#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 6.32 0.93 1.61 0.01 -1.26 -5.08 113.70 116.22 2da0 s SER 2 Ca 0.00 0.36 -0.13 0.00 1.31 0.00 0.00 55.95 57.49 2da0 s SER 2 Cb 0.00 -2.18 0.19 0.00 0.21 0.00 0.00 66.02 64.25 2da0 s SER 2 CO 0.00 -0.00 1.27 -0.44 0.41 0.00 0.00 173.24 174.48 2da0 s SER 3 N 0.97 3.27 -0.45 2.44 0.01 -1.26 -5.07 113.70 113.60 2da0 s SER 3 Ca 0.14 0.10 0.05 0.00 1.31 0.00 0.00 55.95 57.56 2da0 s SER 3 Cb -0.14 -0.18 0.27 0.00 0.21 0.00 0.00 66.02 66.19 2da0 s SER 3 CO 0.06 -2.62 1.04 0.61 0.41 0.00 0.00 173.24 172.74 2da0 n GLY 4 N -3.61 -0.10 4.02 3.44 0.00 -1.26 -5.16 105.19 102.51 2da0 n GLY 4 Ca 0.16 0.25 -0.18 0.00 0.00 0.00 0.00 46.02 46.25 2da0 n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2da0 s SER 5 N -1.30 5.42 0.38 1.61 1.04 -1.26 -5.11 113.70 114.48 2da0 s SER 5 Ca 0.27 -0.56 -0.05 0.00 0.48 0.00 0.00 55.95 56.09 2da0 s SER 5 Cb 0.25 -0.31 -0.05 0.00 0.10 0.00 0.00 66.02 66.01 2da0 s SER 5 CO -0.17 -1.00 0.67 -0.55 0.98 0.00 0.00 173.24 173.17 2da0 s SER 6 N -4.47 6.39 -1.05 7.02 0.15 -1.26 -5.02 113.70 115.45 2da0 s SER 6 Ca 0.58 0.83 -0.14 0.00 0.70 0.00 0.00 55.95 57.92 2da0 s SER 6 Cb -0.08 -2.20 0.20 0.00 -1.71 0.00 0.00 66.02 62.23 2da0 s SER 6 CO 0.36 -0.36 1.15 -0.83 1.20 0.00 0.00 173.24 174.75 2da0 s GLY 7 N -3.55 2.58 -0.04 9.45 0.00 -1.26 -4.84 107.32 109.65 2da0 s GLY 7 Ca 0.46 -3.36 -0.21 0.00 0.00 0.00 0.00 44.72 41.61 2da0 s GLY 7 CO 0.35 1.69 0.90 -0.97 0.00 0.00 0.00 173.10 175.08 2da0 h TYR 8 N 7.50 -0.24 0.00 1.90 -1.99 -1.95 -3.50 116.97 118.69 2da0 h TYR 8 Ca 0.20 -0.01 0.00 0.00 2.00 0.00 0.00 58.73 60.93 2da0 h TYR 8 Cb 0.94 0.08 0.00 0.00 2.00 0.00 0.00 36.73 39.75 2da0 h TYR 8 CO 1.01 0.17 0.00 0.41 -0.00 0.00 0.00 178.16 179.75 2da0 n GLY 9 N 0.48 4.17 0.10 3.88 0.00 -1.26 -4.98 105.19 107.57 2da0 n GLY 9 Ca -0.08 -0.95 -0.02 0.00 0.00 0.00 0.00 46.02 44.97 2da0 n GLY 9 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2da0 h SER 10 N 0.00 0.00 -3.37 1.61 0.02 -1.90 -3.33 113.55 106.58 2da0 h SER 10 Ca 0.00 0.00 -0.67 0.00 -0.84 0.00 0.00 61.79 60.28 2da0 h SER 10 Cb 0.00 0.00 -0.17 0.00 0.14 0.00 0.00 62.40 62.37 2da0 h SER 10 CO 0.00 0.73 -0.64 -1.61 -1.14 0.00 0.00 176.83 174.17 2da0 s GLU 11 N -2.84 3.18 -0.26 3.45 2.02 -1.26 -4.20 118.70 118.79 2da0 s GLU 11 Ca 0.02 -0.45 -0.14 