#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 -0.28 0.31 1.61 1.04 -1.26 -5.14 113.70 109.98 2da0 s SER 2 Ca 0.00 0.22 -0.29 0.00 0.48 0.00 0.00 55.95 56.36 2da0 s SER 2 Cb 0.00 0.37 -0.11 0.00 0.10 0.00 0.00 66.02 66.38 2da0 s SER 2 CO 0.00 -0.47 1.48 -0.55 0.98 0.00 0.00 173.24 174.69 2da0 s SER 3 N -1.25 6.49 0.00 7.02 0.15 -1.26 -4.98 113.70 119.86 2da0 s SER 3 Ca -0.13 2.88 0.00 0.00 0.70 0.00 0.00 55.95 59.40 2da0 s SER 3 Cb -0.04 -2.64 0.00 0.00 -1.71 0.00 0.00 66.02 61.62 2da0 s SER 3 CO 0.05 -0.80 0.00 0.61 1.20 0.00 0.00 173.24 174.30 2da0 n GLY 4 N 1.46 0.19 3.68 9.45 0.00 -1.26 -5.12 105.19 113.59 2da0 n GLY 4 Ca 0.04 0.71 -0.52 0.00 0.00 0.00 0.00 46.02 46.26 2da0 n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2da0 n SER 5 N 0.00 2.81 0.07 1.61 7.64 -1.26 -4.87 113.62 119.61 2da0 n SER 5 Ca 0.00 1.04 -0.14 0.00 1.01 0.00 0.00 58.87 60.78 2da0 n SER 5 Cb 0.00 -1.27 -0.09 0.00 -1.01 0.00 0.00 64.21 61.84 2da0 n SER 5 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 2da0 h SER 6 N 7.56 -1.46 -5.05 6.43 4.64 -2.01 -3.47 113.55 120.19 2da0 h SER 6 Ca -0.47 0.16 -0.12 0.00 -0.47 0.00 0.00 61.79 60.88 2da0 h SER 6 Cb 1.29 0.55 0.10 0.00 -0.31 0.00 0.00 62.40 64.03 2da0 h SER 6 CO 0.93 -0.48 -0.42 0.61 -0.87 0.00 0.00 176.83 176.59 2da0 n GLY 7 N -1.42 -0.96 0.44 -0.77 0.00 -1.26 -4.99 105.19 96.24 2da0 n GLY 7 Ca -0.07 0.42 -0.11 0.00 0.00 0.00 0.00 46.02 46.26 2da0 n GLY 7 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2da0 n TYR 8 N -2.42 0.00 0.00 1.61 4.02 -1.26 -5.15 117.16 113.97 2da0 n TYR 8 Ca -0.03 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.86 2da0 n TYR 8 Cb 0.56 -0.42 0.00 0.00 -0.02 0.00 0.00 39.34 39.46 2da0 n TYR 8 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2da0 n GLY 9 N 2.50 3.30 1.27 2.72 0.00 -1.26 -4.84 105.19 108.88 2da0 n GLY 9 Ca -0.22 -1.78 -0.01 0.00 0.00 0.00 0.00 46.02 44.01 2da0 n GLY 9 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2da0 n SER 10 N 0.00 3.25 -3.73 1.61 7.64 -1.26 -4.32 113.62 116.81 2da0 n SER 10 Ca 0.00 -2.52 -0.12 0.00 1.01 0.00 0.00 58.87 57.24 2da0 n SER 10 Cb 0.00 -0.61 -0.12 0.00 -1.01 0.00 0.00 64.21 62.47 2da0 n SER 10 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 2da0 s GLU 11 N -1.75 0.29 -0.29 1.43 8.01 -1.26 -4.40 118.70 120.74 2da0 s GLU 11 Ca 0.26 0.55 -0.14 0.00 0.01 0.00 0.00 54.97 55.64 2da0 s GLU 11 Cb 0.20 -0.01 0.10 0.00 -4.31 0.00 0.00 34.13 30.11 2da0 s GLU 11 CO 0.07 -0.12 0.69 0.21 0.01 0.00 0.00 175.26 176.11 2da0 s LYS 12 N 0.95 0.66 -0.16 1.61 2.20 -0.80 -5.02 119.74 119.18 2da0 s LYS 12 Ca -0.07 1.29 0.01 0.00 -0.36 0.00 0.00 55.97 56.84 2da0 s LYS 12 Cb -0.07 0.36 0.01 0.00 -1.51 0.00 0.00 37.83 36.62 2da0 s LYS 12 CO -0.07 -0.16 -0.18 0.21 -0.36 0.00 0.00 175.35 174.79 2da0 s LYS 13 N 2.02 3.09 0.00 4.03 2.20 -1.26 -1.39 119.74 128.44 2da0 s LYS 13 Ca -0.09 -0.80 0.00 0.00 -0.36 0.00 0.00 55.97 54.72 2da0 s LYS 13 Cb -0.07 -2.57 0.00 0.00 -1.51 0.00 0.00 37.83 33.68 2da0 s LYS 13 CO -0.20 -0.08 0.00 0.41 -0.36 0.00 0.00 175.35 175.13 2da0 n GLY 14 N 4.28 2.66 3.05 5.54 0.00 -0.50 -5.01 105.19 115.21 2da0 n GLY 14 Ca -0.20 0.01 -0.14 0.00 0.00 0.00 0.00 46.02 45.69 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 0.72 0.70 0.05 1.61 1.51 -1.26 -1.13 117.35 119.55 2da0 s TYR 15 Ca 0.00 -0.41 -0.06 0.00 -1.01 0.00 0.00 57.07 55.59 2da0 s TYR 15 Cb 0.00 -0.42 -0.01 0.00 -0.11 0.00 0.00 41.96 41.42 2da0 s TYR 15 CO 0.00 -0.05 0.12 -0.51 -1.11 0.00 0.00 175.55 174.00 2da0 s LEU 16 N -1.28 1.72 -0.08 -1.29 1.43 -0.31 -4.78 118.68 114.09 2da0 s LEU 16 Ca -0.06 -0.57 -0.20 0.00 -1.03 0.00 0.00 54.13 52.27 2da0 s LEU 16 Cb -0.08 0.71 -0.04 0.00 0.03 