#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2da0 s SER 2 N 0.00 5.05 -0.42 1.61 0.15 -1.26 -4.95 113.70 113.88 2da0 s SER 2 Ca 0.00 -0.12 -0.39 0.00 0.70 0.00 0.00 55.95 56.14 2da0 s SER 2 Cb 0.00 -0.64 -0.17 0.00 -1.71 0.00 0.00 66.02 63.51 2da0 s SER 2 CO 0.00 -1.32 1.43 -0.24 1.20 0.00 0.00 173.24 174.31 2da0 n SER 3 N -2.46 0.95 0.00 5.45 2.88 -1.26 -4.19 113.62 115.00 2da0 n SER 3 Ca 0.10 0.92 0.00 0.00 -1.33 0.00 0.00 58.87 58.56 2da0 n SER 3 Cb 0.60 -0.74 0.00 0.00 -0.75 0.00 0.00 64.21 63.32 2da0 n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2da0 n GLY 4 N 3.90 0.93 2.98 0.46 0.00 -1.26 -4.91 105.19 107.29 2da0 n GLY 4 Ca 0.30 -1.57 -0.28 0.00 0.00 0.00 0.00 46.02 44.47 2da0 n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2da0 s SER 5 N -4.00 2.31 0.65 1.61 0.15 -1.26 -5.06 113.70 108.09 2da0 s SER 5 Ca 0.00 -0.38 0.05 0.00 0.70 0.00 0.00 55.95 56.32 2da0 s SER 5 Cb 0.00 -0.98 0.11 0.00 -1.71 0.00 0.00 66.02 63.44 2da0 s SER 5 CO 0.00 -0.05 0.89 -0.44 1.20 0.00 0.00 173.24 174.84 2da0 s SER 6 N 1.35 4.71 0.00 5.45 0.01 -1.26 -5.00 113.70 118.95 2da0 s SER 6 Ca -0.00 -0.64 0.00 0.00 1.31 0.00 0.00 55.95 56.61 2da0 s SER 6 Cb -0.14 0.19 0.00 0.00 0.21 0.00 0.00 66.02 66.29 2da0 s SER 6 CO -0.06 -1.61 0.00 0.61 0.41 0.00 0.00 173.24 172.59 2da0 n GLY 7 N -2.54 0.22 0.21 3.44 0.00 -1.26 -5.03 105.19 100.23 2da0 n GLY 7 Ca 0.16 -0.17 -0.14 0.00 0.00 0.00 0.00 46.02 45.87 2da0 n GLY 7 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 2da0 h TYR 8 N 0.00 -0.41 0.00 1.61 -1.99 -1.92 -3.49 116.97 110.76 2da0 h TYR 8 Ca 0.00 -0.01 0.00 0.00 2.00 0.00 0.00 58.73 60.72 2da0 h TYR 8 Cb 0.00 0.14 0.00 0.00 2.00 0.00 0.00 36.73 38.87 2da0 h TYR 8 CO 0.00 -0.11 0.00 0.41 -0.00 0.00 0.00 178.16 178.46 2da0 n GLY 9 N -0.56 3.46 0.18 3.88 0.00 -1.26 -4.98 105.19 105.91 2da0 n GLY 9 Ca -0.10 -0.79 0.07 0.00 0.00 0.00 0.00 46.02 45.19 2da0 n GLY 9 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2da0 h SER 10 N 0.00 0.00 -3.54 1.61 4.64 -1.91 -3.33 113.55 111.02 2da0 h SER 10 Ca 0.00 0.00 -0.67 0.00 -0.47 0.00 0.00 61.79 60.65 2da0 h SER 10 Cb 0.00 0.00 -0.16 0.00 -0.31 0.00 0.00 62.40 61.93 2da0 h SER 10 CO 0.00 0.31 -0.68 -0.70 -0.87 0.00 0.00 176.83 174.89 2da0 s GLU 11 N -3.20 2.65 0.05 4.77 -6.30 -1.26 -4.34 118.70 111.07 2da0 s GLU 11 Ca 0.04 -0.66 -0.23 0.00 -2.50 0.00 0.00 54.97 51.61 2da0 s GLU 11 Cb 0.08 -2.57 0.06 0.00 0.00 0.00 0.00 34.13 31.70 2da0 s GLU 11 CO 0.70 0.62 0.54 0.21 0.02 0.00 0.00 175.26 177.35 2da0 s LYS 12 N -1.36 1.06 -0.01 4.30 2.36 -0.46 -5.03 119.74 120.60 2da0 s LYS 12 Ca 0.17 -0.21 -0.06 0.00 -2.55 0.00 0.00 55.97 53.33 2da0 s LYS 12 Cb -0.11 0.48 0.00 0.00 -1.05 0.00 0.00 37.83 37.16 2da0 s LYS 12 CO 0.07 -0.38 0.12 0.21 1.55 0.00 0.00 175.35 176.92 2da0 s LYS 13 N -2.43 0.37 0.00 4.03 2.20 -1.26 -1.24 119.74 121.41 2da0 s LYS 13 Ca -0.05 -0.24 0.00 0.00 -0.36 0.00 0.00 55.97 55.31 2da0 s LYS 13 Cb -0.01 0.15 0.00 0.00 -1.51 0.00 0.00 37.83 36.47 2da0 s LYS 13 CO -0.01 -0.08 0.00 0.41 -0.36 0.00 0.00 175.35 175.31 2da0 n GLY 14 N 1.94 -0.62 3.06 5.54 0.00 -1.19 -5.05 105.19 108.86 2da0 n GLY 14 Ca -0.20 -0.22 -0.11 0.00 0.00 0.00 0.00 46.02 45.49 2da0 n GLY 14 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2da0 s TYR 15 N -2.94 0.01 0.02 1.61 1.51 -1.26 -2.70 117.35 113.60 2da0 s TYR 15 Ca 0.00 -0.03 0.01 0.00 -1.01 0.00 0.00 57.07 56.04 2da0 s TYR 15 Cb 0.00 -0.04 -0.02 0.00 -0.11 0.00 0.00 41.96 41.80 2da0 s TYR 15 CO 0.00 -0.20 -0.05 -0.51 -1.11 0.00 0.00 175.55 173.68 2da0 s LEU 16 N -0.93 2.16 0.11 -1.29 1.43 -0.90 -4.84 118.68 114.43 2da0 s LEU 16 Ca -0.10 -0.36 -0.22 0.00 -1.03 0.00 0.00 54.13 52.41 2da0 s LEU 16 Cb -0.06 -0.09 -0.07 0.00 0.03 0.00 0.00 46.19 46.00 2da0 s LEU 16 CO 0.01 -0.14 0.68 -0.76 0.23 0.00 0.00 176.35 176.36 2da0 s LEU 17 N -1.01 4.55 -0.11 1.79 1.43 -1.01 -0.19 118.68 124.13 2da0 s LEU 17 Ca -0.08 1.45 0.03 0.00 -1.03 0.00 0.00 54.13 54.51 2da0 s LEU 17 Cb -0.07 -3.10 0.01 0.00 0.03 0.00 0.00 46.19 43.05 2da0 s LEU 17 CO -0.00 0.23 -0.21 -0.75 0.23 0.00 0.00 176.35 175.84 2da0 s LYS 18 N -1.05 2.81 -0.12 1.70 2.20 0.81 -1.70 119.74 124.40 2da0 s LYS 18 Ca 0.33 -0.79 -0.29 0.00 -0.36 0.00 0.00 55.97 54.85 2da0 s LYS 18 Cb -0.21 -2.22 -0.03 0.00 -1.51 0.00 0.00 37.83 33.86 2da0 s LYS 18 CO 0.23 0.07 1.33 0.21 -0.36 0.00 0.00 175.35 176.82 2da0 s LYS 19 N 0.62 4.25 0.60 4.03 2.20 -1.20 -2.10 119.74 128.13 2da0 s LYS 19 Ca -0.13 1.78 -0.18 0.00 -0.36 0.00 0.00 55.97 57.08 2da0 s LYS 19 Cb -0.17 -3.75 -0.03 0.00 -1.51 0.00 0.00 37.83 32.37 2da0 s LYS 19 CO 0.03 -0.68 1.15 0.45 -0.36 0.00 0.00 175.35 175.95 2da0 s SER 20 N 2.11 5.31 -0.28 1.43 0.15 0.38 -4.87 113.70 117.94 2da0 s SER 20 Ca 0.59 2.22 0.02 0.00 0.70 0.00 0.00 55.95 59.48 2da0 s SER 20 Cb -0.25 -2.58 0.07 0.00 -1.71 0.00 0.00 66.02 61.55 2da0 s SER 20 CO 0.19 -1.50 -0.03 1.51 1.20 0.00 0.00 173.24 174.61 2da0 s ASP 21 N -1.91 4.32 0.00 5.45 -4.77 -1.26 -4.26 116.67 114.24 2da0 s ASP 21 Ca 0.73 -1.56 0.00 0.00 -3.30 0.00 0.00 52.55 48.42 2da0 s ASP 21 Cb -0.25 -1.40 0.00 0.00 -1.09 0.00 0.00 42.92 40.17 2da0 s ASP 21 CO 0.33 -0.27 0.00 0.61 0.70 0.00 0.00 175.17 176.54 2da0 n GLY 22 N 4.49 -0.46 0.18 2.12 0.00 -1.26 -4.97 105.19 105.29 2da0 n GLY 22 Ca -0.07 0.20 -0.09 0.00 0.00 0.00 0.00 46.02 46.06 2da0 n GLY 22 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2da0 h ILE 23 N 0.00 1.17 -3.96 -0.61 2.04 -2.06 -3.44 117.51 110.66 2da0 h ILE 23 Ca 0.00 -0.51 -0.33 0.00 1.00 0.00 0.00 64.86 65.03 2da0 h ILE 23 Cb 0.00 0.82 -0.21 0.00 -0.74 0.00 0.00 36.82 36.68 2da0 h ILE 23 CO 0.00 0.19 -0.75 -0.13 0.00 0.00 0.00 178.15 177.45 2da0 s ARG 24 N -5.67 0.64 -1.02 2.37 0.52 -1.26 -5.06 118.95 109.47 2da0 s ARG 24 Ca -0.13 -0.84 -0.02 0.00 -0.52 0.00 0.00 55.73 54.23 2da0 s ARG 24 Cb 0.10 -0.50 0.30 0.00 0.52 0.00 0.00 34.95 35.37 2da0 s ARG 24 CO 0.74 0.10 1.93 1.63 0.02 0.00 0.00 175.30 179.72 2da0 n LYS 25 N 1.39 4.91 -2.29 3.54 5.02 -1.26 -4.35 118.16 125.12 2da0 n LYS 25 Ca -0.22 -4.34 -0.32 0.00 -2.02 0.00 0.00 58.31 51.40 2da0 n LYS 25 Cb 0.54 -2.45 -0.02 0.00 -0.02 0.00 0.00 35.03 33.09 2da0 n LYS 25 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 2da0 s VAL 26 N -4.13 4.21 -0.28 -0.18 -7.23 -1.26 -4.56 120.40 106.96 2da0 s VAL 26 Ca 0.43 1.09 -0.10 0.00 -1.81 0.00 0.00 61.98 61.59 2da0 s VAL 26 Cb 0.23 -3.57 -0.03 0.00 0.56 0.00 0.00 36.38 33.57 2da0 s VAL 26 CO -0.17 -0.58 0.14 0.26 -0.31 0.00 0.00 175.10 174.45 2da0 s TRP 27 N -2.50 3.17 -0.07 2.82 0.52 -1.26 -0.47 118.94 121.15 2da0 s TRP 27 Ca 0.61 -0.25 0.05 0.00 0.02 0.00 0.00 56.10 56.53 2da0 s TRP 27 Cb -0.13 -2.33 -0.01 0.00 -1.15 0.00 0.00 33.47 29.85 2da0 s TRP 27 CO 0.32 -0.31 -0.21 -0.65 0.02 0.00 0.00 176.95 176.11 2da0 s GLN 28 N 1.67 2.67 0.10 4.98 -1.52 -0.89 -4.86 119.66 121.82 2da0 s GLN 28 Ca 0.06 -0.83 -0.30 0.00 -1.95 0.00 0.00 55.36 52.34 2da0 s GLN 28 Cb -0.16 -2.27 -0.06 0.00 -0.22 0.00 0.00 33.01 30.30 2da0 s GLN 28 CO 0.07 0.40 1.09 -0.98 -0.25 0.00 0.00 175.29 175.62 2da0 s ARG 29 N -0.19 4.56 -0.01 2.91 1.70 -1.26 -0.13 118.95 126.52 2da0 s ARG 29 Ca -0.02 1.64 0.03 0.00 -0.47 0.00 0.00 55.73 56.92 2da0 s ARG 29 Cb -0.14 -3.34 -0.01 0.00 -0.57 0.00 0.00 34.95 30.90 2da0 s ARG 29 CO 0.03 -0.02 -0.11 1.03 -1.08 0.00 0.00 175.30 175.15 2da0 s ARG 30 N 0.33 0.98 -0.16 3.89 1.81 0.73 -4.95 118.95 121.58 2da0 s ARG 30 Ca 0.52 -0.40 -0.29 0.00 -1.72 0.00 0.00 55.73 53.85 2da0 s ARG 30 Cb -0.27 -0.93 -0.06 0.00 -0.45 0.00 0.00 34.95 33.24 2da0 s ARG 30 CO 0.31 0.22 2.14 0.21 -0.68 0.00 0.00 175.30 177.50 2da0 s LYS 31 N -0.16 3.38 0.24 3.54 2.36 -1.26 -2.12 119.74 125.71 2da0 s LYS 31 Ca 0.02 2.14 0.08 0.00 -2.55 0.00 0.00 55.97 55.67 2da0 s LYS 31 Cb -0.06 -4.32 -0.04 0.00 -1.05 0.00 0.00 37.83 32.37 2da0 s LYS 31 CO -0.00 -1.83 0.04 0.00 1.55 0.00 0.00 175.35 175.12 2da0 s SER 33 N -3.50 -0.83 -0.18 0.00 1.04 -1.15 -3.20 113.70 105.87 2da0 s SER 33 Ca 0.31 1.35 0.01 0.00 0.48 0.00 0.00 55.95 58.09 2da0 s SER 33 Cb -0.08 1.29 0.02 0.00 0.10 0.00 0.00 66.02 67.35 2da0 s SER 33 CO 0.21 -0.23 -0.19 -0.69 0.98 0.00 0.00 173.24 173.32 2da0 s VAL 34 N 1.68 2.13 -0.24 5.02 1.01 -0.37 -1.21 120.40 128.42 2da0 s VAL 34 Ca -0.09 -0.92 -0.20 0.00 0.00 0.00 0.00 61.98 60.76 2da0 s VAL 34 Cb -0.06 -1.90 0.06 0.00 0.00 0.00 0.00 36.38 34.48 2da0 s VAL 34 CO -0.18 0.53 0.63 -0.75 0.00 0.00 0.00 175.10 175.33 2da0 s LYS 35 N 1.30 0.72 -1.70 2.72 2.36 -0.51 -1.36 119.74 123.27 2da0 s LYS 35 Ca 0.05 0.92 -0.01 0.00 -2.55 0.00 0.00 55.97 54.38 2da0 s LYS 35 Cb -0.13 0.31 0.00 0.00 -1.05 0.00 0.00 37.83 36.96 2da0 s LYS 35 CO -0.12 -0.10 0.12 0.09 1.55 0.00 0.00 175.35 176.89 2da0 n ASN 36 N 3.03 -5.84 -1.71 1.43 5.03 -1.26 -1.67 115.26 114.28 2da0 n ASN 36 Ca -0.15 -0.06 -0.12 0.00 0.87 0.00 0.00 54.58 55.12 2da0 n ASN 36 Cb 0.56 -4.83 0.02 0.00 -1.02 0.00 0.00 39.78 34.51 2da0 n ASN 36 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2da0 n GLY 37 N -1.11 0.07 2.79 7.41 0.00 -1.26 -4.97 105.19 108.13 2da0 n GLY 37 Ca -0.21 -0.30 -0.15 0.00 0.00 0.00 0.00 46.02 45.35 2da0 n GLY 37 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2da0 s ILE 38 N -2.89 0.01 -0.49 -0.61 -1.09 -0.67 -0.86 121.20 114.61 2da0 s ILE 38 Ca 0.17 0.16 -0.07 0.00 -2.23 0.00 0.00 60.65 58.69 2da0 s ILE 38 Cb -0.07 -0.12 0.13 0.00 -1.58 0.00 0.00 42.46 40.81 2da0 s ILE 38 CO 0.21 0.10 0.33 -0.22 -1.23 0.00 0.00 174.94 174.13 2da0 s LEU 39 N 0.97 5.55 0.32 2.97 2.96 -1.07 -1.42 118.68 128.96 2da0 s LEU 39 Ca -0.08 -2.10 -0.25 0.00 -0.22 0.00 0.00 54.13 51.47 2da0 s LEU 39 Cb -0.12 -1.94 -0.10 0.00 0.50 0.00 0.00 46.19 44.53 2da0 s LEU 39 CO -0.02 -0.60 0.93 -0.89 -1.32 0.00 0.00 176.35 174.45 2da0 s THR 40 N 1.06 4.24 -0.22 3.68 2.01 -0.35 -2.42 115.64 123.64 2da0 s THR 40 Ca 0.08 1.77 -0.00 0.00 0.31 0.00 0.00 61.69 63.86 2da0 s THR 40 Cb -0.24 -3.97 0.06 0.00 0.01 0.00 0.00 72.50 68.36 2da0 s THR 40 CO -0.03 0.11 -0.04 -0.63 -0.69 0.00 0.00 174.62 173.35 2da0 s ILE 41 N -1.65 1.30 1.04 1.82 1.01 0.36 -2.94 121.20 122.14 2da0 s ILE 41 Ca 0.51 -1.03 -0.16 0.00 0.00 0.00 0.00 60.65 59.97 2da0 s ILE 41 Cb -0.18 -1.60 0.08 0.00 0.01 0.00 0.00 42.46 40.77 2da0 s ILE 41 CO 0.23 -0.09 0.23 -1.20 0.00 0.00 0.00 174.94 174.10 2da0 n SER 42 N 4.76 -2.21 -3.47 3.58 7.64 -1.17 -2.02 113.62 120.74 2da0 n SER 42 Ca -0.11 0.09 -0.49 0.00 1.01 0.00 0.00 58.87 59.37 2da0 n SER 42 Cb 0.45 -1.09 -0.10 0.00 -1.01 0.00 0.00 64.21 62.47 2da0 n SER 42 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2da0 n HIS 43 N -4.05 0.95 0.00 1.43 1.44 -1.26 -4.72 115.22 109.01 2da0 n HIS 43 Ca 0.04 0.63 0.00 0.00 -2.01 0.00 0.00 57.72 56.38 2da0 n HIS 43 Cb 0.58 -1.87 0.00 0.00 0.12 0.00 0.00 29.99 28.82 2da0 n HIS 43 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2da0 n ALA 44 N 6.10 1.82 -2.72 1.59 0.00 -1.26 -5.02 120.51 121.02 2da0 n ALA 44 Ca 0.45 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.57 2da0 n ALA 44 Cb -0.03 0.24 -0.09 0.00 0.00 0.00 0.00 19.45 19.57 2da0 n ALA 44 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2da0 s THR 45 N -1.74 1.41 -0.92 0.00 -4.23 -1.26 -5.03 115.64 103.87 2da0 s THR 45 Ca 0.00 -2.00 -0.25 0.00 -1.18 0.00 0.00 61.69 58.26 2da0 s THR 45 Cb 0.00 -2.40 -0.13 0.00 1.34 0.00 0.00 72.50 71.31 2da0 s THR 45 CO 0.00 0.00 2.19 -0.44 -0.54 0.00 0.00 174.62 175.83 2da0 s SER 46 N -3.83 4.23 0.07 3.99 0.01 -1.26 -4.77 113.70 112.14 2da0 s SER 46 Ca 0.14 -0.51 -0.27 0.00 1.31 0.00 0.00 55.95 56.62 2da0 s SER 46 Cb 0.04 -2.57 0.09 0.00 0.21 0.00 0.00 66.02 63.80 2da0 s SER 46 CO 0.07 -3.69 1.14 0.54 0.41 0.00 0.00 173.24 171.71 2da0 s ASN 47 N 9.26 -0.08 -0.25 2.44 2.20 -1.26 -5.08 114.94 122.16 2da0 s ASN 47 Ca 0.82 -0.32 -0.07 0.00 -0.94 0.00 0.00 52.86 52.35 2da0 s ASN 47 Cb -0.09 0.32 -0.13 0.00 -2.00 0.00 0.00 41.25 39.36 2da0 s ASN 47 CO 0.08 -0.61 -0.29 0.54 -2.94 0.00 0.00 177.10 173.88 2da0 n ARG 48 N -0.56 0.57 -2.94 3.55 5.12 -1.26 -4.92 116.66 116.22 2da0 n ARG 48 Ca -0.06 0.20 -0.39 0.00 -1.93 0.00 0.00 57.85 55.68 2da0 n ARG 48 Cb 0.61 -1.45 -0.06 0.00 -1.16 0.00 0.00 32.46 30.40 2da0 n ARG 48 CO 0.00 0.00 0.00 -1.14 -1.93 0.00 0.00 177.63 174.56 2da0 s GLN 49 N -2.48 4.60 1.08 5.56 0.74 -1.26 -4.87 119.66 123.03 2da0 s GLN 49 Ca -0.35 1.21 -0.15 0.00 0.05 0.00 0.00 55.36 56.12 2da0 s GLN 49 Cb 0.12 -3.22 0.23 0.00 1.10 0.00 0.00 33.01 31.24 2da0 s GLN 49 CO 0.50 0.54 1.10 -1.25 -0.55 0.00 0.00 175.29 175.62 2da0 s PRO 50 N -1.25 -0.23 -0.19 1.67 0.04 -1.26 -4.91 135.00 128.87 2da0 s PRO 50 Ca 0.38 0.30 -0.14 0.00 0.04 0.00 0.00 61.00 61.58 2da0 s PRO 50 Cb -0.23 -1.68 -0.04 0.00 0.04 0.00 0.00 34.50 32.58 2da0 s PRO 50 CO 0.27 -3.12 0.29 0.00 0.04 0.00 0.00 177.00 174.48 2da0 s ALA 51 N -2.98 3.59 -0.28 8.56 0.00 -0.86 -4.89 121.76 124.91 2da0 s ALA 51 Ca 0.67 -0.58 -0.04 0.00 0.00 0.00 0.00 51.96 52.02 2da0 s ALA 51 Cb -0.16 -2.45 0.02 0.00 0.00 0.00 0.00 23.12 20.54 2da0 s ALA 51 CO 0.57 -0.10 0.00 0.15 0.00 0.00 0.00 175.76 176.39 2da0 s LYS 52 N 0.87 2.85 0.15 0.00 -0.14 -1.26 -0.49 119.74 121.72 2da0 s LYS 52 Ca 0.15 -0.99 -0.02 0.00 -1.36 0.00 0.00 55.97 53.75 2da0 s LYS 52 Cb -0.14 -3.16 -0.05 0.00 -1.68 0.00 0.00 37.83 32.80 2da0 s LYS 52 CO 0.05 -0.46 0.35 -0.51 -0.76 0.00 0.00 175.35 174.02 2da0 s LEU 53 N 1.37 4.27 -0.63 3.17 1.43 -1.02 -4.95 118.68 122.33 2da0 s LEU 53 Ca 0.00 0.44 -0.13 0.00 -1.03 0.00 0.00 54.13 53.41 2da0 s LEU 53 Cb -0.17 -3.18 0.16 0.00 0.03 0.00 0.00 46.19 43.03 2da0 s LEU 53 CO -0.01 0.03 0.55 0.21 0.23 0.00 0.00 176.35 177.37 2da0 s ASN 54 N -2.77 6.21 0.18 2.29 3.04 -1.26 -2.60 114.94 120.02 2da0 s ASN 54 Ca 0.39 -2.21 0.15 0.00 0.04 0.00 0.00 52.86 51.23 2da0 s ASN 54 Cb -0.12 -2.14 0.75 0.00 -1.54 0.00 0.00 41.25 38.20 2da0 s ASN 54 CO 0.27 -0.69 1.47 0.18 -3.04 0.00 0.00 177.10 175.29 2da0 n LEU 55 N 4.60 0.36 0.13 3.21 4.32 -0.03 -1.21 117.00 128.38 2da0 n LEU 55 Ca -0.02 0.64 -0.01 0.00 -0.02 0.00 0.00 56.01 56.60 2da0 n LEU 55 Cb 0.42 -0.65 0.20 0.00 -1.62 0.00 0.00 43.42 41.78 2da0 n LEU 55 CO 0.43 -0.66 0.55 -0.07 -1.22 0.00 0.00 177.39 176.42 2da0 h LEU 56 N 0.00 0.07 -2.66 2.23 3.38 -1.86 -3.25 115.31 113.22 2da0 h LEU 56 Ca 0.00 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.94 2da0 h LEU 56 Cb 0.11 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 40.84 2da0 h LEU 56 CO 0.00 0.61 -0.10 1.07 0.09 0.00 0.00 178.44 180.10 2da0 n THR 57 N -3.89 1.21 -2.82 0.22 5.66 -0.62 -4.96 114.28 109.08 2da0 n THR 57 Ca -0.02 -1.42 -0.32 0.00 -3.05 0.00 0.00 64.05 59.25 2da0 n THR 57 Cb 0.57 0.13 -0.04 0.00 -1.55 0.00 0.00 70.33 69.43 2da0 n THR 57 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2da0 s GLN 59 N -3.59 2.06 -0.61 0.00 0.74 -1.08 -4.98 119.66 112.19 2da0 s GLN 59 Ca 0.55 -1.61 -0.24 0.00 0.05 0.00 0.00 55.36 54.10 2da0 s GLN 59 Cb -0.10 -3.33 0.05 0.00 1.10 