 36.89 2dsd s ILE 17 CO -0.04 0.33 -0.00 -0.38 -1.23 0.00 0.00 174.94 173.62 2dsd n ILE 18 N 1.06 0.47 -3.63 2.92 5.41 0.38 -4.93 119.36 121.03 2dsd n ILE 18 Ca -0.01 -0.26 -0.08 0.00 1.00 0.00 0.00 62.75 63.40 2dsd n ILE 18 Cb 0.45 -0.82 -0.07 0.00 -0.71 0.00 0.00 39.64 38.50 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 -4.09 -0.36 -0.40 4.38 1.04 -0.83 -4.98 113.70 108.46 2dsd s SER 19 Ca -0.05 0.66 0.04 0.00 0.48 0.00 0.00 55.95 57.07 2dsd s SER 19 Cb 0.02 0.65 0.11 0.00 0.10 0.00 0.00 66.02 66.91 2dsd s SER 19 CO 0.26 -0.15 0.13 -1.61 0.98 0.00 0.00 173.24 172.84 2dsd s GLU 20 N -0.01 1.56 -0.16 4.02 2.02 -1.26 -0.04 118.70 124.84 2dsd s GLU 20 Ca 0.03 -2.05 -0.24 0.00 0.02 0.00 0.00 54.97 52.73 2dsd s GLU 20 Cb -0.04 -3.11 -0.02 0.00 0.10 0.00 0.00 34.13 31.05 2dsd s GLU 20 CO -0.07 -1.01 0.74 -2.00 0.02 0.00 0.00 175.26 172.95 2dsd s GLU 21 N 0.56 4.30 0.55 1.61 2.12 0.13 -4.88 118.70 123.09 2dsd s GLU 21 Ca 0.13 0.87 -0.21 0.00 0.36 0.00 0.00 54.97 56.12 2dsd s GLU 21 Cb -0.21 -3.55 -0.05 0.00 0.26 0.00 0.00 34.13 30.58 2dsd s GLU 21 CO -0.06 -0.22 1.32 -1.17 -0.54 0.00 0.00 175.26 174.59 2dsd s LEU 22 N 1.79 3.83 0.00 2.70 1.98 -1.26 -0.11 118.68 127.61 2dsd s LEU 22 Ca 0.35 2.68 0.00 0.00 -2.89 0.00 0.00 54.13 54.27 2dsd s LEU 22 Cb -0.17 -4.32 0.00 0.00 0.66 0.00 0.00 46.19 42.36 2dsd s LEU 22 CO 0.13 -1.55 0.00 -0.38 -1.89 0.00 0.00 176.35 172.66 2dsd n ILE 23 N -1.09 0.00 -3.46 6.68 5.41 -1.10 -4.75 119.36 121.05 2dsd n ILE 23 Ca 0.11 0.00 -0.13 0.00 1.00 0.00 0.00 62.75 63.73 2dsd n ILE 23 Cb 0.46 -0.33 -0.03 0.00 -0.71 0.00 0.00 39.64 39.03 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 -3.55 -0.56 0.33 4.38 0.15 -1.16 -4.98 113.70 108.30 2dsd s SER 24 Ca 0.00 0.20 0.03 0.00 0.70 0.00 0.00 55.95 56.88 2dsd s SER 24 Cb 0.00 0.55 -0.05 0.00 -1.71 0.00 0.00 66.02 64.81 2dsd s SER 24 CO 0.00 -0.81 0.10 -0.70 1.20 0.00 0.00 173.24 173.03 2dsd s GLU 25 N -2.91 1.65 -0.15 5.44 -6.30 -1.26 -1.10 118.70 114.08 2dsd s GLU 25 Ca -0.02 -1.94 -0.34 0.00 -2.50 0.00 0.00 54.97 50.18 2dsd s GLU 25 Cb -0.01 -0.57 0.13 0.00 0.00 0.00 0.00 34.13 33.68 2dsd s GLU 25 CO -0.06 -0.31 1.14 0.20 0.02 0.00 0.00 175.26 176.25 2dsd s GLY 26 N -3.46 -0.33 0.58 -1.50 0.00 -0.58 -4.90 107.32 97.12 2dsd s GLY 26 Ca 0.34 1.45 0.30 0.00 0.00 0.00 0.00 44.72 46.80 2dsd s GLY 26 CO 0.15 0.48 1.83 1.70 0.00 0.00 0.00 173.10 177.26 2dsd h LYS 27 N 2.00 0.00 0.00 2.90 3.64 -2.02 -3.25 116.57 119.85 2dsd h LYS 27 Ca -0.12 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.26 2dsd h LYS 27 Cb 1.18 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.00 2dsd h LYS 27 CO 0.25 0.00 -0.51 0.91 -2.27 0.00 0.00 179.45 177.82 2dsd n TRP 28 N -3.78 0.00 -4.76 1.91 7.02 -1.26 -4.68 117.44 111.89 2dsd n TRP 28 Ca 0.13 0.00 -0.31 0.00 -1.02 0.00 0.00 57.50 56.30 2dsd n TRP 28 Cb 0.85 0.00 -0.13 0.00 -2.42 0.00 0.00 31.31 29.60 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 -1.51 2.55 -0.08 -0.99 1.01 -1.23 -1.83 120.40 118.32 2dsd s VAL 29 Ca 0.00 -1.26 0.00 0.00 0.00 0.00 0.00 61.98 60.72 2dsd s VAL 29 Cb 0.00 -2.04 0.02 0.00 0.00 0.00 0.00 36.38 34.36 2dsd s VAL 29 CO 0.00 0.35 -0.06 -0.75 0.00 0.00 0.00 175.10 174.65 2dsd s LYS 30 N -1.35 1.14 0.25 2.72 2.20 0.19 -1.53 119.74 123.36 2dsd s LYS 30 Ca 0.13 -0.15 -0.09 0.00 -0.36 0.00 0.00 55.97 55.50 2dsd s LYS 30 Cb -0.10 -1.20 -0.07 0.00 -1.51 0.00 0.00 37.83 34.95 2dsd s LYS 30 CO 0.04 -0.17 0.56 -1.17 -0.36 0.00 0.00 175.35 174.25 2dsd s LEU 31 N 1.36 4.14 0.03 5.43 2.96 -0.25 -0.44 118.68 131.90 2dsd s LEU 31 Ca -0.03 0.90 -0.22 0.00 -0.22 0.00 0.00 54.13 54.56 2dsd s LEU 31 Cb -0.14 -3.67 0.05 0.00 0.50 0.00 0.00 46.19 42.93 2dsd s LEU 31 CO -0.03 -0.11 0.50 -0.70 -1.32 0.00 0.00 176.35 174.70 2dsd s GLU 32 N -2.97 0.98 -0.16 1.98 2.12 0.28 -2.73 118.70 118.20 2dsd s GLU 32 Ca 0.47 -0.19 -0.02 0.00 0.36 0.00 0.00 54.97 55.59 2dsd s GLU 32 Cb -0.11 0.45 -0.02 0.00 0.26 0.00 0.00 34.13 34.71 2dsd s GLU 32 CO 0.23 -0.34 -0.08 0.21 -0.54 0.00 0.00 175.26 174.74 2dsd s LYS 33 N -2.19 3.47 -0.07 4.30 2.20 0.84 -0.20 119.74 128.09 2dsd s LYS 33 Ca -0.07 -0.62 0.03 0.00 -0.36 0.00 0.00 55.97 54.95 2dsd s LYS 33 Cb -0.01 -2.81 -0.02 0.00 -1.51 0.00 0.00 37.83 33.48 2dsd s LYS 33 CO 0.00 0.12 -0.15 0.99 -0.36 0.00 0.00 175.35 175.95 2dsd s THR 34 N 0.63 2.97 -0.11 3.43 2.01 0.31 0.19 115.64 125.07 2dsd s THR 34 Ca -0.05 -0.74 0.02 0.00 0.31 0.00 0.00 61.69 61.24 2dsd s THR 34 Cb -0.15 -2.18 -0.01 0.00 0.01 0.00 0.00 72.50 70.18 2dsd s THR 34 CO 0.03 0.57 -0.19 -0.89 -0.69 0.00 0.00 174.62 173.45 2dsd s THR 35 N -0.41 2.50 0.28 -0.82 2.01 0.95 -0.49 115.64 119.67 2dsd s THR 35 Ca 0.05 -0.86 0.01 0.00 0.31 0.00 0.00 61.69 61.20 2dsd s THR 35 Cb -0.12 -2.00 -0.03 0.00 0.01 0.00 0.00 72.50 70.36 2dsd s THR 35 CO 0.02 0.55 0.28 -0.72 -0.69 0.00 0.00 174.62 174.05 2dsd s TYR 36 N 0.30 1.34 -0.08 4.92 -0.85 0.11 -0.47 117.35 122.61 2dsd s TYR 36 Ca -0.14 -1.44 0.04 0.00 -0.52 0.00 0.00 57.07 55.00 2dsd s TYR 36 Cb -0.17 -0.49 -0.01 0.00 0.38 0.00 0.00 41.96 41.67 2dsd s TYR 36 CO 0.07 -0.85 -0.19 1.41 -1.52 0.00 0.00 175.55 174.47 2dsd s MET 37 N -3.65 2.85 0.80 -3.49 -2.45 -0.97 -0.34 119.30 112.05 2dsd s MET 37 Ca 0.37 -0.80 -0.07 0.00 -1.25 0.00 0.00 55.69 53.94 2dsd s MET 37 Cb 0.03 -2.36 0.17 0.00 1.25 0.00 0.00 34.83 33.92 2dsd s MET 37 CO 0.20 0.36 1.10 -0.40 1.05 0.00 0.00 175.02 177.32 2dsd n ASP 38 N 3.06 0.76 0.19 1.11 5.68 0.66 -3.44 116.55 124.58 2dsd n ASP 38 Ca -0.18 -1.81 0.09 0.00 -0.50 0.00 0.00 54.79 52.39 2dsd n ASP 38 Cb 0.52 -0.78 0.62 0.00 -1.14 0.00 0.00 41.12 40.35 2dsd n ASP 38 CO 0.00 0.00 0.00 -0.65 -1.33 0.00 0.00 177.20 175.22 2dsd h PRO 39 N 0.00 0.06 -0.08 0.11 0.11 -1.89 -2.39 132.00 127.92 2dsd h PRO 39 Ca -0.36 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.75 2dsd h PRO 39 Cb 1.15 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.25 2dsd h PRO 39 CO 0.32 0.04 0.00 0.25 -0.21 0.00 0.00 178.00 178.40 2dsd n THR 40 N -4.51 0.10 -1.05 -1.15 -2.24 -1.26 -4.87 114.28 99.30 2dsd n THR 40 Ca -0.01 -0.14 0.00 0.00 -2.27 0.00 0.00 64.05 61.64 2dsd n THR 40 Cb 0.16 -0.01 0.00 0.00 -2.10 0.00 0.00 70.33 68.38 2dsd n THR 40 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2dsd