0.00 0.00 46.19 46.80 2da0 s LEU 16 CO 0.00 -0.57 0.55 -0.76 0.23 0.00 0.00 176.35 175.80 2da0 s LEU 17 N -2.34 4.32 -0.04 1.79 1.43 -0.12 -1.52 118.68 122.20 2da0 s LEU 17 Ca -0.02 0.97 0.07 0.00 -1.03 0.00 0.00 54.13 54.12 2da0 s LEU 17 Cb 0.01 -2.82 -0.01 0.00 0.03 0.00 0.00 46.19 43.39 2da0 s LEU 17 CO -0.06 0.00 -0.25 -0.75 0.23 0.00 0.00 176.35 175.52 2da0 s LYS 18 N 0.45 2.31 -0.31 1.70 2.20 -0.49 -1.40 119.74 124.20 2da0 s LYS 18 Ca 0.30 -0.91 -0.16 0.00 -0.36 0.00 0.00 55.97 54.83 2da0 s LYS 18 Cb -0.16 -2.08 -0.02 0.00 -1.51 0.00 0.00 37.83 34.06 2da0 s LYS 18 CO 0.13 0.46 0.44 0.21 -0.36 0.00 0.00 175.35 176.23 2da0 s LYS 19 N -0.37 3.77 0.25 4.03 2.20 -1.18 -1.44 119.74 127.00 2da0 s LYS 19 Ca 0.03 -0.11 -0.30 0.00 -0.36 0.00 0.00 55.97 55.23 2da0 s LYS 19 Cb -0.12 -3.75 -0.10 0.00 -1.51 0.00 0.00 37.83 32.35 2da0 s LYS 19 CO 0.01 -0.48 1.51 -1.12 -0.36 0.00 0.00 175.35 174.92 2da0 s SER 20 N 1.70 6.55 -0.24 1.43 0.01 -1.12 -4.69 113.70 117.33 2da0 s SER 20 Ca 0.16 2.75 -0.04 0.00 1.31 0.00 0.00 55.95 60.13 2da0 s SER 20 Cb -0.16 -2.62 -0.00 0.00 0.21 0.00 0.00 66.02 63.45 2da0 s SER 20 CO 0.11 -0.79 -0.01 -0.62 0.41 0.00 0.00 173.24 172.34 2da0 s ASP 21 N 0.52 4.54 0.00 2.44 -1.08 -1.26 -4.27 116.67 117.55 2da0 s ASP 21 Ca 0.62 -0.50 0.00 0.00 -0.52 0.00 0.00 52.55 52.15 2da0 s ASP 21 Cb -0.44 -1.77 0.00 0.00 -1.46 0.00 0.00 42.92 39.25 2da0 s ASP 21 CO 0.43 -0.07 0.00 0.61 0.52 0.00 0.00 175.17 176.66 2da0 n GLY 22 N 4.80 -1.61 0.09 2.66 0.00 -1.26 -5.02 105.19 104.86 2da0 n GLY 22 Ca -0.17 0.63 -0.10 0.00 0.00 0.00 0.00 46.02 46.38 2da0 n GLY 22 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2da0 n ILE 23 N 0.00 1.49 -4.67 -0.61 -0.00 -1.26 -4.97 119.36 109.34 2da0 n ILE 23 Ca 0.00 0.10 -0.33 0.00 -0.00 0.00 0.00 62.75 62.52 2da0 n ILE 23 Cb 0.00 -2.31 -0.14 0.00 -0.00 0.00 0.00 39.64 37.20 2da0 n ILE 23 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 2da0 s ARG 24 N -2.74 3.43 -0.50 0.38 1.70 -1.26 -5.08 118.95 114.88 2da0 s ARG 24 Ca -0.27 -0.64 -0.19 0.00 -0.47 0.00 0.00 55.73 54.16 2da0 s ARG 24 Cb 0.05 -2.70 0.06 0.00 -0.57 0.00 0.00 34.95 31.78 2da0 s ARG 24 CO 0.40 0.25 0.60 0.15 -1.08 0.00 0.00 175.30 175.62 2da0 s LYS 25 N 0.29 3.12 -0.02 3.89 1.02 -1.26 -4.70 119.74 122.08 2da0 s LYS 25 Ca -0.08 -0.88 -0.03 0.00 0.02 0.00 0.00 55.97 55.00 2da0 s LYS 25 Cb -0.15 -4.08 0.00 0.00 -0.52 0.00 0.00 37.83 33.08 2da0 s LYS 25 CO 0.05 -1.18 0.07 0.14 -0.92 0.00 0.00 175.35 173.51 2da0 s VAL 26 N 2.56 0.03 0.16 3.17 -7.23 -1.26 -4.98 120.40 112.85 2da0 s VAL 26 Ca 0.15 -0.25 -0.30 0.00 -1.81 0.00 0.00 61.98 59.77 2da0 s VAL 26 Cb -0.19 -0.19 -0.07 0.00 0.56 0.00 0.00 36.38 36.49 2da0 s VAL 26 CO 0.12 -0.14 1.03 0.26 -0.31 0.00 0.00 175.10 176.07 2da0 s TRP 27 N -0.41 3.72 -0.00 2.82 0.52 -1.26 -2.81 118.94 121.51 2da0 s TRP 27 Ca -0.05 1.71 0.01 0.00 0.02 0.00 0.00 56.10 57.79 2da0 s TRP 27 Cb -0.03 -3.16 -0.00 0.00 -1.15 0.00 0.00 33.47 29.12 2da0 s TRP 27 CO 0.00 -0.20 -0.03 -0.65 0.02 0.00 0.00 176.95 176.09 2da0 s GLN 28 N -0.32 0.28 0.14 4.98 -1.52 -0.52 -4.96 119.66 117.73 2da0 s GLN 28 Ca 0.48 -0.13 -0.31 0.00 -1.95 0.00 0.00 55.36 53.44 2da0 s GLN 28 Cb -0.27 -0.26 -0.08 0.00 -0.22 0.00 0.00 33.01 32.18 2da0 s GLN 28 CO 0.33 0.07 1.41 0.50 -0.25 0.00 0.00 175.29 177.35 2da0 s ARG 29 N -0.11 4.31 -0.14 2.91 3.52 -1.26 -1.40 118.95 126.78 2da0 s ARG 29 Ca 0.01 2.13 -0.09 0.00 -0.13 0.00 0.00 55.73 57.65 2da0 s ARG 29 Cb -0.01 -3.22 0.05 0.00 -1.56 0.00 0.00 34.95 30.20 2da0 s ARG 29 CO -0.00 -0.45 0.34 1.03 -0.81 0.00 0.00 175.30 175.42 2da0 s ARG 30 N 0.91 0.34 0.41 5.12 1.81 -0.58 -4.93 118.95 122.04 2da0 s ARG 30 Ca 0.64 0.62 -0.27 0.00 -1.72 0.00 