0.00 0.00 33.01 30.73 2da0 s GLN 59 CO 0.25 -0.86 1.02 0.08 -0.55 0.00 0.00 175.29 175.23 2da0 s VAL 60 N 1.13 4.24 -0.68 1.34 1.01 -1.26 -2.10 120.40 124.07 2da0 s VAL 60 Ca 0.03 0.17 -0.08 0.00 0.00 0.00 0.00 61.98 62.10 2da0 s VAL 60 Cb -0.21 -4.65 0.18 0.00 0.00 0.00 0.00 36.38 31.70 2da0 s VAL 60 CO -0.04 -1.34 0.56 -0.54 0.00 0.00 0.00 175.10 173.74 2da0 s LYS 61 N 4.33 2.97 0.42 2.72 1.02 -0.64 -4.99 119.74 125.58 2da0 s LYS 61 Ca 0.30 -2.39 -0.24 0.00 0.02 0.00 0.00 55.97 53.65 2da0 s LYS 61 Cb -0.13 -4.04 -0.08 0.00 -0.52 0.00 0.00 37.83 33.06 2da0 s LYS 61 CO 0.17 -1.23 1.18 -1.25 -0.92 0.00 0.00 175.35 173.30 2da0 s PRO 62 N 0.23 3.92 0.72 -1.68 0.04 -1.26 -1.04 135.00 135.94 2da0 s PRO 62 Ca 0.16 1.84 -0.12 0.00 0.04 0.00 0.00 61.00 62.92 2da0 s PRO 62 Cb -0.17 -2.57 0.03 0.00 0.04 0.00 0.00 34.50 31.82 2da0 s PRO 62 CO -0.05 -0.43 1.08 0.54 0.04 0.00 0.00 177.00 178.18 2da0 s ASN 63 N -1.19 4.95 0.06 6.66 6.03 -0.28 -4.91 114.94 126.27 2da0 s ASN 63 Ca 0.60 1.79 0.00 0.00 -1.03 0.00 0.00 52.86 54.21 2da0 s ASN 63 Cb -0.30 -2.52 0.00 0.00 -3.03 0.00 0.00 41.25 35.40 2da0 s ASN 63 CO 0.38 -1.73 0.00 0.00 -2.03 0.00 0.00 177.10 173.72 2da0 n ALA 64 N -3.12 3.00 -0.34 3.54 0.00 -1.26 -4.76 120.51 117.56 2da0 n ALA 64 Ca 0.09 0.00 0.20 0.00 0.00 0.00 0.00 53.44 53.73 2da0 n ALA 64 Cb 0.53 0.33 0.44 0.00 0.00 0.00 0.00 19.45 20.75 2da0 n ALA 64 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2da0 h GLU 65 N 0.00 0.48 0.00 0.00 5.08 -2.01 -3.42 114.58 114.71 2da0 h GLU 65 Ca 0.00 -0.03 -0.45 0.00 -1.00 0.00 0.00 59.36 57.88 2da0 h GLU 65 Cb 0.44 -0.11 -0.08 0.00 0.50 0.00 0.00 28.75 29.51 2da0 h GLU 65 CO 0.00 0.32 -0.31 -0.25 -1.00 0.00 0.00 179.01 177.77 2da0 n ASP 66 N -4.78 2.84 -4.39 1.42 8.00 -1.26 -5.16 116.55 113.22 2da0 n ASP 66 Ca 0.27 -2.52 -0.23 0.00 0.71 0.00 0.00 54.79 53.02 2da0 n ASP 66 Cb 0.81 0.20 -0.11 0.00 -0.02 0.00 0.00 41.12 42.00 2da0 n ASP 66 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 2da0 s LYS 67 N -3.35 1.43 -1.06 -1.24 2.47 -1.26 -4.81 119.74 111.93 2da0 s LYS 67 Ca 0.04 -1.55 -0.02 0.00 -1.56 0.00 0.00 55.97 52.89 2da0 s LYS 67 Cb -0.00 -1.50 -0.02 0.00 -1.46 0.00 0.00 37.83 34.85 2da0 s LYS 67 CO 0.03 0.29 0.89 1.63 0.16 0.00 0.00 175.35 178.35 2da0 n LYS 68 N -0.05 -4.90 -3.66 4.03 5.02 -1.26 -5.02 118.16 112.33 2da0 n LYS 68 Ca -0.10 0.78 -0.15 0.00 -2.02 0.00 0.00 58.31 56.82 2da0 n LYS 68 Cb 0.58 -5.54 -0.08 0.00 -0.02 0.00 0.00 35.03 29.97 2da0 n LYS 68 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2da0 s SER 69 N -3.99 -0.54 -0.24 4.39 0.15 -1.26 -3.41 113.70 108.81 2da0 s SER 69 Ca 0.12 0.87 -0.26 0.00 0.70 0.00 0.00 55.95 57.39 2da0 s SER 69 Cb -0.02 0.88 0.07 0.00 -1.71 0.00 0.00 66.02 65.25 2da0 s SER 69 CO 0.67 -0.33 0.74 0.72 1.20 0.00 0.00 173.24 176.24 2da0 s PHE 70 N -0.30 -0.75 -0.20 3.44 -0.71 -1.20 -1.13 117.98 117.14 2da0 s PHE 70 Ca -0.05 1.75 -0.04 0.00 -1.04 0.00 0.00 56.93 57.56 2da0 s PHE 70 Cb -0.03 0.30 -0.02 0.00 -1.21 0.00 0.00 43.02 42.06 2da0 s PHE 70 CO 0.03 -0.40 -0.03 -0.51 -1.34 0.00 0.00 175.22 172.98 2da0 s ASP 71 N 0.14 4.62 -0.44 1.98 1.01 -0.20 -2.91 116.67 120.86 2da0 s ASP 71 Ca -0.01 -0.26 -0.17 0.00 0.71 0.00 0.00 52.55 52.82 2da0 s ASP 71 Cb -0.04 -1.78 0.04 0.00 1.01 0.00 0.00 42.92 42.14 2da0 s ASP 71 CO 0.02 0.06 0.42 -0.22 0.21 0.00 0.00 175.17 175.66 2da0 s LEU 72 N 1.02 5.09 -0.33 1.23 2.96 -0.70 -1.62 118.68 126.33 2da0 s LEU 72 Ca 0.01 -0.89 -0.21 0.00 -0.22 0.00 0.00 54.13 52.83 2da0 s LEU 72 Cb -0.14 -2.30 -0.00 0.00 0.50 0.00 0.00 46.19 44.24 2da0 s LEU 72 CO 0.01 -0.60 0.65 -0.63 -1.32 0.00 0.00 176.35 174.45 2da0 s ILE 73 N 1.99 4.90 0.59 6.68 1.01 -0.89 0.29 121.20 135.77 2da0 