n GLY 41 N 0.85 0.41 3.77 3.38 0.00 -0.90 -5.05 105.19 107.66 2dsd n GLY 41 Ca 0.12 -1.03 -0.32 0.00 0.00 0.00 0.00 46.02 44.79 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 -2.10 3.00 -0.02 1.61 2.20 -1.26 -4.90 119.74 118.27 2dsd s LYS 42 Ca 0.00 -0.54 -0.15 0.00 -0.36 0.00 0.00 55.97 54.92 2dsd s LYS 42 Cb 0.00 -2.81 -0.05 0.00 -1.51 0.00 0.00 37.83 33.45 2dsd s LYS 42 CO 0.00 0.63 0.42 0.99 -0.36 0.00 0.00 175.35 177.02 2dsd s THR 43 N -1.22 5.06 0.09 3.43 2.01 -1.26 -0.25 115.64 123.50 2dsd s THR 43 Ca 0.24 0.85 -0.03 0.00 0.31 0.00 0.00 61.69 63.06 2dsd s THR 43 Cb -0.12 -3.73 -0.03 0.00 0.01 0.00 0.00 72.50 68.63 2dsd s THR 43 CO 0.15 0.53 0.07 -0.13 -0.69 0.00 0.00 174.62 174.55 2dsd s ARG 44 N -0.74 0.80 0.48 4.92 0.52 0.54 -4.96 118.95 120.51 2dsd s ARG 44 Ca 0.24 -1.23 0.03 0.00 -0.52 0.00 0.00 55.73 54.25 2dsd s ARG 44 Cb -0.16 0.26 0.03 0.00 0.52 0.00 0.00 34.95 35.60 2dsd s ARG 44 CO 0.13 -0.22 0.26 0.25 0.02 0.00 0.00 175.30 175.74 2dsd n THR 45 N -0.02 0.00 -3.48 0.02 -2.24 -1.26 0.06 114.28 107.36 2dsd n THR 45 Ca -0.11 -2.02 0.03 0.00 -2.27 0.00 0.00 64.05 59.68 2dsd n THR 45 Cb 0.62 0.07 -0.05 0.00 -2.10 0.00 0.00 70.33 68.87 2dsd n THR 45 CO 0.00 0.00 0.00 0.86 -0.57 0.00 0.00 175.07 175.36 2dsd s TRP 46 N -2.51 -0.10 -0.02 4.78 -0.11 0.36 -4.89 118.94 116.45 2dsd s TRP 46 Ca 0.20 0.19 -0.28 0.00 1.22 0.00 0.00 56.10 57.43 2dsd s TRP 46 Cb -0.02 0.06 -0.03 0.00 -1.50 0.00 0.00 33.47 31.98 2dsd s TRP 46 CO 0.13 -0.05 0.90 -1.21 -4.62 0.00 0.00 176.95 172.10 2dsd s GLU 47 N 1.43 4.52 0.22 5.86 2.02 -1.26 -0.53 118.70 130.96 2dsd s GLU 47 Ca -0.05 1.27 0.06 0.00 0.02 0.00 0.00 54.97 56.27 2dsd s GLU 47 Cb -0.02 -3.46 -0.05 0.00 0.10 0.00 0.00 34.13 30.70 2dsd s GLU 47 CO -0.12 -0.02 -0.07 -1.12 0.02 0.00 0.00 175.26 173.94 2dsd s SER 48 N 0.95 2.25 0.09 -0.19 0.01 0.73 -4.80 113.70 112.75 2dsd s SER 48 Ca 0.48 -1.12 0.09 0.00 1.31 0.00 0.00 55.95 56.71 2dsd s SER 48 Cb -0.20 -0.08 -0.03 0.00 0.21 0.00 0.00 66.02 65.92 2dsd s SER 48 CO 0.25 -0.34 -0.23 -0.69 0.41 0.00 0.00 173.24 172.64 2dsd s VAL 49 N -3.18 1.89 0.03 3.43 1.01 0.89 -0.55 120.40 123.92 2dsd s VAL 49 Ca 0.25 -1.51 -0.08 0.00 0.00 0.00 0.00 61.98 60.63 2dsd s VAL 49 Cb 0.03 -1.68 0.00 0.00 0.00 0.00 0.00 36.38 34.73 2dsd s VAL 49 CO 0.07 0.08 0.17 -0.54 0.00 0.00 0.00 175.10 174.88 2dsd s LYS 50 N -1.73 0.65 -0.28 2.72 1.02 0.41 -3.18 119.74 119.35 2dsd s LYS 50 Ca 0.09 -0.63 -0.17 0.00 0.02 0.00 0.00 55.97 55.28 2dsd s LYS 50 Cb -0.10 0.27 -0.02 0.00 -0.52 0.00 0.00 37.83 37.45 2dsd s LYS 50 CO 0.04 -0.18 0.48 1.03 -0.92 0.00 0.00 175.35 175.80 2dsd s ARG 51 N -2.45 3.95 0.60 1.68 0.52 -1.26 0.57 118.95 122.57 2dsd s ARG 51 Ca -0.06 0.13 0.32 0.00 -0.52 0.00 0.00 55.73 55.61 2dsd s ARG 51 Cb -0.02 -3.69 1.93 0.00 0.52 0.00 0.00 34.95 33.70 2dsd s ARG 51 CO -0.03 -0.40 2.28 1.79 0.02 0.00 0.00 175.30 178.96 2dsd h THR 52 N 5.45 0.43 -0.69 0.02 1.35 -1.66 -2.89 112.91 114.92 2dsd h THR 52 Ca -0.29 -0.01 -0.72 0.00 -0.55 0.00 0.00 66.41 64.84 2dsd h THR 52 Cb 1.14 1.01 -0.07 0.00 -1.73 0.00 0.00 68.15 68.50 2dsd h THR 52 CO 0.71 0.00 2.94 0.35 -0.25 0.00 0.00 175.52 179.27 2dsd n THR 53 N -3.70 4.71 -4.55 6.82 -2.24 -1.26 -4.87 114.28 109.19 2dsd n THR 53 Ca -0.03 -3.63 -0.33 0.00 -2.27 0.00 0.00 64.05 57.79 2dsd n THR 53 Cb 0.08 -2.33 -0.16 0.00 -2.10 0.00 0.00 70.33 65.82 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 0.47 3.04 0.00 -0.78 3.52 -1.09 -5.06 118.95 119.05 2dsd s ARG 54 Ca 0.58 -0.84 0.00 0.00 -0.13 0.00 0.00 55.73 55.34 2dsd s ARG 54 Cb 0.17 -2.49 0.00 0.00 -1.56 0.00 0.00 34.95 31.07 2dsd s ARG 54 CO -0.07 -0.05 0.00 1.63 -0.81 0.00 0.00 175.30 176.00 2dsd n LYS 55 N 4.17 1.00 -3.23 5.12 4.01 -1.26 -5.08 118.16 122.89 2dsd n LYS 55 Ca -0.20 0.00 -0.25 0.00 -0.51 0.00 0.00 58.31 57.35 2dsd n LYS 55 Cb 0.51 0.00 -0.07 0.00 -0.51 0.00 0.00 35.03 34.96 2dsd n LYS 55 CO 0.00 0.00 0.00 -1.91 -1.11 0.00 0.00 177.40 174.38 2dsd n GLU 56 N 0.00 0.86 0.00 1.97 4.07 -1.26 -5.08 120.64 121.20 2dsd n GLU 56 Ca 0.00 -3.37 0.00 0.00 -0.06 0.00 0.00 57.16 53.73 2dsd n GLU 56 Cb 0.00 -1.35 0.00 0.00 -0.06 0.00 0.00 31.44 30.03 2dsd n GLU 56 CO 0.00 0.00 0.00 1.04 -0.06 0.00 0.00 177.13 178.11 2dsd n GLN 57 N 1.45 3.73 -0.01 5.31 6.02 -1.26 -5.05 117.38 127.56 2dsd n GLN 57 Ca 0.22 0.00 -0.10 0.00 -0.01 0.00 0.00 57.00 57.11 2dsd n GLN 57 Cb 0.51 0.00 -0.14 0.00 1.02 0.00 0.00 30.24 31.63 2dsd n GLN 57 CO 0.00 0.00 0.00 1.79 -1.01 0.00 0.00 177.06 177.84 2dsd h THR 58 N 0.00 0.85 -2.57 5.09 1.35 -1.98 -3.49 112.91 112.17 2dsd h THR 58 Ca 0.00 -2.69 0.10 0.00 -0.55 0.00 0.00 66.41 63.28 2dsd h THR 58 Cb 0.00 2.45 -0.10 0.00 -1.73 0.00 0.00 68.15 68.76 2dsd h THR 58 CO 0.00 0.55 0.39 0.00 -0.25 0.00 0.00 175.52 176.21 2dsd s ALA 59 N -2.60 -1.61 0.16 6.62 0.00 -1.26 -4.76 121.76 118.31 2dsd s ALA 59 Ca -0.06 0.36 -0.16 0.00 0.00 0.00 0.00 51.96 52.10 2dsd s ALA 59 Cb 0.08 0.66 0.04 0.00 0.00 0.00 0.00 23.12 23.90 2dsd s ALA 59 CO 0.82 -0.89 1.81 -0.44 0.00 0.00 0.00 175.76 177.06 2dsd h ASP 60 N 2.00 0.45 -0.55 0.00 3.45 -1.82 -3.44 116.42 116.52 2dsd h ASP 60 Ca -0.24 -0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.21 2dsd h ASP 60 Cb 1.25 -0.10 0.00 0.00 -0.56 0.00 0.00 39.33 39.92 2dsd h ASP 60 CO 0.29 0.33 0.00 0.61 -1.57 0.00 0.00 179.24 178.89 2dsd n GLY 61 N -1.22 2.44 3.27 2.75 0.00 -1.13 -2.52 105.19 108.79 2dsd n GLY 61 Ca 0.01 -0.90 -0.21 0.00 0.00 0.00 0.00 46.02 44.93 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 -3.00 1.56 -0.10 1.61 -7.23 0.77 -1.29 120.40 112.71 2dsd s VAL 62 Ca 0.00 -1.63 0.02 0.00 -1.81 0.00 0.00 61.98 58.56 2dsd s VAL 62 Cb 0.00 -1.54 0.01 0.00 0.56 0.00 0.00 36.38 35.41 2dsd s VAL 62 CO 0.00 -0.23 -0.16 0.00 -0.31 0.00 0.00 175.10 174.40 2dsd s ALA 63 N -1.61 1.72 -0.22 1.32 0.00 0.10 -1.92 121.76 121.14 2dsd s ALA 63 Ca 0.08 -0.74 -0.06 0.00 0.00 0.00 0.00 51.96 51.24 2dsd s ALA 63 Cb -0.08 -0.81 -0.03 0.00 0.00 0.00 0.00 23.12 22.21 2dsd s ALA 63 CO 0.04 -0.01 0.04 0.08 0.00 0.00 0.00 175.76 175.91 2dsd s VAL 64 N 0.87 4.24 -0.59 0.00 1.01 0.51 -0.26 120.40 126.18 2dsd s VAL 64 Ca -0.09 -0.21 -0.19 0.00 0.00 0.00 0.00 61.98 61.49 2dsd s VAL 64 Cb -0.15 -2.95 0.09 0.00 0.00 0.00 0.00 36.38 33.37 2dsd