0.00 55.73 55.01 2da0 s ARG 30 Cb -0.38 0.01 -0.09 0.00 -0.45 0.00 0.00 34.95 34.03 2da0 s ARG 30 CO 0.32 -0.13 1.44 0.21 -0.68 0.00 0.00 175.30 176.46 2da0 s LYS 31 N 1.01 3.90 0.07 3.54 2.20 -1.26 -1.16 119.74 128.04 2da0 s LYS 31 Ca -0.07 2.45 -0.01 0.00 -0.36 0.00 0.00 55.97 57.99 2da0 s LYS 31 Cb -0.07 -2.80 -0.04 0.00 -1.51 0.00 0.00 37.83 33.41 2da0 s LYS 31 CO -0.08 -0.66 -0.02 0.00 -0.36 0.00 0.00 175.35 174.23 2da0 s SER 33 N -2.96 -0.46 -0.13 0.00 0.01 -0.96 -1.41 113.70 107.78 2da0 s SER 33 Ca 0.11 -0.01 -0.05 0.00 1.31 0.00 0.00 55.95 57.30 2da0 s SER 33 Cb 0.07 0.54 0.06 0.00 0.21 0.00 0.00 66.02 66.91 2da0 s SER 33 CO -0.07 -0.87 0.28 -0.69 0.41 0.00 0.00 173.24 172.30 2da0 s VAL 34 N -3.37 -0.28 -0.25 3.43 1.01 -0.48 -1.66 120.40 118.79 2da0 s VAL 34 Ca -0.00 0.21 -0.21 0.00 0.00 0.00 0.00 61.98 61.98 2da0 s VAL 34 Cb -0.00 -0.46 0.07 0.00 0.00 0.00 0.00 36.38 35.99 2da0 s VAL 34 CO -0.09 0.09 0.65 -0.75 0.00 0.00 0.00 175.10 175.00 2da0 s LYS 35 N 1.97 0.74 -1.81 2.72 2.20 -0.41 -1.91 119.74 123.24 2da0 s LYS 35 Ca -0.03 0.97 0.00 0.00 -0.36 0.00 0.00 55.97 56.54 2da0 s LYS 35 Cb -0.11 0.32 0.00 0.00 -1.51 0.00 0.00 37.83 36.53 2da0 s LYS 35 CO -0.09 -0.10 0.00 0.09 -0.36 0.00 0.00 175.35 174.88 2da0 n ASN 36 N 3.06 -5.40 -0.25 1.43 3.02 -1.26 -1.35 115.26 114.52 2da0 n ASN 36 Ca -0.15 0.21 -0.03 0.00 -0.03 0.00 0.00 54.58 54.58 2da0 n ASN 36 Cb 0.56 -4.51 -0.01 0.00 -0.61 0.00 0.00 39.78 35.21 2da0 n ASN 36 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2da0 n GLY 37 N -0.84 0.53 3.13 7.41 0.00 -1.26 -5.03 105.19 109.12 2da0 n GLY 37 Ca -0.21 -0.91 -0.28 0.00 0.00 0.00 0.00 46.02 44.63 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 -2.12 1.56 -0.34 -0.61 -1.09 -0.46 -2.16 121.20 115.99 2da0 s ILE 38 Ca 0.00 -0.74 -0.10 0.00 -2.23 0.00 0.00 60.65 57.58 2da0 s ILE 38 Cb 0.00 -1.36 0.01 0.00 -1.58 0.00 0.00 42.46 39.53 2da0 s ILE 38 CO 0.00 0.45 0.16 -0.22 -1.23 0.00 0.00 174.94 174.10 2da0 s LEU 39 N 0.36 4.34 -0.05 2.97 2.96 -0.89 -1.29 118.68 127.07 2da0 s LEU 39 Ca -0.13 -0.79 -0.08 0.00 -0.22 0.00 0.00 54.13 52.91 2da0 s LEU 39 Cb -0.15 -1.98 -0.05 0.00 0.50 0.00 0.00 46.19 44.51 2da0 s LEU 39 CO 0.05 -0.28 0.24 -0.89 -1.32 0.00 0.00 176.35 174.15 2da0 s THR 40 N 1.56 5.34 -0.32 3.68 2.01 -0.67 -0.43 115.64 126.80 2da0 s THR 40 Ca 0.03 0.33 0.03 0.00 0.31 0.00 0.00 61.69 62.38 2da0 s THR 40 Cb -0.18 -3.52 0.10 0.00 0.01 0.00 0.00 72.50 68.90 2da0 s THR 40 CO 0.06 0.53 0.05 -0.63 -0.69 0.00 0.00 174.62 173.93 2da0 s ILE 41 N -1.13 1.96 0.61 1.82 1.01 -1.08 -2.26 121.20 122.13 2da0 s ILE 41 Ca 0.21 -2.07 -0.18 0.00 0.00 0.00 0.00 60.65 58.61 2da0 s ILE 41 Cb -0.13 -2.42 -0.06 0.00 0.01 0.00 0.00 42.46 39.85 2da0 s ILE 41 CO 0.10 -0.56 0.68 -0.24 0.00 0.00 0.00 174.94 174.92 2da0 n SER 42 N 4.40 -0.46 -3.82 3.58 2.88 -1.21 -2.18 113.62 116.80 2da0 n SER 42 Ca 0.01 0.73 -0.23 0.00 -1.33 0.00 0.00 58.87 58.05 2da0 n SER 42 Cb 0.42 -1.25 -0.07 0.00 -0.75 0.00 0.00 64.21 62.55 2da0 n SER 42 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2da0 n HIS 43 N -1.86 -0.92 -0.24 0.66 -0.00 -1.26 -4.76 115.22 106.85 2da0 n HIS 43 Ca 0.12 0.44 -0.04 0.00 -0.00 0.00 0.00 57.72 58.24 2da0 n HIS 43 Cb 0.48 -2.03 0.07 0.00 -0.00 0.00 0.00 29.99 28.50 2da0 n HIS 43 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 2da0 h ALA 44 N 1.13 0.87 0.00 1.59 0.00 -1.74 -3.40 119.26 117.71 2da0 h ALA 44 Ca -0.48 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.40 2da0 h ALA 44 Cb 1.02 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.58 2da0 h ALA 44 CO 0.51 0.20 -0.32 2.41 0.00 0.00 0.00 179.25 182.06 2da0 n THR 45 N -4.67 0.00 -3.84 0.00 -1.04 -1.26 -5.00 114.28 