0.00 0.02 0.00 0.00 54.97 54.42 2da0 s GLU 11 Cb 0.09 -2.82 0.08 0.00 0.10 0.00 0.00 34.13 31.57 2da0 s GLU 11 CO 0.78 0.56 0.62 0.21 0.02 0.00 0.00 175.26 177.46 2da0 s LYS 12 N -0.50 0.63 -0.16 1.61 2.20 -1.12 -5.05 119.74 117.35 2da0 s LYS 12 Ca 0.08 1.14 0.01 0.00 -0.36 0.00 0.00 55.97 56.84 2da0 s LYS 12 Cb -0.12 0.12 0.01 0.00 -1.51 0.00 0.00 37.83 36.34 2da0 s LYS 12 CO 0.02 -0.15 -0.19 0.21 -0.36 0.00 0.00 175.35 174.88 2da0 s LYS 13 N 1.63 3.06 0.00 4.03 2.20 -1.26 -2.09 119.74 127.31 2da0 s LYS 13 Ca -0.10 -0.82 0.00 0.00 -0.36 0.00 0.00 55.97 54.70 2da0 s LYS 13 Cb -0.06 -2.55 0.00 0.00 -1.51 0.00 0.00 37.83 33.71 2da0 s LYS 13 CO -0.18 -0.09 0.00 0.41 -0.36 0.00 0.00 175.35 175.13 2da0 n GLY 14 N 4.30 2.94 2.92 5.54 0.00 -1.15 -5.05 105.19 114.69 2da0 n GLY 14 Ca -0.20 -0.20 -0.13 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 -0.18 0.19 0.20 1.61 1.51 -1.26 -1.85 117.35 117.57 2da0 s TYR 15 Ca 0.00 -0.11 0.01 0.00 -1.01 0.00 0.00 57.07 55.96 2da0 s TYR 15 Cb 0.00 -0.12 -0.05 0.00 -0.11 0.00 0.00 41.96 41.68 2da0 s TYR 15 CO 0.00 -0.03 0.05 -0.51 -1.11 0.00 0.00 175.55 173.95 2da0 s LEU 16 N -0.29 1.81 0.22 -1.29 1.43 -0.81 -4.84 118.68 114.91 2da0 s LEU 16 Ca -0.02 -1.27 0.04 0.00 -1.03 0.00 0.00 54.13 51.85 2da0 s LEU 16 Cb -0.02 0.07 -0.03 0.00 0.03 0.00 0.00 46.19 46.23 2da0 s LEU 16 CO -0.00 -0.67 0.35 -0.76 0.23 0.00 0.00 176.35 175.50 2da0 s LEU 17 N -3.20 4.31 -0.05 1.79 1.43 -0.65 -1.76 118.68 120.55 2da0 s LEU 17 Ca 0.30 0.13 -0.02 0.00 -1.03 0.00 0.00 54.13 53.51 2da0 s LEU 17 Cb 0.07 -2.91 0.03 0.00 0.03 0.00 0.00 46.19 43.41 2da0 s LEU 17 CO 0.07 -0.05 0.11 -0.75 0.23 0.00 0.00 176.35 175.96 2da0 s LYS 18 N -3.76 0.07 -0.57 1.70 2.20 -0.46 -2.92 119.74 116.00 2da0 s LYS 18 Ca 0.35 0.26 -0.24 0.00 -0.36 0.00 0.00 55.97 55.98 2da0 s LYS 18 Cb -0.10 -0.11 0.05 0.00 -1.51 0.00 0.00 37.83 36.16 2da0 s LYS 18 CO 0.29 -0.11 0.93 0.21 -0.36 0.00 0.00 175.35 176.31 2da0 s LYS 19 N 0.78 3.27 -0.06 4.03 2.20 -1.18 -1.15 119.74 127.63 2da0 s LYS 19 Ca -0.06 -0.42 -0.30 0.00 -0.36 0.00 0.00 55.97 54.83 2da0 s LYS 19 Cb -0.08 -4.09 -0.09 0.00 -1.51 0.00 0.00 37.83 32.06 2da0 s LYS 19 CO -0.03 -1.54 2.03 0.45 -0.36 0.00 0.00 175.35 175.90 2da0 n SER 20 N 7.45 3.78 -4.73 1.43 2.88 0.07 -4.81 113.62 119.69 2da0 n SER 20 Ca 0.00 0.72 -0.24 0.00 -1.33 0.00 