s VAL 64 CO 0.00 0.39 0.73 -0.63 0.00 0.00 0.00 175.10 175.59 2dsd s ILE 65 N 1.19 4.76 -0.40 2.22 1.01 -0.06 -3.67 121.20 126.25 2dsd s ILE 65 Ca 0.04 -0.82 -0.21 0.00 0.00 0.00 0.00 60.65 59.66 2dsd s ILE 65 Cb -0.14 -4.48 0.01 0.00 0.01 0.00 0.00 42.46 37.86 2dsd s ILE 65 CO 0.03 -1.12 0.65 -2.16 0.00 0.00 0.00 174.94 172.34 2dsd s PRO 66 N 2.86 3.46 -0.44 2.79 0.05 -1.26 -0.90 135.00 141.56 2dsd s PRO 66 Ca 0.14 -0.17 -0.13 0.00 0.05 0.00 0.00 61.00 60.88 2dsd s PRO 66 Cb -0.22 -3.89 0.06 0.00 0.05 0.00 0.00 34.50 30.50 2dsd s PRO 66 CO 0.08 -0.90 0.33 0.08 0.05 0.00 0.00 177.00 176.64 2dsd s VAL 67 N 2.82 4.93 -0.28 -0.36 1.01 -0.17 -0.93 120.40 127.41 2dsd s VAL 67 Ca 0.24 -1.07 -0.29 0.00 0.00 0.00 0.00 61.98 60.86 2dsd s VAL 67 Cb -0.14 -3.91 0.01 0.00 0.00 0.00 0.00 36.38 32.34 2dsd s VAL 67 CO 0.18 -0.49 1.06 -0.22 0.00 0.00 0.00 175.10 175.62 2dsd s LEU 68 N 1.59 4.01 -0.23 3.92 0.20 0.95 -0.54 118.68 128.58 2dsd s LEU 68 Ca 0.04 1.20 -0.00 0.00 0.69 0.00 0.00 54.13 56.05 2dsd s LEU 68 Cb -0.23 -3.54 0.03 0.00 -0.43 0.00 0.00 46.19 42.02 2dsd s LEU 68 CO 0.06 -0.78 -0.10 -1.10 -0.29 0.00 0.00 176.35 174.13 2dsd s GLN 69 N 3.44 2.81 -0.05 1.98 -0.21 0.31 -1.30 119.66 126.65 2dsd s GLN 69 Ca 0.45 -0.98 0.05 0.00 0.02 0.00 0.00 55.36 54.90 2dsd s GLN 69 Cb -0.13 -2.86 -0.01 0.00 1.00 0.00 0.00 33.01 31.01 2dsd s GLN 69 CO 0.11 -0.37 -0.22 1.03 -2.12 0.00 0.00 175.29 173.73 2dsd s ARG 70 N 1.29 2.18 0.34 2.91 3.00 -1.26 -0.78 118.95 126.63 2dsd s ARG 70 Ca 0.00 -0.78 -0.28 0.00 0.00 0.00 0.00 55.73 54.67 2dsd s ARG 70 Cb -0.16 -1.89 -0.12 0.00 0.00 0.00 0.00 34.95 32.78 2dsd s ARG 70 CO -0.07 0.34 1.25 0.25 0.00 0.00 0.00 175.30 177.08 2dsd n THR 71 N 2.98 2.02 -1.21 0.02 -2.24 -1.26 -1.96 114.28 112.63 2dsd n THR 71 Ca -0.17 -0.50 -0.07 0.00 -2.27 0.00 0.00 64.05 61.03 2dsd n THR 71 Cb 0.52 -1.50 -0.03 0.00 -2.10 0.00 0.00 70.33 67.22 2dsd n THR 71 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2dsd n LEU 72 N 0.79 -0.14 -4.42 3.22 4.77 -1.26 -4.98 117.00 114.98 2dsd n LEU 72 Ca 0.05 0.18 -0.22 0.00 -0.03 0.00 0.00 56.01 56.00 2dsd n LEU 72 Cb 0.36 -2.12 -0.10 0.00 -2.33 0.00 0.00 43.42 39.23 2dsd n LEU 72 CO 0.62 -0.78 -0.47 -1.00 -1.33 0.00 0.00 177.39 174.44 2dsd s HIS 73 N -1.88 2.06 0.56 -1.77 3.76 -0.83 -5.13 115.29 112.06 2dsd s HIS 73 Ca 0.00 -0.43 -0.17 0.00 -0.15 0.00 0.00 55.06 54.32 2dsd s HIS 73 Cb 0.00 -0.92 -0.05 0.00 1.11 0.00 0.00 32.58 32.72 2dsd s HIS 73 CO 0.00 0.57 1.05 0.71 -0.85 0.00 0.00 174.74 176.22 2dsd s TYR 74 N -2.66 3.04 0.35 1.40 1.51 -1.26 -4.71 117.35 115.01 2dsd s TYR 74 Ca 0.27 1.52 -0.26 0.00 -1.01 0.00 0.00 57.07 57.59 2dsd s TYR 74 Cb -0.03 -3.00 -0.09 0.00 -0.11 0.00 0.00 41.96 38.72 2dsd s TYR 74 CO 0.12 -0.98 1.00 -1.21 -1.11 0.00 0.00 175.55 173.37 2dsd s GLU 75 N -3.89 4.42 -0.06 -0.62 2.02 -1.26 -4.69 118.70 114.62 2dsd s GLU 75 Ca 0.64 1.45 0.01 0.00 0.02 0.00 0.00 54.97 57.09 2dsd s GLU 75 Cb -0.15 -2.73 -0.03 0.00 0.10 0.00 0.00 34.13 31.31 2dsd s GLU 75 CO 0.33 0.11 -0.07 0.00 0.02 0.00 0.00 175.26 175.64 2dsd s ILE 77 N -0.81 5.25 -0.34 0.00 -1.09 0.16 -0.04 121.20 124.32 2dsd s ILE 77 Ca 0.12 0.10 -0.27 0.00 -2.23 0.00 0.00 60.65 58.38 2dsd s ILE 77 Cb -0.11 -3.68 0.01 0.00 -1.58 0.00 0.00 42.46 37.11 2dsd s ILE 77 CO 0.02 0.08 0.97 -0.69 -1.23 0.00 0.00 174.94 174.09 2dsd s VAL 78 N 1.87 4.57 0.40 2.92 1.01 -0.11 -2.11 120.40 128.95 2dsd s VAL 78 Ca 0.09 1.40 0.07 0.00 0.00 0.00 0.00 61.98 63.55 2dsd s VAL 78 Cb -0.16 -4.35 -0.05 0.00 0.00 0.00 0.00 36.38 31.81 2dsd s VAL 78 CO 0.11 -0.49 0.15 -0.76 0.00 0.00 0.00 175.10 174.11 2dsd s LEU 79 N 3.50 3.10 0.06 3.92 1.43 0.13 -4.41 118.68 126.41 2dsd s LEU 79 Ca 0.40 -1.07 0.07 0.00 -1.03 0.00 0.00 54.13 52.50 2dsd s LEU 79 Cb -0.12 -1.42 -0.03 0.00 0.03 0.00 0.00 46.19 44.66 2dsd s LEU 79 CO 0.17 -0.50 -0.19 0.68 0.23 0.00 0.00 176.35 176.74 2dsd s VAL 80 N -2.59 1.55 -0.15 -1.59 -7.23 0.14 -1.30 120.40 109.23 2dsd s VAL 80 Ca 0.40 -1.27 -0.00 0.00 -1.81 0.00 0.00 61.98 59.30 2dsd s VAL 80 Cb 0.04 -1.38 -0.00 0.00 0.56 0.00 0.00 36.38 35.59 2dsd s VAL 80 CO 0.22 0.07 -0.14 -0.75 -0.31 0.00 0.00 175.10 174.19 2dsd s LYS 81 N -1.41 3.25 -0.03 4.82 2.20 0.43 0.29 119.74 129.29 2dsd s LYS 81 Ca 0.06 -0.73 -0.10 0.00 -0.36 0.00 0.00 55.97 54.83 2dsd s LYS 81 Cb -0.09 -2.65 0.02 0.00 -1.51 0.00 0.00 37.83 33.60 2dsd s LYS 81 CO 0.02 0.04 0.24 -0.65 -0.36 0.00 0.00 175.35 174.64 2dsd s GLN 82 N 0.77 0.49 0.06 4.03 -0.21 -0.67 -1.24 119.66 122.89 2dsd s GLN 82 Ca -0.06 -0.10 -0.31 0.00 0.02 0.00 0.00 55.36 54.92 2dsd s GLN 82 Cb -0.15 0.22 -0.05 0.00 1.00 0.00 0.00 33.01 34.02 2dsd s GLN 82 CO 0.01 -0.12 1.18 0.12 -2.12 0.00 0.00 175.29 174.36 2dsd s PHE 83 N -0.90 3.46 -0.35 0.91 5.36 -1.26 -1.24 117.98 123.95 2dsd s PHE 83 Ca -0.10 1.33 0.02 0.00 -0.96 0.00 0.00 56.93 57.22 2dsd s PHE 83 Cb -0.05 -3.40 0.10 0.00 -0.34 0.00 0.00 43.02 39.33 2dsd s PHE 83 CO 0.02 -1.18 0.07 1.03 -1.46 0.00 0.00 175.22 173.70 2dsd s ARG 84 N 1.05 1.73 0.31 10.12 1.81 0.11 -4.95 118.95 129.13 2dsd s ARG 84 Ca 0.58 -1.78 0.03 0.00 -1.72 0.00 0.00 55.73 52.84 2dsd s ARG 84 Cb -0.29 -3.27 0.78 0.00 -0.45 0.00 0.00 34.95 31.73 2dsd s ARG 84 CO 0.29 -0.92 1.59 -1.35 -0.68 0.00 0.00 175.30 174.23 2dsd h PRO 85 N 7.75 0.05 0.00 3.54 0.11 -1.95 0.63 132.00 142.14 2dsd h PRO 85 Ca -0.09 -0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.01 2dsd h PRO 85 Cb 1.03 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.13 2dsd h PRO 85 CO 0.56 0.03 -0.06 -1.35 -0.21 0.00 0.00 178.00 176.97 2dsd h PRO 86 N 0.05 0.00 0.00 1.05 0.11 -1.95 -2.71 132.00 128.55 2dsd h PRO 86 Ca 0.60 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.69 2dsd h PRO 86 Cb 1.27 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.38 2dsd h PRO 86 CO -0.84 0.06 -1.65 -1.33 -0.21 0.00 0.00 178.00 174.03 2dsd n MET 87 N -3.56 0.64 -2.00 1.05 2.81 0.21 -4.98 117.12 111.28 2dsd n MET 87 Ca -0.02 -0.07 -0.11 0.00 -1.81 0.00 0.00 57.70 55.69 2dsd n MET 87 Cb 0.18 -1.64 -0.01 0.00 -0.71 0.00 0.00 33.22 31.04 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 1.26 0.22 0.00 3.03 0.00 -0.26 -4.93 105.19 104.50 2dsd n GLY 88 Ca -0.04 -0.45 0.00 0.00 0.00 0.00 0.00 46.02 45.53 