98.46 2da0 n THR 45 Ca 0.07 0.00 -0.05 0.00 -2.04 0.00 0.00 64.05 62.03 2da0 n THR 45 Cb 0.07 -0.17 0.01 0.00 -1.82 0.00 0.00 70.33 68.43 2da0 n THR 45 CO 0.00 0.00 0.00 -0.44 -0.64 0.00 0.00 175.07 173.99 2da0 s SER 46 N -3.22 -0.04 0.40 8.00 0.01 -1.26 -5.01 113.70 112.58 2da0 s SER 46 Ca 0.00 -0.74 0.26 0.00 1.31 0.00 0.00 55.95 56.78 2da0 s SER 46 Cb 0.00 0.60 1.40 0.00 0.21 0.00 0.00 66.02 68.23 2da0 s SER 46 CO 0.00 -1.17 1.55 -3.20 0.41 0.00 0.00 173.24 170.83 2da0 n ASN 47 N -1.10 0.28 -4.35 2.44 5.15 -1.26 -4.53 115.26 111.88 2da0 n ASN 47 Ca -0.05 1.50 -0.36 0.00 -0.60 0.00 0.00 54.58 55.07 2da0 n ASN 47 Cb 0.60 -0.73 0.06 0.00 -0.53 0.00 0.00 39.78 39.17 2da0 n ASN 47 CO 0.00 0.00 0.00 -1.14 1.40 0.00 0.00 177.26 177.52 2da0 n ARG 48 N -4.95 0.16 -1.13 1.20 3.00 -1.26 -4.78 116.66 108.89 2da0 n ARG 48 Ca 0.39 0.08 -0.36 0.00 -0.00 0.00 0.00 57.85 57.96 2da0 n ARG 48 Cb 1.41 -1.55 0.00 0.00 0.00 0.00 0.00 32.46 32.32 2da0 n ARG 48 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.63 178.67 2da0 n GLN 49 N 0.09 0.00 -1.11 -0.14 1.13 -1.26 -4.78 117.38 111.31 2da0 n GLN 49 Ca 0.08 0.00 -0.29 0.00 -1.94 0.00 0.00 57.00 54.84 2da0 n GLN 49 Cb 0.51 -0.88 0.22 0.00 0.11 0.00 0.00 30.24 30.19 2da0 n GLN 49 CO 0.00 0.00 0.00 -1.25 -1.44 0.00 0.00 177.06 174.37 2da0 s PRO 50 N -0.88 -0.59 -0.36 -1.09 0.04 -1.26 -4.80 135.00 126.06 2da0 s PRO 50 Ca 0.51 0.16 -0.18 0.00 0.04 0.00 0.00 61.00 61.54 2da0 s PRO 50 Cb -0.52 -1.65 -0.00 0.00 0.04 0.00 0.00 34.50 32.37 2da0 s PRO 50 CO 0.56 -3.34 0.50 0.00 0.04 0.00 0.00 177.00 174.77 2da0 s ALA 51 N -2.99 3.47 -0.29 8.56 0.00 -1.20 -4.85 121.76 124.46 2da0 s ALA 51 Ca 0.69 -1.08 -0.20 0.00 0.00 0.00 0.00 51.96 51.36 2da0 s ALA 51 Cb -0.14 -3.02 -0.01 0.00 0.00 0.00 0.00 23.12 19.95 2da0 s ALA 51 CO 0.57 -1.27 0.63 0.15 0.00 0.00 0.00 175.76 175.83 2da0 s LYS 52 N 2.37 3.97 -0.35 0.00 1.02 -1.26 -2.63 119.74 122.86 2da0 s LYS 52 Ca 0.18 0.38 -0.10 0.00 0.02 0.00 0.00 55.97 56.45 2da0 s LYS 52 Cb -0.16 -3.70 0.02 0.00 -0.52 0.00 0.00 37.83 33.47 2da0 s LYS 52 CO 0.14 -0.52 0.18 -0.51 -0.92 0.00 0.00 175.35 173.72 2da0 s LEU 53 N 2.57 4.48 0.04 3.17 1.43 0.42 -4.92 118.68 125.88 2da0 s LEU 53 Ca 0.25 -0.85 -0.30 0.00 -1.03 0.00 0.00 54.13 52.20 2da0 s LEU 53 Cb -0.15 -2.00 -0.08 0.00 0.03 0.00 0.00 46.19 43.99 2da0 s LEU 53 CO 0.11 -0.32 1.71 0.21 0.23 0.00 0.00 176.35 178.29 2da0 s ASN 54 N 1.56 6.59 0.19 2.29 3.84 -1.26 -2.10 114.94 126.05 2da0 s ASN 54 Ca 0.03 2.46 0.00 0.00 0.21 0.00 0.00 52.86 55.56 2da0 s ASN 54 Cb -0.18 -2.55 0.10 0.00 -0.55 0.00 0.00 41.25 38.06 2da0 s ASN 54 CO 0.06 -0.93 1.46 -0.07 -2.79 0.00 0.00 177.10 174.83 2da0 h LEU 55 N 9.27 0.42 -2.52 3.21 4.07 -1.76 0.18 115.31 128.18 2da0 h LEU 55 Ca -0.43 -0.27 0.02 0.00 0.08 0.00 0.00 57.88 57.27 2da0 h LEU 55 Cb 1.20 -0.12 -0.00 0.00 1.08 0.00 0.00 40.66 42.82 2da0 h LEU 55 CO 0.94 1.00 0.11 -0.07 -1.08 0.00 0.00 178.44 179.34 2da0 h LEU 56 N 0.24 0.00 0.00 1.67 3.38 -1.90 -2.56 115.31 116.14 2da0 h LEU 56 Ca -0.02 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.77 2da0 h LEU 56 Cb 1.27 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.99 2da0 h LEU 56 CO 0.12 0.00 -1.65 0.35 0.09 0.00 0.00 178.44 177.35 2da0 n THR 57 N -3.39 0.65 -1.48 0.22 -2.24 -1.13 -5.03 114.28 101.88 2da0 n THR 57 Ca -0.02 -0.39 -0.30 0.00 -2.27 0.00 0.00 64.05 61.07 2da0 n THR 57 Cb 0.20 -0.76 0.09 0.00 -2.10 0.00 0.00 70.33 67.76 2da0 n THR 57 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2da0 s GLN 59 N -5.08 1.53 -0.38 0.00 0.74 -0.51 -4.84 119.66 111.11 2da0 s GLN 59 Ca 0.61 -1.14 0.03 0.00 0.05 0.00 0.00 55.36 54.91 2da0 s GLN 59 Cb -0.15 -1.78 0.11 0.00 1.10 0.00 0.00 33.01 