s ILE 73 Ca 0.09 0.76 0.07 0.00 0.00 0.00 0.00 60.65 61.57 2da0 s ILE 73 Cb -0.19 -4.05 0.10 0.00 0.01 0.00 0.00 42.46 38.33 2da0 s ILE 73 CO 0.11 -0.24 0.81 -1.20 0.00 0.00 0.00 174.94 174.42 2da0 n SER 74 N 6.00 1.81 -4.57 3.58 7.64 0.34 -2.63 113.62 125.79 2da0 n SER 74 Ca -0.01 -2.36 -0.39 0.00 1.01 0.00 0.00 58.87 57.12 2da0 n SER 74 Cb 0.49 -0.46 -0.03 0.00 -1.01 0.00 0.00 64.21 63.20 2da0 n SER 74 CO 0.00 0.00 0.00 1.57 -3.01 0.00 0.00 175.04 173.60 2da0 n HIS 75 N -2.35 1.67 -3.64 1.43 -0.00 -1.26 -2.00 115.22 109.07 2da0 n HIS 75 Ca 0.16 0.01 -0.24 0.00 0.46 0.00 0.00 57.72 58.11 2da0 n HIS 75 Cb 0.57 -2.68 0.07 0.00 -0.12 0.00 0.00 29.99 27.82 2da0 n HIS 75 CO 0.00 0.00 0.00 0.09 0.46 0.00 0.00 176.34 176.89 2da0 n ASN 76 N 13.95 -4.78 -3.59 0.26 3.02 -1.26 -4.97 115.26 117.88 2da0 n ASN 76 Ca 0.34 -0.63 -0.09 0.00 -0.03 0.00 0.00 54.58 54.17 2da0 n ASN 76 Cb 0.50 -4.74 -0.05 0.00 -0.61 0.00 0.00 39.78 34.88 2da0 n ASN 76 CO 0.00 0.00 0.00 -0.60 -2.62 0.00 0.00 177.26 174.04 2da0 s ARG 77 N -6.16 0.48 -0.01 3.52 3.52 -0.85 -5.17 118.95 114.28 2da0 s ARG 77 Ca 0.44 0.14 0.08 0.00 -0.13 0.00 0.00 55.73 56.26 2da0 s ARG 77 Cb -0.20 0.23 -0.02 0.00 -1.56 0.00 0.00 34.95 33.39 2da0 s ARG 77 CO 0.76 -0.15 -0.26 0.99 -0.81 0.00 0.00 175.30 175.84 2da0 s THR 78 N -1.01 2.11 0.09 4.11 2.01 -1.26 0.13 115.64 121.82 2da0 s THR 78 Ca 0.01 -1.14 0.10 0.00 0.31 0.00 0.00 61.69 60.96 2da0 s THR 78 Cb -0.01 -1.75 -0.04 0.00 0.01 0.00 0.00 72.50 70.72 2da0 s THR 78 CO -0.01 0.54 -0.27 -0.31 -0.69 0.00 0.00 174.62 173.89 2da0 s TYR 79 N -0.65 2.31 -0.19 4.92 1.51 0.15 -4.91 117.35 120.48 2da0 s TYR 79 Ca 0.10 -0.39 -0.01 0.00 -1.01 0.00 0.00 57.07 55.76 2da0 s TYR 79 Cb -0.10 -1.31 0.00 0.00 -0.11 0.00 0.00 41.96 40.45 2da0 s TYR 79 CO -0.00 0.25 -0.13 -1.01 -1.11 0.00 0.00 175.55 173.54 2da0 s HIS 80 N -0.95 2.85 0.07 2.71 3.76 -1.26 -1.72 115.29 120.75 2da0 s HIS 80 Ca 0.13 -1.25 0.05 0.00 -0.15 0.00 0.00 55.06 53.84 2da0 s HIS 80 Cb -0.10 -1.98 -0.03 0.00 1.11 0.00 0.00 32.58 31.58 2da0 s HIS 80 CO 0.04 -0.64 -0.15 -0.06 -0.85 0.00 0.00 174.74 173.09 2da0 s PHE 81 N 1.26 1.25 -0.03 1.40 0.08 -1.14 -3.21 117.98 117.58 2da0 s PHE 81 Ca 0.03 -0.46 -0.01 0.00 0.12 0.00 0.00 56.93 56.61 2da0 s PHE 81 Cb -0.14 -0.70 0.03 0.00 -0.57 0.00 0.00 43.02 41.64 2da0 s PHE 81 CO -0.07 0.06 0.06 -1.14 -0.10 0.00 0.00 175.22 174.04 2da0 s GLN 82 N -1.75 -0.03 0.46 0.44 0.74 -0.69 -3.22 119.66 115.61 2da0 s GLN 82 Ca -0.02 0.28 -0.20 0.00 0.05 0.00 0.00 55.36 55.47 2da0 s GLN 82 Cb -0.10 -0.31 -0.10 0.00 1.10 0.00 0.00 33.01 33.60 2da0 s GLN 82 CO 0.02 -0.22 0.97 0.00 -0.55 0.00 0.00 175.29 175.51 2da0 s ALA 83 N 1.42 3.03 -0.11 1.58 0.00 -1.22 -2.41 121.76 124.05 2da0 s ALA 83 Ca -0.05 0.34 -0.24 0.00 0.00 0.00 0.00 51.96 52.01 2da0 s ALA 83 Cb -0.13 -3.15 -0.27 0.00 0.00 0.00 0.00 23.12 19.57 2da0 s ALA 83 CO -0.03 -0.02 0.73 0.93 0.00 0.00 0.00 175.76 177.36 2da0 h GLU 84 N 1.56 0.14 -5.22 0.00 4.39 -1.90 -3.47 114.58 110.08 2da0 h GLU 84 Ca -0.48 -0.24 -0.40 0.00 0.34 0.00 0.00 59.36 58.58 2da0 h GLU 84 Cb 1.18 0.09 -0.14 0.00 -0.10 0.00 0.00 28.75 29.78 2da0 h GLU 84 CO 0.61 1.11 -0.68 0.34 -1.16 0.00 0.00 179.01 179.23 2da0 s ASP 85 N -6.66 2.08 0.26 1.42 2.15 -1.26 -5.05 116.67 109.62 2da0 s ASP 85 Ca -0.18 -1.14 -0.05 0.00 0.43 0.00 0.00 52.55 51.61 2da0 s ASP 85 Cb 0.00 -0.05 0.31 0.00 -0.30 0.00 0.00 42.92 42.88 2da0 s ASP 85 CO 0.74 -0.40 1.93 -0.33 -0.17 0.00 0.00 175.17 176.94 2da0 h GLU 86 N 2.52 1.24 -0.29 4.34 4.39 -1.99 -1.30 114.58 123.49 2da0 h GLU 86 Ca -0.38 -0.09 0.03 0.00 0.34 0.00 0.00 59.36 59.26 2da0 h GLU 86 Cb 1.22 -0.27 -0.01 0.00 -0.10 0.00 0.00 28.75 29.58 2da0 h GLU 86 CO 0.64 