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 -1.15 1.19 3.91 -0.02 0.00 -1.23 -5.02 105.19 102.86 2dsd n GLY 89 Ca -0.13 -0.78 -0.32 0.00 0.00 0.00 0.00 46.02 44.79 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 -3.53 3.53 0.03 1.61 1.51 -1.26 0.09 117.35 119.33 2dsd s TYR 90 Ca 0.00 0.37 0.03 0.00 -1.01 0.00 0.00 57.07 56.46 2dsd s TYR 90 Cb 0.00 -1.85 -0.02 0.00 -0.11 0.00 0.00 41.96 39.99 2dsd s TYR 90 CO 0.00 0.59 -0.09 0.00 -1.11 0.00 0.00 175.55 174.94 2dsd s ILE 92 N -0.90 5.24 0.20 0.00 -1.09 0.02 -1.67 121.20 123.00 2dsd s ILE 92 Ca -0.03 0.24 0.00 0.00 -2.23 0.00 0.00 60.65 58.62 2dsd s ILE 92 Cb -0.07 -3.65 -0.04 0.00 -1.58 0.00 0.00 42.46 37.12 2dsd s ILE 92 CO 0.01 0.14 0.09 -1.61 -1.23 0.00 0.00 174.94 172.34 2dsd s GLU 93 N 1.89 1.21 0.18 2.79 2.02 0.15 -0.92 118.70 126.02 2dsd s GLU 93 Ca 0.10 -1.63 -0.30 0.00 0.02 0.00 0.00 54.97 53.16 2dsd s GLU 93 Cb -0.16 0.02 -0.08 0.00 0.10 0.00 0.00 34.13 34.01 2dsd s GLU 93 CO 0.11 -0.30 0.98 -0.06 0.02 0.00 0.00 175.26 176.01 2dsd s PHE 94 N -3.94 3.83 0.19 1.61 2.99 -1.26 0.24 117.98 121.64 2dsd s PHE 94 Ca 0.34 1.81 -0.32 0.00 0.00 0.00 0.00 56.93 58.76 2dsd s PHE 94 Cb 0.07 -3.08 -0.15 0.00 0.00 0.00 0.00 43.02 39.86 2dsd s PHE 94 CO 0.10 0.13 1.17 -2.30 -0.00 0.00 0.00 175.22 174.32 2dsd n PRO 95 N 2.11 1.25 -3.66 0.24 -0.02 -1.24 -4.64 135.00 129.04 2dsd n PRO 95 Ca 0.00 0.44 -0.13 0.00 -2.02 0.00 0.00 63.50 61.79 2dsd n PRO 95 Cb 0.48 -1.95 -0.07 0.00 -0.02 0.00 0.00 33.50 31.94 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 -0.24 -1.07 0.11 3.55 0.00 -1.26 -0.37 121.76 122.48 2dsd s ALA 96 Ca 0.72 0.44 -0.26 0.00 0.00 0.00 0.00 51.96 52.86 2dsd s ALA 96 Cb -0.82 0.26 0.07 0.00 0.00 0.00 0.00 23.12 22.63 2dsd s ALA 96 CO 0.52 -0.41 0.91 0.20 0.00 0.00 0.00 175.76 176.98 2dsd s GLY 97 N -1.79 -0.32 0.33 0.00 0.00 -0.81 -5.00 107.32 99.72 2dsd s GLY 97 Ca -0.07 0.42 -0.27 0.00 0.00 0.00 0.00 44.72 44.80 2dsd s GLY 97 CO 0.00 0.12 1.00 1.08 0.00 0.00 0.00 173.10 175.30 2dsd s LEU 98 N -2.78 4.36 0.09 0.66 1.43 -1.26 -0.17 118.68 121.02 2dsd s LEU 98 Ca 0.09 1.98 -0.30 0.00 -1.03 0.00 0.00 54.13 54.87 2dsd s LEU 98 Cb -0.01 -3.94 -0.06 0.00 0.03 0.00 0.00 46.19 42.21 2dsd s LEU 98 CO -0.02 -0.17 1.07 -0.63 0.23 0.00 0.00 176.35 176.83 2dsd s ILE 99 N -1.49 4.29 0.57 -0.59 1.01 -1.05 -4.84 121.20 119.09 2dsd s ILE 99 Ca 0.50 1.78 -0.16 0.00 0.00 0.00 0.00 60.65 62.77 2dsd s ILE 99 Cb -0.23 -4.14 -0.05 0.00 0.01 0.00 0.00 42.46 38.05 2dsd s ILE 99 CO 0.29 0.22 1.03 -1.81 0.00 0.00 0.00 174.94 174.66 2dsd s ASP 100 N 0.49 6.10 0.11 3.58 -0.00 -1.26 -4.95 116.67 120.73 2dsd s ASP 100 Ca 0.52 1.72 -0.31 0.00 -0.00 0.00 0.00 52.55 54.48 2dsd s ASP 100 Cb -0.26 -2.52 -0.10 0.00 -0.00 0.00 0.00 42.92 40.04 2dsd s ASP 100 CO 0.31 -0.95 1.87 -1.81 -0.00 0.00 0.00 175.17 174.58 2dsd s ASP 101 N -2.93 6.42 -0.26 0.27 1.01 -1.26 -2.58 116.67 117.34 2dsd s ASP 101 Ca 0.62 2.75 -0.00 0.00 0.71 0.00 0.00 52.55 56.63 2dsd s ASP 101 Cb -0.14 -2.56 0.00 0.00 1.01 0.00 0.00 42.92 41.24 2dsd s ASP 101 CO 0.35 -1.02 0.22 0.61 0.21 0.00 0.00 175.17 175.54 2dsd n GLY 102 N 4.32 0.33 3.04 0.21 0.00 -1.26 -5.06 105.19 106.76 2dsd n GLY 102 Ca 0.18 -0.38 -0.12 0.00 0.00 0.00 0.00 46.02 45.71 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 -4.47 0.24 0.29 1.61 2.12 -1.07 -5.16 118.70 112.26 2dsd s GLU 103 Ca 0.02 0.05 -0.14 0.00 0.36 0.00 0.00 54.97 55.26 2dsd s GLU 103 Cb -0.01 0.11 -0.08 0.00 0.26 0.00 0.00 34.13 34.40 2dsd s GLU 103 CO 0.16 -0.04 0.69 -0.08 -0.54 0.00 0.00 175.26 175.45 2dsd s THR 104 N -0.26 4.72 0.24 -1.70 -1.32 -1.26 -4.82 115.64 111.23 2dsd s THR 104 Ca -0.03 0.88 -0.08 0.00 -1.21 0.00 0.00 61.69 61.24 2dsd s THR 104 Cb -0.03 -3.64 0.26 0.00 -1.51 0.00 0.00 72.50 67.59 2dsd s THR 104 CO 0.00 -0.11 1.64 -0.65 -2.21 0.00 0.00 174.62 173.29 2dsd h PRO 105 N 2.45 0.10 -0.83 7.08 0.11 -1.98 0.15 132.00 139.07 2dsd h PRO 105 Ca -0.48 -0.01 0.07 0.00 0.11 0.00 0.00 66.00 65.70 2dsd h PRO 105 Cb 1.18 -0.02 -0.06 0.00 0.11 0.00 0.00 31.00 32.20 2dsd h PRO 105 CO 0.66 0.06 0.51 0.93 -0.21 0.00 0.00 178.00 179.95 2dsd h GLU 106 N 0.10 0.88 -0.41 1.05 3.07 -1.99 0.25 114.58 117.53 2dsd h GLU 106 Ca 0.39 -0.05 -0.14 0.00 -0.50 0.00 0.00 59.36 59.06 2dsd h GLU 106 Cb 0.66 -0.20 -0.01 0.00 -0.84 0.00 0.00 28.75 28.36 2dsd h GLU 106 CO -0.64 0.58 -0.29 0.00 -1.40 0.00 0.00 179.01 177.27 2dsd h ALA 107 N 1.41 0.72 -0.65 3.43 0.00 -1.20 -1.68 119.26 121.29 2dsd h ALA 107 Ca 0.37 -0.41 -0.08 0.00 0.00 0.00 0.00 54.91 54.79 2dsd h ALA 107 Cb 0.22 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 2dsd h ALA 107 CO -0.19 0.66 0.10 0.00 0.00 0.00 0.00 179.25 179.83 2dsd h ALA 108 N 0.92 0.95 -0.08 0.00 0.00 0.24 -1.84 119.26 119.44 2dsd h ALA 108 Ca 0.09 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.72 2dsd h ALA 108 Cb 0.85 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 18.39 2dsd h ALA 108 CO 0.07 0.65 0.04 0.00 0.00 0.00 0.00 179.25 180.02 2dsd h ALA 109 N 1.10 0.11 -0.04 0.00 0.00 -0.31 0.79 119.26 120.90 2dsd h ALA 109 Ca 0.20 -0.07 -0.09 0.00 0.00 0.00 0.00 54.91 54.95 2dsd h ALA 109 Cb 0.43 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 2dsd h ALA 109 CO 0.01 -0.33 -0.39 -0.07 0.00 0.00 0.00 179.25 178.47 2dsd h LEU 110 N 0.00 0.09 0.00 0.00 3.38 -1.20 -2.24 115.31 115.34 2dsd h LEU 110 Ca 0.03 -0.03 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 2dsd h LEU 110 Cb 0.13 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.85 2dsd h LEU 110 CO -0.00 0.48 -0.00 -0.09 0.09 0.00 0.00 178.44 178.91 2dsd h ARG 111 N 0.08 -0.00 0.00 1.13 2.43 -1.14 -2.77 114.38 114.10 2dsd h ARG 111 Ca 0.01 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.17 2dsd h ARG 111 Cb 0.73 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.28 2dsd h ARG 111 CO 0.05 0.68 -0.04 1.49 -1.51 0.00 0.00 179.97 180.64 2dsd h GLU 112 N -0.68 0.00 0.00 0.20 4.57 -0.82 -0.84 114.58 117.01 2dsd h GLU 112 Ca -0.00 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.17 2dsd h GLU 112 Cb 0.68 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.27 2dsd h GLU 112 CO 0.00 0.04 -0.05 1.25 -1.18 0.00 0.00 179.01 179.07 2dsd h LEU 113 N 0.00 0.04 -1.44 1.64 5.85 -1.38 -2.20 115.31 117.82 2dsd h LEU 113 