32.29 2da0 s GLN 59 CO 0.55 0.45 0.11 0.08 -0.55 0.00 0.00 175.29 175.93 2da0 s VAL 60 N -0.91 2.16 -0.53 1.34 1.01 -1.26 -1.92 120.40 120.29 2da0 s VAL 60 Ca 0.11 -2.49 -0.06 0.00 0.00 0.00 0.00 61.98 59.53 2da0 s VAL 60 Cb -0.10 -2.57 0.14 0.00 0.00 0.00 0.00 36.38 33.85 2da0 s VAL 60 CO 0.03 -0.67 0.38 -0.54 0.00 0.00 0.00 175.10 174.30 2da0 s LYS 61 N 0.67 2.50 0.21 2.72 3.01 -0.59 -4.99 119.74 123.27 2da0 s LYS 61 Ca 0.13 -2.06 -0.30 0.00 -1.01 0.00 0.00 55.97 52.73 2da0 s LYS 61 Cb -0.21 -3.84 -0.09 0.00 -1.01 0.00 0.00 37.83 32.68 2da0 s LYS 61 CO -0.08 -1.17 1.29 -1.25 0.51 0.00 0.00 175.35 174.65 2da0 s PRO 62 N 0.80 4.40 -0.89 -1.68 0.04 -1.26 -1.49 135.00 134.92 2da0 s PRO 62 Ca 0.11 2.04 -0.22 0.00 0.04 0.00 0.00 61.00 62.97 2da0 s PRO 62 Cb -0.22 -3.19 0.07 0.00 0.04 0.00 0.00 34.50 31.21 2da0 s PRO 62 CO -0.03 -0.21 1.25 -0.80 0.04 0.00 0.00 177.00 177.25 2da0 s ASN 63 N 0.19 6.43 0.11 6.66 0.01 -0.36 -4.87 114.94 123.10 2da0 s ASN 63 Ca 0.55 -1.39 -0.23 0.00 -0.71 0.00 0.00 52.86 51.09 2da0 s ASN 63 Cb -0.36 -2.49 -0.10 0.00 0.41 0.00 0.00 41.25 38.71 2da0 s ASN 63 CO 0.40 -1.42 1.71 0.00 -1.51 0.00 0.00 177.10 176.28 2da0 h ALA 64 N 9.52 -0.02 -0.71 0.60 0.00 -1.93 -2.70 119.26 124.02 2da0 h ALA 64 Ca 0.03 0.02 0.20 0.00 0.00 0.00 0.00 54.91 55.16 2da0 h ALA 64 Cb 1.03 0.11 -0.13 0.00 0.00 0.00 0.00 17.79 18.80 2da0 h ALA 64 CO 1.27 -0.54 0.03 0.39 0.00 0.00 0.00 179.25 180.41 2da0 n GLU 65 N -5.17 -0.06 -3.78 0.00 1.02 -1.26 -4.39 120.64 107.00 2da0 n GLU 65 Ca -0.05 1.07 -0.24 0.00 -0.02 0.00 0.00 57.16 57.91 2da0 n GLU 65 Cb 0.10 -1.70 -0.02 0.00 -0.02 0.00 0.00 31.44 29.80 2da0 n GLU 65 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2da0 s ASP 66 N -4.99 4.75 0.08 1.62 1.01 -1.02 -5.14 116.67 112.98 2da0 s ASP 66 Ca -0.09 -1.06 0.04 0.00 0.71 0.00 0.00 52.55 52.15 2da0 s ASP 66 Cb 0.21 -0.00 -0.04 0.00 1.01 0.00 0.00 42.92 44.10 2da0 s ASP 66 CO 0.56 -0.91 0.03 -0.54 0.21 0.00 0.00 175.17 174.52 2da0 s LYS 67 N -4.21 2.70 -1.31 8.23 -0.14 -1.26 -4.61 119.74 119.15 2da0 s LYS 67 Ca 0.41 -0.75 -0.03 0.00 -1.36 0.00 0.00 55.97 54.23 2da0 s LYS 67 Cb -0.02 -2.63 -0.00 0.00 -1.68 0.00 0.00 37.83 33.50 2da0 s LYS 67 CO 0.24 0.56 0.62 1.63 -0.76 0.00 0.00 175.35 177.64 2da0 n LYS 68 N 0.62 -3.72 -3.81 1.68 5.02 -1.26 -4.96 118.16 111.73 2da0 n LYS 68 Ca -0.10 0.53 -0.13 0.00 -2.02 0.00 0.00 58.31 56.59 2da0 n LYS 68 Cb 0.52 -4.82 -0.13 0.00 -0.02 0.00 0.00 35.03 30.59 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 -4.21 -0.16 -0.27 4.39 0.15 -1.26 -2.75 113.70 109.59 2da0 s SER 69 Ca 0.09 0.33 -0.25 0.00 0.70 0.00 0.00 55.95 56.81 2da0 s SER 69 Cb -0.03 0.32 0.07 0.00 -1.71 0.00 0.00 66.02 64.67 2da0 s SER 69 CO 0.84 -0.07 0.74 0.72 1.20 0.00 0.00 173.24 176.68 2da0 s PHE 70 N 0.20 -0.77 -0.14 3.44 -0.71 -1.16 -1.23 117.98 117.61 2da0 s PHE 70 Ca -0.01 1.88 -0.03 0.00 -1.04 0.00 0.00 56.93 57.73 2da0 s PHE 70 Cb -0.02 0.28 -0.03 0.00 -1.21 0.00 0.00 43.02 42.04 2da0 s PHE 70 CO -0.01 -0.37 -0.03 -0.51 -1.34 0.00 0.00 175.22 172.96 2da0 s ASP 71 N 0.40 4.89 -0.48 1.98 1.01 -0.56 -1.48 116.67 122.43 2da0 s ASP 71 Ca 0.00 -0.07 -0.11 0.00 0.71 0.00 0.00 52.55 53.08 2da0 s ASP 71 Cb -0.05 -1.69 0.11 0.00 1.01 0.00 0.00 42.92 42.31 2da0 s ASP 71 CO 0.00 0.22 0.37 -0.22 0.21 0.00 0.00 175.17 175.75 2da0 s LEU 72 N 0.07 5.72 -0.61 1.23 2.96 0.18 -1.54 118.68 126.70 2da0 s LEU 72 Ca 0.00 -1.80 -0.27 0.00 -0.22 0.00 0.00 54.13 51.84 2da0 s LEU 72 Cb -0.13 -2.06 0.03 0.00 0.50 0.00 0.00 46.19 44.53 2da0 s LEU 72 CO 0.03 -0.71 1.16 -0.63 -1.32 0.00 0.00 176.35 174.88 2da0 s ILE 73 N 1.43 4.04 0.18 6.68 1.01 -0.81 0.12 121.20 133.86 2da0 s ILE 73 Ca 0.05 0.68 -0.27 0.00 