0.00 58.87 58.02 2da0 n SER 20 Cb 0.47 -1.50 0.09 0.00 -0.75 0.00 0.00 64.21 62.52 2da0 n SER 20 CO 0.00 0.00 0.00 1.51 -1.23 0.00 0.00 175.04 175.32 2da0 s ASP 21 N 5.48 4.51 0.00 -3.46 1.47 -1.26 -3.64 116.67 119.77 2da0 s ASP 21 Ca 0.93 -0.12 0.00 0.00 1.18 0.00 0.00 52.55 54.55 2da0 s ASP 21 Cb -0.46 -0.38 0.00 0.00 -0.34 0.00 0.00 42.92 41.74 2da0 s ASP 21 CO 0.42 -1.74 0.00 0.61 0.68 0.00 0.00 175.17 175.14 2da0 n GLY 22 N -2.82 2.00 0.29 2.12 0.00 -1.26 -4.71 105.19 100.81 2da0 n GLY 22 Ca 0.12 -0.77 -0.19 0.00 0.00 0.00 0.00 46.02 45.19 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 1.10 -4.37 -0.61 5.41 -1.26 -5.05 119.36 114.57 2da0 n ILE 23 Ca 0.00 -0.32 -0.19 0.00 1.00 0.00 0.00 62.75 63.24 2da0 n ILE 23 Cb 0.00 -1.58 -0.10 0.00 -0.71 0.00 0.00 39.64 37.25 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 -2.37 1.40 -0.49 0.38 1.70 -1.26 -5.12 118.95 113.19 2da0 s ARG 24 Ca -0.27 -1.66 -0.06 0.00 -0.47 0.00 0.00 55.73 53.27 2da0 s ARG 24 Cb 0.09 -1.07 0.13 0.00 -0.57 0.00 0.00 34.95 33.53 2da0 s ARG 24 CO 0.38 0.10 0.32 0.15 -1.08 0.00 0.00 175.30 175.18 2da0 s LYS 25 N -3.70 2.35 -0.06 3.89 1.02 -1.25 -4.22 119.74 117.78 2da0 s LYS 25 Ca 0.25 -1.94 0.06 0.00 0.02 0.00 0.00 55.97 54.36 2da0 s LYS 25 Cb 0.02 -3.78 -0.01 0.00 -0.52 0.00 0.00 37.83 33.53 2da0 s LYS 25 CO 0.08 -1.15 -0.25 0.14 -0.92 0.00 0.00 175.35 173.26 2da0 s VAL 26 N 0.99 2.11 -0.33 3.17 -7.23 -1.24 -4.89 120.40 112.97 2da0 s VAL 26 Ca 0.09 -1.05 -0.24 0.00 -1.81 0.00 0.00 61.98 58.97 2da0 s VAL 26 Cb -0.23 -1.76 0.01 0.00 0.56 0.00 0.00 36.38 34.95 2da0 s VAL 26 CO -0.03 0.57 0.83 0.26 -0.31 0.00 0.00 175.10 176.42 2da0 s TRP 27 N -0.20 3.16 0.03 2.82 0.52 -1.26 -0.75 118.94 123.26 2da0 s TRP 27 Ca -0.02 0.77 0.07 0.00 0.02 0.00 0.00 56.10 56.93 2da0 s TRP 27 Cb -0.13 -3.36 -0.03 0.00 -1.15 0.00 0.00 33.47 28.80 2da0 s TRP 27 CO 0.03 -0.66 -0.17 -0.65 0.02 0.00 0.00 176.95 175.52 2da0 s GLN 28 N 3.11 2.14 0.16 4.98 -0.21 -0.30 -4.89 119.66 124.65 2da0 s GLN 28 Ca 0.34 -0.94 -0.27 0.00 0.02 0.00 0.00 55.36 54.51 2da0 s GLN 28 Cb -0.13 -2.22 -0.07 0.00 1.00 0.00 0.00 33.01 31.58 2da0 s GLN 28 CO 0.15 0.55 0.84 0.50 -2.12 0.00 0.00 175.29 175.21 2da0 s ARG 29 N -1.37 4.65 0.04 2.91 3.52 -1.26 -1.36 118.95 126.08 2da0 s ARG 29 Ca 0.15 1.27 -0.11 0.00 -0.13 0.00 0.00 55.73 56.90 