Ca -0.00 -0.84 -0.04 0.00 0.84 0.00 0.00 57.88 57.84 2dsd h LEU 113 Cb 0.16 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.17 2dsd h LEU 113 CO 0.01 0.88 -0.01 -0.08 -0.34 0.00 0.00 178.44 178.90 2dsd h GLU 114 N -0.79 0.35 -0.04 1.25 4.81 -1.18 0.14 114.58 119.12 2dsd h GLU 114 Ca -0.01 -0.06 -0.23 0.00 -0.13 0.00 0.00 59.36 58.93 2dsd h GLU 114 Cb 0.89 -0.06 0.02 0.00 0.63 0.00 0.00 28.75 30.23 2dsd h GLU 114 CO 0.01 0.39 -0.88 0.93 -0.73 0.00 0.00 179.01 178.72 2dsd h GLU 115 N 0.34 0.66 0.00 1.92 5.08 -1.22 -1.06 114.58 120.30 2dsd h GLU 115 Ca 0.08 -0.66 -0.08 0.00 -1.00 0.00 0.00 59.36 57.69 2dsd h GLU 115 Cb 0.25 0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.66 2dsd h GLU 115 CO 0.01 1.26 -0.97 0.93 -1.00 0.00 0.00 179.01 179.24 2dsd h GLU 116 N 0.32 0.00 0.00 2.33 5.08 -1.18 -2.13 114.58 119.00 2dsd h GLU 116 Ca -0.10 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.26 2dsd h GLU 116 Cb 1.54 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.79 2dsd h GLU 116 CO 0.18 0.19 -0.56 0.25 -1.00 0.00 0.00 179.01 178.07 2dsd n THR 117 N -2.90 0.00 0.00 1.13 -2.24 0.48 -4.80 114.28 105.95 2dsd n THR 117 Ca -0.03 -0.04 0.00 0.00 -2.27 0.00 0.00 64.05 61.71 2dsd n THR 117 Cb 0.69 0.39 0.00 0.00 -2.10 0.00 0.00 70.33 69.31 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 1.48 3.17 3.76 3.38 0.00 -0.40 -4.11 105.19 112.47 2dsd n GLY 118 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 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 -2.47 2.71 -0.21 1.61 2.02 -1.26 -4.02 117.35 115.73 2dsd s TYR 119 Ca 0.00 1.48 0.02 0.00 -0.37 0.00 0.00 57.07 58.19 2dsd s TYR 119 Cb 0.00 -3.53 0.04 0.00 -0.40 0.00 0.00 41.96 38.07 2dsd s TYR 119 CO 0.00 -1.96 -0.16 0.15 -1.57 0.00 0.00 175.55 172.01 2dsd s LYS 120 N -2.70 2.69 0.00 -0.62 1.02 -1.26 -2.76 119.74 116.11 2dsd s LYS 120 Ca 0.65 -1.04 0.00 0.00 0.02 0.00 0.00 55.97 55.60 2dsd s LYS 120 Cb -0.33 -2.72 -0.00 0.00 -0.52 0.00 0.00 37.83 34.26 2dsd s LYS 120 CO 0.40 -0.36 0.00 0.41 -0.92 0.00 0.00 175.35 174.88 2dsd n GLY 121 N 4.55 4.18 3.27 -3.33 0.00 -1.26 -4.60 105.19 108.00 2dsd n GLY 121 Ca -0.18 -2.16 -0.30 0.00 0.00 0.00 0.00 46.02 43.37 2dsd n GLY 121 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2dsd s ASP 122 N -1.03 2.90 0.29 1.61 1.01 0.15 -4.94 116.67 116.66 2dsd s ASP 122 Ca 0.00 -0.46 -0.30 0.00 0.71 0.00 0.00 52.55 52.50 2dsd s ASP 122 Cb 0.00 -0.47 -0.11 0.00 1.01 0.00 0.00 42.92 43.35 2dsd s ASP 122 CO 0.00 0.28 1.57 -0.63 0.21 0.00 0.00 175.17 176.60 2dsd s ILE 123 N -0.44 2.17 -0.12 0.77 -1.09 -1.26 -1.25 121.20 119.97 2dsd s ILE 123 Ca 0.06 0.15 -0.12 0.00 -2.23 0.00 0.00 60.65 58.51 2dsd s ILE 123 Cb -0.11 -3.09 -0.05 0.00 -1.58 0.00 0.00 42.46 37.63 2dsd s ILE 123 CO 0.00 0.02 -0.25 0.00 -1.23 0.00 0.00 174.94 173.49 2dsd n ALA 124 N 2.19 1.58 -2.93 9.38 0.00 0.32 -4.84 120.51 126.21 2dsd n ALA 124 Ca 0.08 -0.63 -0.10 0.00 0.00 0.00 0.00 53.44 52.79 2dsd n ALA 124 Cb 0.38 0.14 -0.05 0.00 0.00 0.00 0.00 19.45 19.92 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 -2.56 1.08 0.23 0.00 -1.05 -1.10 -5.01 118.70 110.29 2dsd s GLU 125 Ca -0.22 -0.82 0.11 0.00 -0.15 0.00 0.00 54.97 53.89 2dsd s GLU 125 Cb 0.05 0.44 -0.05 0.00 -0.44 0.00 0.00 34.13 34.14 2dsd s GLU 125 CO 0.31 -0.42 -0.21 0.00 0.95 0.00 0.00 175.26 175.90 2dsd s SER 127 N -3.08 3.27 0.74 0.00 1.04 -1.16 -5.01 113.70 109.50 2dsd s SER 127 Ca 0.25 -1.07 -0.11 0.00 0.48 0.00 0.00 55.95 55.50 2dsd s SER 127 Cb -0.07 -0.25 0.04 0.00 0.10 0.00 0.00 66.02 65.84 2dsd s SER 127 CO 0.13 -0.10 1.10 -2.16 0.98 0.00 0.00 173.24 173.19 2dsd s PRO 128 N -3.58 2.53 0.22 4.02 0.04 -1.26 -4.62 135.00 132.36 2dsd s PRO 128 Ca 0.29 0.51 -0.31 0.00 0.04 0.00 0.00 61.00 61.52 2dsd s PRO 128 Cb -0.02 -1.98 -0.11 0.00 0.04 0.00 0.00 34.50 32.43 2dsd s PRO 128 CO 0.13 -1.28 1.66 0.00 0.04 0.00 0.00 177.00 177.55 2dsd s ALA 129 N -3.29 3.86 0.11 8.56 0.00 -1.26 -4.61 121.76 125.13 2dsd s ALA 129 Ca 0.59 1.54 0.10 0.00 0.00 0.00 0.00 51.96 54.20 2dsd s ALA 129 Cb -0.12 -3.67 -0.04 0.00 0.00 0.00 0.00 23.12 19.29 2dsd s ALA 129 CO 0.53 -0.91 -0.26 0.14 0.00 0.00 0.00 175.76 175.26 2dsd s VAL 130 N 0.86 2.15 0.10 0.00 -7.23 0.50 -4.87 120.40 111.91 2dsd s VAL 130 Ca 0.71 -1.65 -0.30 0.00 -1.81 0.00 0.00 61.98 58.93 2dsd s VAL 130 Cb -0.48 -1.89 -0.06 0.00 0.56 0.00 0.00 36.38 34.51 2dsd s VAL 130 CO 0.36 0.12 1.08 0.00 -0.31 0.00 0.00 175.10 176.35 2dsd h MET 132 N 5.94 0.82 -0.88 0.00 2.86 -1.37 -3.42 114.93 118.88 2dsd h MET 132 Ca -0.43 -0.43 -0.04 0.00 -2.06 0.00 0.00 59.70 56.74 2dsd h MET 132 Cb 1.21 0.02 -0.18 0.00 0.06 0.00 0.00 31.60 32.70 2dsd h MET 132 CO 0.75 1.07 -0.40 0.34 1.06 0.00 0.00 176.91 179.72 2dsd s ASP 133 N -6.69 -1.35 0.23 1.22 -1.08 -1.26 -5.07 116.67 102.68 2dsd s ASP 133 Ca -0.12 -0.79 -0.06 0.00 -0.52 0.00 0.00 52.55 51.07 2dsd s ASP 133 Cb 0.10 1.73 0.41 0.00 -1.46 0.00 0.00 42.92 43.70 2dsd s ASP 133 CO 0.86 -0.14 1.72 -0.65 0.52 0.00 0.00 175.17 177.47 2dsd h PRO 134 N 6.54 0.36 -0.97 4.34 0.11 -1.82 -0.67 132.00 139.89 2dsd h PRO 134 Ca 0.04 -0.02 -0.18 0.00 0.11 0.00 0.00 66.00 65.95 2dsd h PRO 134 Cb 1.18 -0.08 -0.10 0.00 0.11 0.00 0.00 31.00 32.11 2dsd h PRO 134 CO 0.06 0.24 0.22 0.41 -0.21 0.00 0.00 178.00 178.72 2dsd n GLY 135 N -1.33 2.87 0.00 -0.55 0.00 -1.26 -4.11 105.19 100.81 2dsd n GLY 135 Ca 0.13 -0.44 0.00 0.00 0.00 0.00 0.00 46.02 45.71 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 -0.10 0.00 -4.33 0.99 7.94 -1.08 -5.03 117.00 115.39 2dsd n LEU 136 Ca 0.22 0.00 -0.18 0.00 -1.11 0.00 0.00 56.01 54.94 2dsd n LEU 136 Cb 0.93 0.00 -0.09 0.00 0.53 0.00 0.00 43.42 44.78 2dsd n LEU 136 CO 0.23 0.00 -0.22 -0.55 -1.11 0.00 0.00 177.39 175.74 2dsd s SER 137 N -1.45 1.43 0.00 1.96 0.15 -0.28 -0.08 113.70 115.43 2dsd s SER 137 Ca 0.00 -1.50 0.08 0.00 0.70 0.00 0.00 55.95 55.23 2dsd s SER 137 Cb 0.00 0.32 0.13 0.00 -1.71 0.00 0.00 66.02 64.76 2dsd s SER 137 CO 0.00 -0.84 0.94 -0.46 1.20 0.00 0.00 173.24 174.09 2dsd n ASN 138 N -0.78 2.11 -4.71 5.45 6.94 -1.19 -4.30 115.26 118.79 2dsd n ASN 138 Ca 0.01 -1.63 -0.43 0.00 -0.02 0.00 0.00 54.58 52.51 2dsd n ASN 138 Cb 0.65 -0.07 -0.03 0.00 -2.36 0.00 0.00 39.78 37.97 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 