0.00 0.00 0.00 60.65 61.11 2da0 s ILE 73 Cb -0.26 -4.73 -0.08 0.00 0.01 0.00 0.00 42.46 37.40 2da0 s ILE 73 CO 0.01 -1.40 0.83 -0.44 0.00 0.00 0.00 174.94 173.93 2da0 s SER 74 N 3.10 7.46 0.60 3.58 0.01 0.35 -1.42 113.70 127.37 2da0 s SER 74 Ca 0.39 1.72 0.29 0.00 1.31 0.00 0.00 55.95 59.66 2da0 s SER 74 Cb -0.09 -2.53 1.06 0.00 0.21 0.00 0.00 66.02 64.68 2da0 s SER 74 CO 0.22 0.18 1.40 -0.74 0.41 0.00 0.00 173.24 174.71 2da0 h HIS 75 N 4.37 0.00 0.00 2.43 2.76 -1.95 -0.26 115.15 122.51 2da0 h HIS 75 Ca -0.46 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 57.71 2da0 h HIS 75 Cb 1.20 0.00 0.00 0.00 1.55 0.00 0.00 27.41 30.16 2da0 h HIS 75 CO 0.63 0.00 -0.40 -0.97 -1.30 0.00 0.00 177.93 175.89 2da0 h ASN 76 N 0.00 0.00 -3.89 3.26 -0.73 -1.96 -3.50 115.58 108.75 2da0 h ASN 76 Ca 0.50 0.00 -0.32 0.00 1.87 0.00 0.00 56.30 58.35 2da0 h ASN 76 Cb 2.80 0.00 -0.08 0.00 0.27 0.00 0.00 38.32 41.30 2da0 h ASN 76 CO -0.01 0.69 -0.30 0.54 -0.37 0.00 0.00 177.43 177.98 2da0 n ARG 77 N -4.57 0.29 -3.70 6.67 1.74 -0.11 -5.15 116.66 111.84 2da0 n ARG 77 Ca -0.06 -2.24 -0.36 0.00 -0.77 0.00 0.00 57.85 54.43 2da0 n ARG 77 Cb 0.21 1.86 -0.09 0.00 -1.02 0.00 0.00 32.46 33.42 2da0 n ARG 77 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 2da0 s THR 78 N -2.90 5.38 0.09 0.55 2.01 -1.26 0.13 115.64 119.64 2da0 s THR 78 Ca 0.27 0.18 0.07 0.00 0.31 0.00 0.00 61.69 62.52 2da0 s THR 78 Cb 0.01 -3.48 -0.04 0.00 0.01 0.00 0.00 72.50 69.00 2da0 s THR 78 CO 0.19 0.39 -0.11 -0.31 -0.69 0.00 0.00 174.62 174.09 2da0 s TYR 79 N 0.70 2.72 -0.01 4.92 1.51 0.12 -4.90 117.35 122.42 2da0 s TYR 79 Ca 0.08 -0.16 0.04 0.00 -1.01 0.00 0.00 57.07 56.02 2da0 s TYR 79 Cb -0.12 -1.45 -0.03 0.00 -0.11 0.00 0.00 41.96 40.25 2da0 s TYR 79 CO 0.01 0.40 -0.12 -1.01 -1.11 0.00 0.00 175.55 173.72 2da0 s HIS 80 N -1.17 2.74 0.18 2.71 3.76 -1.26 0.52 115.29 122.76 2da0 s HIS 80 Ca 0.20 -0.13 -0.02 0.00 -0.15 0.00 0.00 55.06 54.95 2da0 s HIS 80 Cb -0.11 -1.58 -0.04 0.00 1.11 0.00 0.00 32.58 31.97 2da0 s HIS 80 CO 0.12 0.28 0.14 -0.06 -0.85 0.00 0.00 174.74 174.37 2da0 s PHE 81 N -0.88 0.94 -0.16 1.40 0.08 -0.55 -3.08 117.98 115.73 2da0 s PHE 81 Ca 0.14 -1.24 -0.25 0.00 0.12 0.00 0.00 56.93 55.70 2da0 s PHE 81 Cb -0.11 -0.44 0.06 0.00 -0.57 0.00 0.00 43.02 41.96 2da0 s PHE 81 CO 0.04 -0.63 0.65 -0.65 -0.10 0.00 0.00 175.22 174.53 2da0 s GLN 82 N -4.10 0.87 0.27 0.44 -0.21 -0.49 -3.01 119.66 113.43 2da0 s GLN 82 Ca 0.31 0.61 -0.03 0.00 0.02 0.00 0.00 55.36 56.27 2da0 s GLN 82 Cb 0.06 0.42 -0.05 0.00 1.00 0.00 0.00 33.01 34.44 2da0 s GLN 82 CO 0.07 -0.18 0.50 0.00 -2.12 0.00 0.00 175.29 173.56 2da0 s ALA 83 N -0.31 3.70 -0.16 6.09 0.00 -1.11 -0.95 121.76 129.02 2da0 s ALA 83 Ca -0.05 -0.68 -0.20 0.00 0.00 0.00 0.00 51.96 51.04 2da0 s ALA 83 Cb -0.03 -2.18 -0.17 0.00 0.00 0.00 0.00 23.12 20.74 2da0 s ALA 83 CO 0.04 0.28 0.31 0.93 0.00 0.00 0.00 175.76 177.33 2da0 h GLU 84 N 1.71 0.00 -6.28 0.00 3.07 -1.90 -3.47 114.58 107.71 2da0 h GLU 84 Ca -0.48 0.00 -0.59 0.00 -0.50 0.00 0.00 59.36 57.79 2da0 h GLU 84 Cb 1.19 0.00 -0.12 0.00 -0.84 0.00 0.00 28.75 28.98 2da0 h GLU 84 CO 0.66 0.74 -0.70 0.34 -1.40 0.00 0.00 179.01 178.65 2da0 s ASP 85 N -6.34 4.16 0.24 1.42 2.15 -1.26 -5.02 116.67 112.02 2da0 s ASP 85 Ca -0.20 -0.74 -0.05 0.00 0.43 0.00 0.00 52.55 51.98 2da0 s ASP 85 Cb 0.02 -0.64 0.41 0.00 -0.30 0.00 0.00 42.92 42.41 2da0 s ASP 85 CO 0.50 0.04 1.75 -0.08 -0.17 0.00 0.00 175.17 177.22 2da0 h GLU 86 N 2.29 0.51 -0.37 4.34 4.81 -2.00 0.54 114.58 124.71 2da0 h GLU 86 Ca -0.44 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 58.75 2da0 h GLU 86 Cb 1.24 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 30.48 2da0 h GLU 86 CO 0.58 