0.84 0.19 1.96 -1.16 0.00 0.00 179.01 181.49 2da0 h GLN 87 N 1.27 0.25 0.22 2.33 4.20 -1.99 0.23 115.11 121.62 2da0 h GLN 87 Ca 0.34 -0.02 -0.29 0.00 0.06 0.00 0.00 58.65 58.74 2da0 h GLN 87 Cb -0.11 -0.06 0.03 0.00 0.30 0.00 0.00 27.48 27.65 2da0 h GLN 87 CO -0.07 0.17 -1.28 0.22 -0.67 0.00 0.00 178.83 177.20 2da0 h ASP 88 N 0.26 0.71 0.19 1.46 3.58 -1.72 -3.20 116.42 117.70 2da0 h ASP 88 Ca 0.12 -0.93 -0.01 0.00 0.42 0.00 0.00 57.03 56.63 2da0 h ASP 88 Cb 0.16 -0.23 0.00 0.00 1.72 0.00 0.00 39.33 40.98 2da0 h ASP 88 CO -0.02 1.61 -0.09 0.22 -2.88 0.00 0.00 179.24 178.08 2da0 h TYR 89 N -0.03 -0.23 -0.91 0.28 5.03 -0.71 -1.71 116.97 118.68 2da0 h TYR 89 Ca -0.23 -0.01 0.23 0.00 2.58 0.00 0.00 58.73 61.31 2da0 h TYR 89 Cb 1.99 0.08 -0.06 0.00 1.55 0.00 0.00 36.73 40.29 2da0 h TYR 89 CO 0.15 0.10 0.62 0.28 -1.32 0.00 0.00 178.16 177.99 2da0 h VAL 90 N -0.58 0.62 0.15 1.81 2.07 -0.72 -2.51 116.25 117.09 2da0 h VAL 90 Ca -0.03 -0.10 -0.01 0.00 0.82 0.00 0.00 66.70 67.39 2da0 h VAL 90 Cb 0.43 0.31 0.00 0.00 -1.52 0.00 0.00 31.29 30.52 2da0 h VAL 90 CO 0.04 0.05 -0.07 0.00 0.02 0.00 0.00 177.57 177.61 2da0 h ALA 91 N 1.60 -0.34 -0.02 1.67 0.00 -1.51 -3.18 119.26 117.47 2da0 h ALA 91 Ca 0.47 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.34 2da0 h ALA 91 Cb 1.36 0.08 -0.00 0.00 0.00 0.00 0.00 17.79 19.23 2da0 h ALA 91 CO -0.14 -0.33 -0.01 0.91 0.00 0.00 0.00 179.25 179.68 2da0 n TRP 92 N -3.51 -0.01 -0.36 0.00 5.03 -0.66 -0.36 117.44 117.57 2da0 n TRP 92 Ca -0.02 0.02 0.00 0.00 3.03 0.00 0.00 57.50 60.53 2da0 n TRP 92 Cb 0.08 -0.43 0.06 0.00 -1.03 0.00 0.00 31.31 29.99 2da0 n TRP 92 CO 0.00 0.00 0.00 -0.89 -0.03 0.00 0.00 177.69 176.77 2da0 n ILE 93 N -2.89 -0.48 -0.19 -0.99 2.08 -0.97 0.74 119.36 116.66 2da0 n ILE 93 Ca 0.00 2.21 -0.02 0.00 0.56 0.00 0.00 62.75 65.51 2da0 n ILE 93 Cb 0.00 -2.95 0.08 0.00 -0.75 0.00 0.00 39.64 36.02 2da0 n ILE 93 CO 0.00 0.00 0.00 -1.28 0.56 0.00 0.00 176.55 175.83 2da0 h SER 94 N 0.00 0.30 0.00 4.38 0.87 -0.68 -1.76 113.55 116.67 2da0 h SER 94 Ca 0.35 0.05 0.00 0.00 -1.23 0.00 0.00 61.79 60.97 2da0 h SER 94 Cb 0.59 0.01 0.00 0.00 -0.44 0.00 0.00 62.40 62.56 2da0 h SER 94 CO -0.95 0.19 0.00 0.52 -0.53 0.00 0.00 176.83 176.06 2da0 n VAL 95 N -4.94 0.00 -0.24 2.23 0.31 0.23 -0.83 118.33 115.09 2da0 n VAL 95 Ca 0.07 1.04 0.05 0.00 -0.01 0.00 0.00 64.34 65.49 2da0 n VAL 95 Cb 0.21 -2.04 0.12 0.00 -0.91 0.00 0.00 33.84 31.22 2da0 n VAL 95 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 2da0 n LEU 96 N -1.99 -0.21 -0.01 7.52 4.77 0.14 0.99 117.00 128.21 2da0 n LEU 96 Ca 0.00 1.16 -0.13 0.00 -0.03 0.00 0.00 56.01 57.01 2da0 n LEU 96 Cb 0.00 -0.37 -0.10 0.00 -2.33 0.00 0.00 43.42 40.63 2da0 n LEU 96 CO 0.00 -1.13 0.65 0.74 -1.33 0.00 0.00 177.39 176.32 2da0 h THR 97 N 0.00 1.37 0.54 -5.08 2.02 -1.39 -3.08 112.91 107.29 2da0 h THR 97 Ca 0.34 -1.09 -0.02 0.00 0.77 0.00 0.00 66.41 66.41 2da0 h THR 97 Cb 0.57 2.11 -0.00 0.00 -1.74 0.00 0.00 68.15 69.09 2da0 h THR 97 CO -0.68 0.28 -0.35 0.78 0.37 0.00 0.00 175.52 175.92 2da0 h ASN 98 N -0.46 -0.91 -1.32 4.18 2.35 0.27 -2.37 115.58 117.33 2da0 h ASN 98 Ca 0.00 0.05 0.47 0.00 -0.55 0.00 0.00 56.30 56.27 2da0 h ASN 98 Cb 0.47 0.27 -0.15 0.00 0.05 0.00 0.00 38.32 38.96 2da0 h ASN 98 CO 0.00 -0.53 0.83 -1.28 -1.65 0.00 0.00 177.43 174.79 2da0 h SER 99 N -0.85 0.22 0.71 5.81 0.87 -0.08 0.41 113.55 120.64 2da0 h SER 99 Ca -0.07 0.18 -0.03 0.00 -1.23 0.00 0.00 61.79 60.63 2da0 h SER 99 Cb 0.69 0.18 0.01 0.00 -0.44 0.00 0.00 62.40 62.84 2da0 h SER 99 CO 0.06 -0.30 -0.34 0.50 -0.53 0.00 0.00 176.83 176.23 2da0 h LYS 100 N 0.00 -0.91 0.27 2.24 3.11 -1.34 -2.55 116.57 117.39 2da0 h LYS 100 Ca 0.88 0.06 -0.01 0.00 -2.81 0.00 