1.02 1.92 0.16 0.00 -4.23 -1.26 -0.89 115.64 112.36 2dsd s THR 140 Ca 0.75 -1.99 -0.02 0.00 -1.18 0.00 0.00 61.69 59.25 2dsd s THR 140 Cb -0.55 -1.93 -0.04 0.00 1.34 0.00 0.00 72.50 71.32 2dsd s THR 140 CO 0.35 -0.32 0.10 0.27 -0.54 0.00 0.00 174.62 174.48 2dsd s ILE 141 N -2.12 0.06 -0.13 2.99 -4.36 -0.29 -2.15 121.20 115.21 2dsd s ILE 141 Ca 0.18 -1.90 -0.01 0.00 -0.26 0.00 0.00 60.65 58.66 2dsd s ILE 141 Cb -0.05 -2.18 -0.02 0.00 1.25 0.00 0.00 42.46 41.45 2dsd s ILE 141 CO 0.08 -0.29 -0.09 -1.00 0.24 0.00 0.00 174.94 173.87 2dsd s HIS 142 N -4.08 2.89 -0.37 1.37 3.76 -0.41 -0.37 115.29 118.08 2dsd s HIS 142 Ca 0.29 -0.42 -0.14 0.00 -0.15 0.00 0.00 55.06 54.63 2dsd s HIS 142 Cb 0.07 -1.85 -0.00 0.00 1.11 0.00 0.00 32.58 31.90 2dsd s HIS 142 CO 0.05 -0.07 0.29 0.42 -0.85 0.00 0.00 174.74 174.59 2dsd s ILE 143 N 0.16 5.24 -0.23 0.60 1.01 -1.26 0.01 121.20 126.73 2dsd s ILE 143 Ca -0.05 -0.35 -0.06 0.00 0.00 0.00 0.00 60.65 60.19 2dsd s ILE 143 Cb -0.14 -3.83 -0.03 0.00 0.01 0.00 0.00 42.46 38.47 2dsd s ILE 143 CO 0.04 -0.16 0.04 -0.69 0.00 0.00 0.00 174.94 174.17 2dsd s VAL 144 N 1.78 4.19 -0.18 2.92 1.01 0.64 -2.99 120.40 127.77 2dsd s VAL 144 Ca 0.07 -0.22 -0.26 0.00 0.00 0.00 0.00 61.98 61.57 2dsd s VAL 144 Cb -0.18 -2.93 -0.01 0.00 0.00 0.00 0.00 36.38 33.26 2dsd s VAL 144 CO 0.11 0.38 0.86 -0.89 0.00 0.00 0.00 175.10 175.56 2dsd s THR 145 N 1.33 4.85 -0.07 3.92 2.01 -0.83 -0.88 115.64 125.98 2dsd s THR 145 Ca 0.05 1.68 0.04 0.00 0.31 0.00 0.00 61.69 63.77 2dsd s THR 145 Cb -0.15 -4.16 0.00 0.00 0.01 0.00 0.00 72.50 68.20 2dsd s THR 145 CO 0.02 -0.01 -0.19 -0.69 -0.69 0.00 0.00 174.62 173.07 2dsd s VAL 146 N 2.35 1.60 -0.02 3.82 1.01 -0.08 -0.52 120.40 128.56 2dsd s VAL 146 Ca 0.39 -0.78 -0.05 0.00 0.00 0.00 0.00 61.98 61.53 2dsd s VAL 146 Cb -0.16 -1.39 -0.04 0.00 0.00 0.00 0.00 36.38 34.78 2dsd s VAL 146 CO 0.11 0.46 0.21 0.42 0.00 0.00 0.00 175.10 176.30 2dsd s THR 147 N 0.25 5.39 -0.21 3.92 -4.23 -0.38 -1.00 115.64 119.37 2dsd s THR 147 Ca -0.10 0.07 0.01 0.00 -1.18 0.00 0.00 61.69 60.49 2dsd s THR 147 Cb -0.15 -3.53 0.04 0.00 1.34 0.00 0.00 72.50 70.21 2dsd s THR 147 CO 0.05 0.40 -0.12 -0.63 -0.54 0.00 0.00 174.62 173.78 2dsd s ILE 148 N -1.25 1.83 -0.59 2.99 1.01 0.30 -0.68 121.20 124.82 2dsd s ILE 148 Ca 0.25 -1.14 -0.27 0.00 0.00 0.00 0.00 60.65 59.49 2dsd s ILE 148 Cb -0.13 -1.87 0.00 0.00 0.01 0.00 0.00 42.46 40.48 2dsd s ILE 148 CO 0.15 0.18 1.55 0.21 0.00 0.00 0.00 174.94 177.03 2dsd s ASN 149 N 1.31 5.87 0.00 3.58 2.47 -1.26 -0.53 114.94 126.39 2dsd s ASN 149 Ca -0.02 0.25 0.13 0.00 0.42 0.00 0.00 52.86 53.64 2dsd s ASN 149 Cb -0.17 -2.54 0.79 0.00 -1.45 0.00 0.00 41.25 37.89 2dsd s ASN 149 CO -0.08 -1.92 1.47 0.61 -3.72 0.00 0.00 177.10 173.45 2dsd n GLY 150 N 5.42 -0.95 0.95 1.21 0.00 0.04 -2.89 105.19 108.97 2dsd n GLY 150 Ca 0.14 -0.08 0.10 0.00 0.00 0.00 0.00 46.02 46.18 2dsd n GLY 150 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2dsd n ASP 151 N -0.72 3.06 -4.88 1.61 8.00 -1.26 -4.72 116.55 117.64 2dsd n ASP 151 Ca 0.10 -1.91 -0.32 0.00 0.71 0.00 0.00 54.79 53.37 2dsd n ASP 151 Cb 0.05 -0.15 -0.05 0.00 -0.02 0.00 0.00 41.12 40.95 2dsd n ASP 151 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2dsd s ASP 152 N -1.46 6.56 0.21 -2.24 -1.08 -1.14 -5.01 116.67 112.51 2dsd s ASP 152 Ca 0.31 0.75 -0.10 0.00 -0.52 0.00 0.00 52.55 52.98 2dsd s ASP 152 Cb 0.19 -2.15 0.16 0.00 -1.46 0.00 0.00 42.92 39.65 2dsd s ASP 152 CO 0.27 0.02 1.86 0.00 0.52 0.00 0.00 175.17 177.83 2dsd h ALA 153 N 2.81 0.98 0.00 3.66 0.00 -1.91 -2.50 119.26 122.29 2dsd h ALA 153 Ca -0.47 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.36 2dsd h ALA 153 Cb 1.17 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.65 2dsd h ALA 153 CO 0.71 0.44 0.00 1.05 0.00 0.00 0.00 179.25 181.44 2dsd h GLU 154 N 1.05 0.00 -0.38 0.00 4.11 -1.95 -1.13 114.58 116.29 2dsd h GLU 154 Ca 0.28 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.71 2dsd h GLU 154 Cb -0.05 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.20 2dsd h GLU 154 CO -0.05 0.00 0.00 0.09 0.07 0.00 0.00 179.01 179.12 2dsd n ASN 155 N -3.02 3.02 0.09 3.06 3.02 -0.96 -4.40 115.26 116.06 2dsd n ASN 155 Ca -0.03 -1.95 -0.12 0.00 -0.03 0.00 0.00 54.58 52.45 2dsd n ASN 155 Cb 0.09 -0.25 -0.08 0.00 -0.61 0.00 0.00 39.78 38.93 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 2.49 -0.26 -2.86 5.41 0.00 -1.03 -3.38 119.26 119.64 2dsd h ALA 156 Ca 0.00 -0.20 -0.61 0.00 0.00 0.00 0.00 54.91 54.09 2dsd h ALA 156 Cb 0.76 0.10 -0.41 0.00 0.00 0.00 0.00 17.79 18.24 2dsd h ALA 156 CO 0.00 -0.42 -0.70 1.03 0.00 0.00 0.00 179.25 179.16 2dsd s ARG 157 N -4.26 1.97 0.21 0.00 0.52 -1.26 -5.10 118.95 111.03 2dsd s ARG 157 Ca -0.14 -2.95 -0.31 0.00 -0.52 0.00 0.00 55.73 51.81 2dsd s ARG 157 Cb 0.02 -2.78 -0.10 0.00 0.52 0.00 0.00 34.95 32.60 2dsd s ARG 157 CO 0.55 -1.32 1.56 -1.25 0.02 0.00 0.00 175.30 174.87 2dsd s PRO 158 N -0.97 4.20 -0.42 3.54 0.04 -1.26 -5.00 135.00 135.13 2dsd s PRO 158 Ca 0.27 2.41 -0.11 0.00 0.04 0.00 0.00 61.00 63.61 2dsd s PRO 158 Cb -0.02 -3.11 0.06 0.00 0.04 0.00 0.00 34.50 31.47 2dsd s PRO 158 CO -0.18 -0.58 0.28 0.15 0.04 0.00 0.00 177.00 176.71 2dsd s LYS 159 N 0.53 2.74 0.06 4.56 3.01 -1.26 -4.77 119.74 124.62 2dsd s LYS 159 Ca 0.67 -1.34 -0.31 0.00 -1.01 0.00 0.00 55.97 53.98 2dsd s LYS 159 Cb -0.45 -3.85 -0.06 0.00 -1.01 0.00 0.00 37.83 32.47 2dsd s LYS 159 CO 0.37 -0.91 1.20 -1.25 0.51 0.00 0.00 175.35 175.27 2dsd s PRO 160 N 1.51 4.43 -0.67 -1.68 0.04 -1.26 -4.12 135.00 133.25 2dsd s PRO 160 Ca 0.03 1.78 0.02 0.00 0.04 0.00 0.00 61.00 62.87 2dsd s PRO 160 Cb -0.22 -3.35 0.16 0.00 0.04 0.00 0.00 34.50 31.13 2dsd s PRO 160 CO 0.04 -0.27 0.46 0.15 0.04 0.00 0.00 177.00 177.43 2dsd s LYS 161 N 1.09 2.47 0.41 4.56 3.01 -0.81 -4.91 119.74 125.56 2dsd s LYS 161 Ca 0.59 -2.99 -0.23 0.00 -1.01 0.00 0.00 55.97 52.32 2dsd s LYS 161 Cb -0.30 -3.53 -0.09 0.00 -1.01 0.00 0.00 37.83 32.91 2dsd s LYS 161 CO 0.29 -1.21 1.06 -1.25 0.51 0.00 0.00 175.35 174.75 2dsd s PRO 162 N -0.87 4.09 0.90 -1.68 0.04 -1.19 -4.62 135.00 131.68 2dsd s PRO 162 Ca 0.22 1.51 -0.12 0.00 0.04 0.00 0.00 61.00 62.65 2dsd s PRO 162 Cb -0.14 -2.48 0.13 0.00 0.04 0.00 0.00 34.50 32.05 2dsd s PRO 162 CO -0.09 -0.20 1.12 0.20 0.04 0.00 0.00 177.00 178.07 2dsd s GLY 163 N -1.60 1.58 0.14 0.56 0.00 -1.26 -4.88 107.32 101.86 2dsd s GLY 163 Ca 0.59 -0.42 -0.34 0.00 0.00 0.00 0.00 44.72 44.55 2dsd s GLY 163 CO 0.27 0.12 1.60 1.34 0.00 0.00 0.00 173.10 176.42 2dsd n ASP 164 N -3.77 3.07 0.00 1.64 -0.08 -1.26 -1.19 116.55 114.96 2dsd n ASP 164 Ca 0.06 1.07 0.00 0.00 -1.51 0.00 0.00 54.79 54.42 2dsd n ASP 164 Cb 0.58 -1.41 0.00 0.00 2.34 0.00 0.00 41.12 42.63 2dsd n ASP 164 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2dsd n GLY 165 N 3.47 0.64 3.74 0.27 0.00 -1.26 -5.00 105.19 107.04 2dsd n GLY 165 Ca 0.17 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.84 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 -0.20 4.17 -0.33 1.61 2.12 -0.34 -5.05 118.70 120.68 2dsd s GLU 166 Ca 0.00 -0.13 0.01 0.00 0.36 0.00 0.00 54.97 55.21 2dsd s GLU 166 Cb 0.00 -3.41 0.10 0.00 0.26 0.00 0.00 34.13 31.09 2dsd s GLU 166 CO 0.00 0.31 0.10 -0.06 -0.54 0.00 0.00 175.26 175.07 2dsd s PHE 167 N 0.31 2.16 -0.09 5.30 0.40 -1.26 -4.68 117.98 120.12 2dsd s PHE 167 Ca 0.11 -2.07 0.01 0.00 -0.60 0.00 0.00 56.93 54.37 2dsd s PHE 167 Cb -0.12 -1.99 -0.02 0.00 0.51 0.00 0.00 43.02 41.40 2dsd s PHE 167 CO -0.00 -0.88 -0.11 0.08 0.70 0.00 0.00 175.22 175.01 2dsd s VAL 168 N 1.34 3.32 -0.15 -0.44 1.01 -1.26 -4.45 120.40 119.77 2dsd s VAL 168 Ca 0.11 -0.60 -0.01 0.00 0.00 0.00 0.00 61.98 61.49 2dsd s VAL 168 Cb -0.18 -2.37 -0.01 0.00 0.00 0.00 0.00 36.38 33.82 2dsd s VAL 168 CO -0.19 0.56 -0.12 -0.70 0.00 0.00 0.00 175.10 174.65 2dsd s GLU 169 N -0.24 3.37 0.04 2.72 2.12 -0.38 -4.95 118.70 121.38 2dsd s GLU 169 Ca 0.02 -0.68 -0.24 0.00 0.36 0.00 0.00 54.97 54.43 2dsd s GLU 169 Cb -0.13 -2.69 -0.06 0.00 0.26 0.00 0.00 34.13 31.51 2dsd s GLU 169 CO 0.03 0.13 0.73 0.08 -0.54 0.00 0.00 175.26 175.69 2dsd s VAL 170 N 0.57 4.74 -0.12 3.70 1.01 -1.26 -0.43 120.40 128.61 2dsd s VAL 170 Ca -0.07 1.56 -0.03 0.00 0.00 0.00 0.00 61.98 63.43 2dsd s VAL 170 Cb -0.15 -4.08 0.05 0.00 0.00 0.00 0.00 36.38 32.19 2dsd s VAL 170 CO 0.03 0.39 0.06 -0.63 0.00 0.00 0.00 175.10 174.95 2dsd s ILE 171 N -0.16 0.07 -0.20 2.22 1.01 -0.42 -4.95 121.20 118.77 2dsd s ILE 171 Ca 0.37 0.01 -0.06 0.00 0.00 0.00 0.00 60.65 60.98 2dsd s ILE 171 Cb -0.20 -0.50 -0.03 0.00 0.01 0.00 0.00 42.46 41.74 2dsd s ILE 171 CO 0.22 -0.03 0.02 -0.44 0.00 0.00 0.00 174.94 174.71 2dsd s SER 172 N 2.08 5.01 0.08 3.58 0.01 -1.26 -0.70 113.70 122.50 2dsd s SER 172 Ca 0.03 -0.15 0.09 0.00 1.31 0.00 0.00 55.95 57.23 2dsd s SER 172 Cb -0.14 -1.86 -0.03 0.00 0.21 0.00 0.00 66.02 64.19 2dsd s SER 172 CO -0.06 0.07 -0.24 -0.76 0.41 0.00 0.00 173.24 172.65 2dsd s LEU 173 N 0.96 2.23 0.18 2.44 1.43 -0.90 -4.92 118.68 120.12 2dsd s LEU 173 Ca 0.02 -0.63 -0.32 0.00 -1.03 0.00 0.00 54.13 52.17 2dsd s LEU 173 Cb -0.14 -1.13 -0.12 0.00 0.03 0.00 0.00 46.19 44.82 2dsd s LEU 173 CO 0.02 0.18 1.75 -2.65 0.23 0.00 0.00 176.35 175.88 2dsd n PRO 174 N 1.44 2.75 -0.07 1.29 -0.02 -1.26 0.37 135.00 139.50 2dsd n PRO 174 Ca -0.18 0.99 -0.03 0.00 -2.02 0.00 0.00 63.50 62.27 2dsd n PRO 174 Cb 0.53 -2.85 0.22 0.00 -0.02 0.00 0.00 33.50 31.37 2dsd n PRO 174 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 2dsd h LYS 175 N 7.17 0.68 0.00 -0.52 3.64 -1.22 -0.37 116.57 125.95 2dsd h LYS 175 Ca -0.44 -0.17 0.00 0.00 -1.27 0.00 0.00 60.65 58.77 2dsd h LYS 175 Cb 1.21 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.94 2dsd h LYS 175 CO 0.95 0.70 0.00 0.27 -2.27 0.00 0.00 179.45 179.10 2dsd n ASN 176 N -4.24 0.11 -0.74 4.20 6.94 -1.26 -3.02 115.26 117.25 2dsd n ASN 176 Ca 0.02 0.53 0.01 0.00 -0.02 0.00 0.00 54.58 55.12 2dsd n ASN 176 Cb 0.28 -0.55 0.00 0.00 -2.36 0.00 0.00 39.78 37.15 2dsd n ASN 176 CO 0.00 0.00 0.00 -0.67 -1.03 0.00 0.00 177.26 175.56 2dsd n ASP 177 N -1.63 0.22 -0.16 0.53 4.64 -0.99 -4.98 116.55 114.18 2dsd n ASP 177 Ca 0.03 -1.97 -0.04 0.00 -1.38 0.00 0.00 54.79 51.43 2dsd n ASP 177 Cb 0.15 -0.21 0.02 0.00 -1.04 0.00 0.00 41.12 40.05 2dsd n ASP 177 CO 0.00 0.00 0.00 0.25 -0.82 0.00 0.00 177.20 176.63 2dsd h LEU 178 N 0.23 -0.78 -0.96 -2.67 5.85 -0.98 -0.26 115.31 115.74 2dsd h LEU 178 Ca -0.06 0.18 0.01 0.00 0.84 0.00 0.00 57.88 58.86 2dsd h LEU 178 Cb 1.50 0.43 -0.05 0.00 0.37 0.00 0.00 40.66 42.91 2dsd h LEU 178 CO 0.02 -0.25 0.63 0.25 -0.34 0.00 0.00 178.44 178.75 2dsd h LEU 179 N -0.11 1.09 -0.11 2.25 5.85 -1.88 -0.73 115.31 121.67 2dsd h LEU 179 Ca 0.23 -0.02 -0.22 0.00 0.84 0.00 0.00 57.88 58.71 2dsd h LEU 179 Cb 0.48 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.23 2dsd h LEU 179 CO -0.57 0.78 -1.00 1.56 -0.34 0.00 0.00 178.44 178.86 2dsd h GLN 180 N 1.28 0.19 0.00 1.25 7.50 -1.83 -2.72 115.11 120.78 2dsd h GLN 180 Ca 0.36 -0.25 0.00 0.00 0.50 0.00 0.00 58.65 59.25 2dsd h GLN 180 Cb -0.12 0.08 0.00 0.00 0.05 0.00 0.00 27.48 27.49 2dsd h GLN 180 CO -0.08 1.04 0.00 0.00 -1.50 0.00 0.00 178.83 178.29 2dsd h ARG 181 N 0.08 0.00 0.14 1.46 2.47 -0.82 -1.64 114.38 116.08 2dsd h ARG 181 Ca -0.06 0.00 -0.22 0.00 -1.26 0.00 0.00 59.98 58.43 2dsd h ARG 181 Cb 1.69 0.00 0.02 0.00 -1.65 0.00 0.00 29.97 30.02 2dsd h ARG 181 CO 0.15 0.00 -1.03 -0.07 0.56 0.00 0.00 179.97 179.58 2dsd h LEU 182 N 0.00 0.47 -1.84 3.04 3.38 -1.06 -3.23 115.31 116.07 2dsd h LEU 182 Ca 0.00 -0.92 -0.03 0.00 0.09 0.00 0.00 57.88 57.02 2dsd h LEU 182 Cb 0.62 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 41.21 2dsd h LEU 182 CO 0.00 1.48 -0.13 0.44 0.09 0.00 0.00 178.44 180.32 2dsd h ASP 183 N -0.32 0.00 0.89 -0.43 3.32 -1.32 -0.07 116.42 118.49 2dsd h ASP 183 Ca -0.20 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.85 2dsd h ASP 183 Cb 1.71 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.26 2dsd h ASP 183 CO 0.13 0.13 0.00 0.00 -1.72 0.00 0.00 179.24 177.78 2dsd h ALA 184 N 1.87 1.00 0.09 3.45 0.00 -1.32 -1.99 119.26 122.36 2dsd h ALA 184 Ca -0.00 0.00 -0.37 0.00 0.00 0.00 0.00 54.91 54.54 2dsd h ALA 184 Cb 0.27 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 2dsd h ALA 184 CO 0.02 0.00 -2.09 1.28 0.00 0.00 0.00 179.25 178.45 2dsd n LEU 185 N -2.96 2.58 0.26 0.00 4.77 -0.12 -2.90 117.00 118.63 2dsd n LEU 185 Ca 0.01 0.14 0.12 0.00 -0.03 0.00 0.00 56.01 56.24 2dsd n LEU 185 Cb 0.27 -0.99 0.71 0.00 -2.33 0.00 0.00 43.42 41.08 