0.34 0.16 1.96 -0.73 0.00 0.00 179.01 181.33 2da0 h GLN 87 N 0.53 0.51 -0.34 1.92 4.20 -1.99 -1.30 115.11 118.65 2da0 h GLN 87 Ca 0.39 -0.06 -0.05 0.00 0.06 0.00 0.00 58.65 59.00 2da0 h GLN 87 Cb 0.52 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 28.18 2da0 h GLN 87 CO -0.34 0.41 0.03 0.22 -0.67 0.00 0.00 178.83 178.48 2da0 h ASP 88 N 0.52 0.56 0.57 1.46 3.58 -1.31 -2.05 116.42 119.75 2da0 h ASP 88 Ca 0.13 -0.28 -0.03 0.00 0.42 0.00 0.00 57.03 57.27 2da0 h ASP 88 Cb 0.08 -0.15 0.01 0.00 1.72 0.00 0.00 39.33 40.99 2da0 h ASP 88 CO -0.02 0.71 -0.27 0.22 -2.88 0.00 0.00 179.24 177.00 2da0 h TYR 89 N 0.40 -0.71 -0.82 0.28 3.20 -0.97 0.16 116.97 118.51 2da0 h TYR 89 Ca 0.10 -0.02 0.20 0.00 3.14 0.00 0.00 58.73 62.15 2da0 h TYR 89 Cb 0.40 0.24 -0.14 0.00 1.54 0.00 0.00 36.73 38.76 2da0 h TYR 89 CO 0.03 -0.44 0.02 0.28 -1.64 0.00 0.00 178.16 176.41 2da0 h VAL 90 N -1.07 0.27 0.35 1.81 2.07 -1.34 -0.72 116.25 117.63 2da0 h VAL 90 Ca -0.08 -0.03 -0.02 0.00 0.82 0.00 0.00 66.70 67.39 2da0 h VAL 90 Cb 0.59 0.17 0.00 0.00 -1.52 0.00 0.00 31.29 30.53 2da0 h VAL 90 CO 0.13 0.02 -0.17 0.00 0.02 0.00 0.00 177.57 177.57 2da0 h ALA 91 N 1.78 -0.68 -0.77 1.67 0.00 -1.39 -2.81 119.26 117.05 2da0 h ALA 91 Ca 0.46 -0.10 0.07 0.00 0.00 0.00 0.00 54.91 55.34 2da0 h ALA 91 Cb 0.85 0.18 -0.09 0.00 0.00 0.00 0.00 17.79 18.73 2da0 h ALA 91 CO -0.73 -0.64 -0.46 0.91 0.00 0.00 0.00 179.25 178.34 2da0 n TRP 92 N -4.08 -0.34 -0.21 0.00 5.03 0.55 0.79 117.44 119.19 2da0 n TRP 92 Ca -0.06 0.97 0.02 0.00 3.03 0.00 0.00 57.50 61.46 2da0 n TRP 92 Cb 0.19 -0.56 0.13 0.00 -1.03 0.00 0.00 31.31 30.04 2da0 n TRP 92 CO 0.00 0.00 0.00 0.82 -0.03 0.00 0.00 177.69 178.48 2da0 h ILE 93 N 0.00 0.59 -0.88 -0.99 1.08 -1.25 0.19 117.51 116.25 2da0 h ILE 93 Ca 0.12 -0.09 0.03 0.00 -0.39 0.00 0.00 64.86 64.54 2da0 h ILE 93 Cb 0.32 0.32 -0.05 0.00 -3.07 0.00 0.00 36.82 34.34 2da0 h ILE 93 CO -0.73 0.05 0.58 0.28 -0.69 0.00 0.00 178.15 177.64 2da0 h SER 94 N 0.25 0.96 0.00 1.72 0.02 0.67 -2.35 113.55 114.81 2da0 h SER 94 Ca 0.34 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.28 2da0 h SER 94 Cb 0.54 -0.22 0.00 0.00 0.14 0.00 0.00 62.40 62.85 2da0 h SER 94 CO -0.45 0.66 0.00 0.52 -1.14 0.00 0.00 176.83 176.43 2da0 n VAL 95 N -4.44 0.00 -0.25 2.27 0.31 0.36 -1.29 118.33 115.29 2da0 n VAL 95 Ca 0.11 0.81 0.02 0.00 -0.01 0.00 0.00 64.34 65.27 2da0 n VAL 95 Cb 0.09 -1.79 0.07 0.00 -0.91 0.00 0.00 33.84 31.30 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 -1.96 -0.32 0.12 7.52 4.77 0.46 0.32 117.00 127.92 2da0 n LEU 96 Ca 0.00 1.17 -0.13 0.00 -0.03 0.00 0.00 56.01 57.02 2da0 n LEU 96 Cb 0.00 -0.32 -0.08 0.00 -2.33 0.00 0.00 43.42 40.69 2da0 n LEU 96 CO 0.00 -1.09 0.56 0.74 -1.33 0.00 0.00 177.39 176.27 2da0 h THR 97 N 0.00 0.79 -0.01 -5.08 2.02 -1.54 -3.14 112.91 105.95 2da0 h THR 97 Ca 0.29 -0.67 0.00 0.00 0.77 0.00 0.00 66.41 66.80 2da0 h THR 97 Cb 0.46 1.15 -0.00 0.00 -1.74 0.00 0.00 68.15 68.02 2da0 h THR 97 CO -0.69 0.14 -0.04 0.78 0.37 0.00 0.00 175.52 176.08 2da0 h ASN 98 N -0.70 -0.13 -1.09 4.18 2.35 0.12 -0.31 115.58 120.00 2da0 h ASN 98 Ca -0.03 0.01 0.39 0.00 -0.55 0.00 0.00 56.30 56.12 2da0 h ASN 98 Cb 0.48 0.05 -0.12 0.00 0.05 0.00 0.00 38.32 38.78 2da0 h ASN 98 CO 0.06 -0.04 0.69 -0.24 -1.65 0.00 0.00 177.43 176.25 2da0 n SER 99 N -2.77 0.19 0.23 5.81 2.88 0.33 0.60 113.62 120.90 2da0 n SER 99 Ca -0.00 1.18 -0.13 0.00 -1.33 0.00 0.00 58.87 58.59 2da0 n SER 99 Cb 0.03 -0.58 -0.07 0.00 -0.75 0.00 0.00 64.21 62.84 2da0 n SER 99 CO 0.00 0.00 0.00 0.50 -1.23 0.00 0.00 175.04 174.31 2da0 h LYS 100 N 0.00 -0.61 0.61 -1.46 3.64 -1.05 -2.55 116.57 115.16 2da0 h LYS 100 Ca 0.72 0.04 -0.03 0.00 -1.27 0.00 0.00 60.65 