0.00 60.65 58.77 2da0 h LYS 100 Cb 2.75 0.21 0.00 0.00 -1.00 0.00 0.00 32.23 34.19 2da0 h LYS 100 CO -0.53 -0.61 -0.13 0.93 -2.81 0.00 0.00 179.45 176.31 2da0 h GLU 101 N -1.05 -0.35 -1.41 1.90 5.08 -0.48 -2.43 114.58 115.84 2da0 h GLU 101 Ca -0.10 0.02 0.41 0.00 -1.00 0.00 0.00 59.36 58.70 2da0 h GLU 101 Cb 0.73 0.08 -0.06 0.00 0.50 0.00 0.00 28.75 30.00 2da0 h GLU 101 CO 0.16 -0.15 1.09 0.93 -1.00 0.00 0.00 179.01 180.05 2da0 h GLU 102 N -0.49 0.00 0.08 2.33 4.39 -0.41 0.81 114.58 121.29 2da0 h GLU 102 Ca -0.04 0.00 -0.21 0.00 0.34 0.00 0.00 59.36 59.45 2da0 h GLU 102 Cb 0.36 0.00 0.02 0.00 -0.10 0.00 0.00 28.75 29.04 2da0 h GLU 102 CO 0.06 0.00 -0.88 0.00 -1.16 0.00 0.00 179.01 177.03 2da0 h ALA 103 N 1.14 -0.00 0.15 3.43 0.00 -0.99 -3.16 119.26 119.82 2da0 h ALA 103 Ca 0.67 -0.68 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 2da0 h ALA 103 Cb 2.85 0.08 0.00 0.00 0.00 0.00 0.00 17.79 20.72 2da0 h ALA 103 CO -0.01 0.47 -0.07 -0.07 0.00 0.00 0.00 179.25 179.57 2da0 h LEU 104 N -0.05 -0.17 -1.38 0.00 3.38 0.68 -2.52 115.31 115.25 2da0 h LEU 104 Ca -0.13 -0.38 0.31 0.00 0.09 0.00 0.00 57.88 57.77 2da0 h LEU 104 Cb 1.62 0.04 -0.10 0.00 0.09 0.00 0.00 40.66 42.31 2da0 h LEU 104 CO 0.17 0.38 0.71 0.00 0.09 0.00 0.00 178.44 179.79 2da0 h THR 105 N -0.81 0.42 0.00 0.22 1.03 -0.64 1.17 112.91 114.31 2da0 h THR 105 Ca -0.02 -0.11 -0.05 0.00 -0.01 0.00 0.00 66.41 66.22 2da0 h THR 105 Cb 0.54 0.08 -0.01 0.00 -1.07 0.00 0.00 68.15 67.69 2da0 h THR 105 CO 0.03 0.06 -0.23 0.00 -0.01 0.00 0.00 175.52 175.37 2da0 h MET 106 N 0.31 0.00 -7.74 0.00 -0.00 -1.55 -3.46 114.93 102.49 2da0 h MET 106 Ca 0.65 0.00 -0.45 0.00 -0.00 0.00 0.00 59.70 59.89 2da0 h MET 106 Cb 1.77 0.00 0.14 0.00 -0.00 0.00 0.00 31.60 33.51 2da0 h MET 106 CO -0.33 0.23 0.41 0.00 -0.00 0.00 0.00 176.91 177.23 2da0 s ALA 107 N -3.10 2.34 -0.14 -3.00 0.00 0.40 -5.07 121.76 113.19 2da0 s ALA 107 Ca 0.06 -1.00 -0.03 0.00 0.00 0.00 0.00 51.96 50.99 2da0 s ALA 107 Cb 0.06 -2.85 -0.03 0.00 0.00 0.00 0.00 23.12 20.31 2da0 s ALA 107 CO 0.70 -2.20 -0.06 -0.59 0.00 0.00 0.00 175.76 173.62 2da0 s PHE 108 N -3.76 2.98 0.22 0.00 -0.12 -1.26 -4.97 117.98 111.07 2da0 s PHE 108 Ca 0.70 -0.32 -0.19 0.00 -0.05 0.00 0.00 56.93 57.07 2da0 s PHE 108 Cb -0.07 -1.91 0.03 0.00 -0.63 0.00 0.00 43.02 40.44 2da0 s PHE 108 CO 0.52 -0.02 0.59 -1.12 -0.05 0.00 0.00 175.22 175.13 2da0 s SER 109 N 0.22 -0.28 0.11 1.98 0.01 -1.26 -5.15 113.70 109.33 2da0 s SER 109 Ca -0.04 -0.51 0.00 0.00 1.31 0.00 0.00 55.95 56.72 2da0 s SER 109 Cb -0.14 0.63 0.00 0.00 0.21 0.00 0.00 66.02 66.72 2da0 s SER 109 CO 0.03 -1.14 0.00 0.61 0.41 0.00 0.00 173.24 173.15 2da0 n GLY 110 N -0.39 -1.68 0.00 3.44 0.00 -1.26 -4.18 105.19 101.13 2da0 n GLY 110 Ca -0.08 -1.42 0.07 0.00 0.00 0.00 0.00 46.02 44.59 2da0 n GLY 110 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2da0 n PRO 111 N -2.29 0.02 -2.13 1.61 -0.04 -1.26 -4.77 135.00 126.14 2da0 n PRO 111 Ca -0.00 0.25 -0.30 0.00 -0.04 0.00 0.00 63.50 63.40 2da0 n PRO 111 Cb 0.19 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.15 2da0 n PRO 111 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2da0 s SER 112 N -2.96 6.27 -1.56 3.54 0.15 -1.26 -4.04 113.70 113.85 2da0 s SER 112 Ca 0.08 1.30 -0.06 0.00 0.70 0.00 0.00 55.95 57.96 2da0 s SER 112 Cb 0.09 -2.41 0.06 0.00 -1.71 0.00 0.00 66.02 62.05 2da0 s SER 112 CO 0.25 -0.76 0.41 -1.20 1.20 0.00 0.00 173.24 173.14 2da0 n SER 113 N -2.50 -0.80 0.00 5.45 7.64 -1.26 -4.68 113.62 117.47 2da0 n SER 113 Ca 0.05 -1.10 0.00 0.00 1.01 0.00 0.00 58.87 58.82 2da0 n SER 113 Cb 0.54 -2.47 0.00 0.00 -1.01 0.00 0.00 64.21 61.27 2da0 n SER 113 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64