2dsd n LEU 185 CO 0.25 0.85 0.98 0.58 -1.33 0.00 0.00 177.39 178.72 2dsd h VAL 186 N 0.05 0.67 0.07 4.08 2.07 -1.13 -2.09 116.25 119.98 2dsd h VAL 186 Ca -0.45 -0.49 -0.31 0.00 0.82 0.00 0.00 66.70 66.27 2dsd h VAL 186 Cb 2.01 1.30 -0.02 0.00 -1.52 0.00 0.00 31.29 33.06 2dsd h VAL 186 CO 0.05 0.12 -1.64 0.00 0.02 0.00 0.00 177.57 176.11 2dsd h ALA 187 N 1.88 0.47 -0.32 1.67 0.00 -1.51 -3.35 119.26 118.09 2dsd h ALA 187 Ca -0.00 -1.26 -0.05 0.00 0.00 0.00 0.00 54.91 53.59 2dsd h ALA 187 Cb 0.30 0.40 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 2dsd h ALA 187 CO 0.02 1.32 -0.02 1.49 0.00 0.00 0.00 179.25 182.06 2dsd h GLU 188 N 0.04 0.51 -2.43 0.00 4.81 -1.26 -3.46 114.58 112.78 2dsd h GLU 188 Ca -0.28 -0.11 0.14 0.00 -0.13 0.00 0.00 59.36 58.98 2dsd h GLU 188 Cb 2.00 -0.07 -0.10 0.00 0.63 0.00 0.00 28.75 31.21 2dsd h GLU 188 CO 0.12 0.55 0.44 -1.83 -0.73 0.00 0.00 179.01 177.56 2dsd s GLU 189 N -4.93 1.16 0.03 1.92 -1.05 -0.92 -5.09 118.70 109.83 2dsd s GLU 189 Ca -0.07 -0.58 -0.30 0.00 -0.15 0.00 0.00 54.97 53.86 2dsd s GLU 189 Cb 0.15 0.43 -0.07 0.00 -0.44 0.00 0.00 34.13 34.21 2dsd s GLU 189 CO 0.76 -0.52 1.50 -1.58 0.95 0.00 0.00 175.26 176.37 2dsd s HIS 190 N -3.34 2.70 -0.03 4.83 5.65 -1.26 -4.32 115.29 119.52 2dsd s HIS 190 Ca 0.09 0.62 -0.25 0.00 0.25 0.00 0.00 55.06 55.78 2dsd s HIS 190 Cb -0.02 -3.79 0.05 0.00 -1.18 0.00 0.00 32.58 27.65 2dsd s HIS 190 CO -0.01 -3.02 0.54 -0.51 -0.65 0.00 0.00 174.74 171.08 2dsd s LEU 191 N 2.44 -0.11 -0.11 8.88 1.43 -1.26 -4.81 118.68 125.15 2dsd s LEU 191 Ca 0.68 0.46 0.03 0.00 -1.03 0.00 0.00 54.13 54.28 2dsd s LEU 191 Cb -0.35 2.08 0.01 0.00 0.03 0.00 0.00 46.19 47.96 2dsd s LEU 191 CO 0.29 -0.56 -0.22 -0.89 0.23 0.00 0.00 176.35 175.20 2dsd s THR 192 N -1.34 1.92 0.00 5.49 2.01 -0.93 -4.86 115.64 117.94 2dsd s THR 192 Ca -0.11 -0.93 -0.19 0.00 0.31 0.00 0.00 61.69 60.77 2dsd s THR 192 Cb -0.02 -1.68 -0.06 0.00 0.01 0.00 0.00 72.50 70.75 2dsd s THR 192 CO 0.07 0.53 0.54 -0.69 -0.69 0.00 0.00 174.62 174.38 2dsd s VAL 193 N 0.55 4.92 0.45 3.82 1.01 -1.26 -0.80 120.40 129.09 2dsd s VAL 193 Ca -0.15 1.12 -0.25 0.00 0.00 0.00 0.00 61.98 62.71 2dsd s VAL 193 Cb -0.17 -3.87 -0.08 0.00 0.00 0.00 0.00 36.38 32.26 2dsd s VAL 193 CO 0.05 0.47 1.39 -0.62 0.00 0.00 0.00 175.10 176.39 2dsd s ASP 194 N -0.47 5.93 0.43 3.32 2.15 -0.10 -4.86 116.67 123.06 2dsd s ASP 194 Ca 0.28 2.83 0.10 0.00 0.43 0.00 0.00 52.55 56.20 2dsd s ASP 194 Cb -0.18 -2.65 0.92 0.00 -0.30 0.00 0.00 42.92 40.72 2dsd s ASP 194 CO 0.16 -1.13 2.02 0.00 -0.17 0.00 0.00 175.17 176.05 2dsd h ALA 195 N 2.33 1.69 -0.18 3.66 0.00 -1.96 -1.45 119.26 123.36 2dsd h ALA 195 Ca -0.51 -0.09 -0.10 0.00 0.00 0.00 0.00 54.91 54.22 2dsd h ALA 195 Cb 1.26 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.96 2dsd h ALA 195 CO 0.61 0.24 -0.27 0.00 0.00 0.00 0.00 179.25 179.83 2dsd h ARG 196 N 0.30 0.49 -0.63 0.00 3.08 -1.97 -0.64 114.38 115.02 2dsd h ARG 196 Ca 0.07 -0.30 0.04 0.00 0.07 0.00 0.00 59.98 59.87 2dsd h ARG 196 Cb 0.12 0.03 -0.05 0.00 0.08 0.00 0.00 29.97 30.15 2dsd h ARG 196 CO -0.00 0.89 0.37 0.28 -1.07 0.00 0.00 179.97 180.43 2dsd h VAL 197 N 0.14 1.03 -0.32 2.04 2.07 -1.81 -0.74 116.25 118.65 2dsd h VAL 197 Ca 0.02 -0.24 -0.06 0.00 0.82 0.00 0.00 66.70 67.23 2dsd h VAL 197 Cb 0.85 0.26 -0.01 0.00 -1.52 0.00 0.00 31.29 30.87 2dsd h VAL 197 CO 0.06 0.13 -0.05 0.22 0.02 0.00 0.00 177.57 177.95 2dsd h TYR 198 N 0.70 0.68 -0.63 1.57 3.20 -1.20 -1.43 116.97 119.87 2dsd h TYR 198 Ca 0.26 -0.14 0.06 0.00 3.14 0.00 0.00 58.73 62.06 2dsd h TYR 198 Cb 0.09 -0.17 -0.05 0.00 1.54 0.00 0.00 36.73 38.14 2dsd h TYR 198 CO -0.07 0.76 0.33 0.77 -1.64 0.00 0.00 178.16 178.32 2dsd h SER 199 N 0.39 0.48 0.01 -2.11 0.02 -0.82 0.15 113.55 111.67 2dsd h SER 199 Ca 0.09 0.03 0.01 0.00 -0.84 0.00 0.00 61.79 61.08 2dsd h SER 199 Cb 0.53 -0.06 -0.01 0.00 0.14 0.00 0.00 62.40 63.00 2dsd h SER 199 CO 0.03 0.31 -0.05 0.22 -1.14 0.00 0.00 176.83 176.20 2dsd h TYR 200 N 0.62 -0.12 -0.70 3.45 3.20 -0.97 -2.08 116.97 120.37 2dsd h TYR 200 Ca 0.28 0.00 0.01 0.00 3.14 0.00 0.00 58.73 62.16 2dsd h TYR 200 Cb 0.19 0.05 -0.03 0.00 1.54 0.00 0.00 36.73 38.48 2dsd h TYR 200 CO -0.09 -0.08 0.47 0.00 -1.64 0.00 0.00 178.16 176.82 2dsd h ALA 201 N 0.89 1.50 -0.43 1.82 0.00 -0.55 -1.77 119.26 120.71 2dsd h ALA 201 Ca 0.02 -0.05 -0.12 0.00 0.00 0.00 0.00 54.91 54.75 2dsd h ALA 201 Cb 0.11 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 2dsd h ALA 201 CO -0.04 0.46 -0.23 -0.07 0.00 0.00 0.00 179.25 179.38 2dsd h LEU 202 N 0.95 0.89 -0.70 0.00 3.38 -0.46 -3.11 115.31 116.26 2dsd h LEU 202 Ca 0.26 -0.33 -0.14 0.00 0.09 0.00 0.00 57.88 57.76 2dsd h LEU 202 Cb -0.11 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.39 2dsd h LEU 202 CO -0.06 1.08 -0.52 0.00 0.09 0.00 0.00 178.44 179.03 2dsd h ALA 203 N 0.99 0.88 -0.41 1.53 0.00 -0.87 -0.99 119.26 120.39 2dsd h ALA 203 Ca 0.10 -0.49 0.06 0.00 0.00 0.00 0.00 54.91 54.58 2dsd h ALA 203 Cb 0.77 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 2dsd h ALA 203 CO 0.06 0.67 0.28 -0.07 0.00 0.00 0.00 179.25 180.19 2dsd h LEU 204 N 0.28 0.26 0.02 0.00 3.38 -1.27 -0.02 115.31 117.96 2dsd h LEU 204 Ca 0.01 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 57.72 2dsd h LEU 204 Cb 1.00 -0.06 -0.04 0.00 0.09 0.00 0.00 40.66 41.66 2dsd h LEU 204 CO 0.09 0.17 -1.39 0.50 0.09 0.00 0.00 178.44 177.90 2dsd h LYS 205 N 0.30 0.04 0.00 1.13 3.64 -1.47 -3.36 116.57 116.86 2dsd h LYS 205 Ca 0.18 -0.07 -0.13 0.00 -1.27 0.00 0.00 60.65 59.36 2dsd h LYS 205 Cb 0.34 0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.16 2dsd h LYS 205 CO -0.04 0.80 -0.64 0.45 -2.27 0.00 0.00 179.45 177.76 2dsd h HIS 206 N 0.01 0.00 0.00 1.91 3.86 -0.05 -3.25 115.15 117.63 2dsd h HIS 206 Ca -0.17 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.04 2dsd h HIS 206 Cb 1.91 0.00 0.00 0.00 1.06 0.00 0.00 27.41 30.38 2dsd h HIS 206 CO 0.01 0.64 0.18 0.00 0.86 0.00 0.00 177.93 179.62 2dsd h ALA 207 N 1.36 1.15 0.00 2.45 0.00 -1.19 -3.50 119.26 119.53 2dsd h ALA 207 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2dsd h ALA 207 Cb 1.19 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.98 2dsd h ALA 207 CO 0.08 -0.15 0.00 0.27 0.00 0.00 0.00 179.25 179.45