60.12 2da0 h LYS 100 Cb 2.28 0.14 0.01 0.00 -0.41 0.00 0.00 32.23 34.24 2da0 h LYS 100 CO -0.42 -0.31 -0.29 0.93 -2.27 0.00 0.00 179.45 177.09 2da0 h GLU 101 N -1.03 -0.79 0.00 1.90 5.08 0.12 -0.66 114.58 119.21 2da0 h GLU 101 Ca -0.06 0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 2da0 h GLU 101 Cb 0.58 0.18 0.00 0.00 0.50 0.00 0.00 28.75 30.01 2da0 h GLU 101 CO 0.11 -0.48 0.40 0.93 -1.00 0.00 0.00 179.01 178.96 2da0 h GLU 102 N -0.96 0.00 0.00 2.33 4.39 -0.58 0.74 114.58 120.50 2da0 h GLU 102 Ca -0.08 0.00 -0.29 0.00 0.34 0.00 0.00 59.36 59.33 2da0 h GLU 102 Cb 0.67 0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 29.27 2da0 h GLU 102 CO 0.14 0.00 -1.94 0.00 -1.16 0.00 0.00 179.01 176.05 2da0 n ALA 103 N -1.72 1.64 -0.06 3.43 0.00 -0.87 -4.19 120.51 118.74 2da0 n ALA 103 Ca -0.01 -0.94 -0.16 0.00 0.00 0.00 0.00 53.44 52.33 2da0 n ALA 103 Cb 0.43 -0.61 -0.13 0.00 0.00 0.00 0.00 19.45 19.15 2da0 n ALA 103 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2da0 h LEU 104 N 0.00 0.06 -1.37 0.00 3.38 0.19 -2.65 115.31 114.92 2da0 h LEU 104 Ca -0.35 -0.93 0.00 0.00 0.09 0.00 0.00 57.88 56.69 2da0 h LEU 104 Cb 1.98 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 42.71 2da0 h LEU 104 CO 0.05 1.11 0.29 0.00 0.09 0.00 0.00 178.44 179.98 2da0 h THR 105 N -0.92 0.00 0.00 0.22 1.03 -0.99 0.47 112.91 112.72 2da0 h THR 105 Ca -0.06 0.00 -0.08 0.00 -0.01 0.00 0.00 66.41 66.26 2da0 h THR 105 Cb 1.12 0.46 -0.01 0.00 -1.07 0.00 0.00 68.15 68.64 2da0 h THR 105 CO -0.01 0.00 -1.95 1.15 -0.01 0.00 0.00 175.52 174.70 2da0 n MET 106 N -2.41 0.71 -2.49 0.00 0.00 -1.24 -4.98 117.12 106.71 2da0 n MET 106 Ca -0.01 -0.13 -0.34 0.00 0.00 0.00 0.00 57.70 57.21 2da0 n MET 106 Cb 0.32 -1.45 -0.03 0.00 0.00 0.00 0.00 33.22 32.06 2da0 n MET 106 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2da0 s ALA 107 N -3.09 2.85 0.04 3.17 0.00 0.16 -4.96 121.76 119.93 2da0 s ALA 107 Ca -0.07 0.60 -0.30 0.00 0.00 0.00 0.00 51.96 52.19 2da0 s ALA 107 Cb 0.10 -3.26 -0.08 0.00 0.00 0.00 0.00 23.12 19.89 2da0 s ALA 107 CO 0.77 -0.37 1.70 -0.06 0.00 0.00 0.00 175.76 177.79 2da0 s PHE 108 N -2.00 2.20 0.06 0.00 0.40 -1.26 -4.90 117.98 112.47 2da0 s PHE 108 Ca 0.67 0.19 -0.17 0.00 -0.60 0.00 0.00 56.93 57.03 2da0 s PHE 108 Cb -0.17 -3.99 -0.15 0.00 0.51 0.00 0.00 43.02 39.22 2da0 s PHE 108 CO 0.21 -4.10 1.30 1.03 0.70 0.00 0.00 175.22 174.37 2da0 h SER 109 N 8.83 0.64 -2.74 1.36 0.87 -1.93 -3.39 113.55 117.19 2da0 h SER 109 Ca -0.43 -0.57 -0.60 0.00 -1.23 0.00 0.00 61.79 58.96 2da0 h SER 109 Cb 1.20 -0.19 -0.40 0.00 -0.44 0.00 0.00 62.40 62.58 2da0 h SER 109 CO 0.94 1.10 -0.81 -0.83 -0.53 0.00 0.00 176.83 176.69 2da0 s GLY 110 N -3.79 1.80 0.61 5.77 0.00 -1.26 -5.12 107.32 105.33 2da0 s GLY 110 Ca -0.13 -2.89 -0.17 0.00 0.00 0.00 0.00 44.72 41.53 2da0 s GLY 110 CO 0.82 1.72 1.12 2.56 0.00 0.00 0.00 173.10 179.32 2da0 s PRO 111 N -0.35 3.01 0.19 2.90 0.04 -1.26 -4.92 135.00 134.61 2da0 s PRO 111 Ca 0.28 1.48 -0.24 0.00 0.04 0.00 0.00 61.00 62.55 2da0 s PRO 111 Cb -0.03 -1.97 -0.15 0.00 0.04 0.00 0.00 34.50 32.39 2da0 s PRO 111 CO -0.16 -1.09 0.44 0.43 0.04 0.00 0.00 177.00 176.66 2da0 n SER 112 N -1.98 -1.19 -4.55 6.66 7.64 -1.26 -4.73 113.62 114.20 2da0 n SER 112 Ca 0.11 0.98 -0.39 0.00 1.01 0.00 0.00 58.87 60.58 2da0 n SER 112 Cb 0.52 -0.84 -0.03 0.00 -1.01 0.00 0.00 64.21 62.85 2da0 n SER 112 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2da0 s SER 113 N -0.88 5.44 0.00 6.43 0.01 -1.26 -5.27 113.70 118.17 2da0 s SER 113 Ca 0.56 0.33 0.00 0.00 1.31 0.00 0.00 55.95 58.15 2da0 s SER 113 Cb -0.81 -2.53 0.00 0.00 0.21 0.00 0.00 66.02 62.89 2da0 s SER 113 CO 0.50 -2.25 0.00 0.61 0.41 0.00 0.00 173.24 172.51