2da0 s ARG 29 Cb -0.11 -3.30 0.01 0.00 -1.56 0.00 0.00 34.95 29.99 2da0 s ARG 29 CO 0.05 0.46 0.23 1.03 -0.81 0.00 0.00 175.30 176.26 2da0 s ARG 30 N -0.80 0.73 -0.28 5.12 1.81 -0.72 -4.98 118.95 119.82 2da0 s ARG 30 Ca 0.39 -0.59 -0.26 0.00 -1.72 0.00 0.00 55.73 53.55 2da0 s ARG 30 Cb -0.23 0.31 0.01 0.00 -0.45 0.00 0.00 34.95 34.58 2da0 s ARG 30 CO 0.28 -0.22 0.92 0.21 -0.68 0.00 0.00 175.30 175.81 2da0 s LYS 31 N -2.55 4.09 0.21 3.54 2.36 -1.26 -1.93 119.74 124.19 2da0 s LYS 31 Ca -0.05 0.93 0.06 0.00 -2.55 0.00 0.00 55.97 54.36 2da0 s LYS 31 Cb -0.01 -3.70 -0.04 0.00 -1.05 0.00 0.00 37.83 33.04 2da0 s LYS 31 CO -0.04 -0.70 0.20 0.00 1.55 0.00 0.00 175.35 176.36 2da0 s SER 33 N -3.56 -0.80 -0.18 0.00 1.04 -1.17 -2.93 113.70 106.11 2da0 s SER 33 Ca 0.32 1.34 0.01 0.00 0.48 0.00 0.00 55.95 58.10 2da0 s SER 33 Cb -0.09 1.24 0.03 0.00 0.10 0.00 0.00 66.02 67.30 2da0 s SER 33 CO 0.25 -0.23 -0.12 -0.69 0.98 0.00 0.00 173.24 173.43 2da0 s VAL 34 N 1.34 1.62 -0.20 5.02 1.01 -0.89 -1.38 120.40 126.93 2da0 s VAL 34 Ca -0.08 -0.85 -0.14 0.00 0.00 0.00 0.00 61.98 60.91 2da0 s VAL 34 Cb -0.06 -1.62 0.06 0.00 0.00 0.00 0.00 36.38 34.76 2da0 s VAL 34 CO -0.14 0.30 0.50 -0.75 0.00 0.00 0.00 175.10 175.01 2da0 s LYS 35 N 1.43 0.53 -1.54 2.72 2.20 -0.84 -2.80 119.74 121.45 2da0 s LYS 35 Ca 0.02 0.83 -0.01 0.00 -0.36 0.00 0.00 55.97 56.45 2da0 s LYS 35 Cb -0.15 0.14 0.00 0.00 -1.51 0.00 0.00 37.83 36.31 2da0 s LYS 35 CO -0.09 -0.12 0.13 0.09 -0.36 0.00 0.00 175.35 175.00 2da0 n ASN 36 N 3.66 -5.43 -1.92 1.43 3.02 -1.26 -2.14 115.26 112.61 2da0 n ASN 36 Ca -0.19 -0.08 -0.13 0.00 -0.03 0.00 0.00 54.58 54.16 2da0 n ASN 36 Cb 0.56 -4.44 0.03 0.00 -0.61 0.00 0.00 39.78 35.32 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 -1.12 0.04 2.86 7.41 0.00 -1.26 -5.02 105.19 108.10 2da0 n GLY 37 Ca -0.19 -0.24 -0.19 0.00 0.00 0.00 0.00 46.02 45.41 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 -2.97 0.38 -0.45 -0.61 -1.09 -0.91 -2.60 121.20 112.95 2da0 s ILE 38 Ca 0.22 -0.04 -0.09 0.00 -2.23 0.00 0.00 60.65 58.50 2da0 s ILE 38 Cb -0.09 -0.43 0.10 0.00 -1.58 0.00 0.00 42.46 40.46 2da0 s ILE 38 CO 0.27 0.19 0.32 -0.22 -1.23 0.00 0.00 174.94 174.26 2da0 s LEU 39 N 0.92 5.51 0.20 2.97 2.96 -0.07 -1.99 118.68 129.17 2da0 s LEU 39 Ca -0.11 -1.75 -0.17 0.00 -0.22 0.00 0.00 54.13 51.88 2da0 s LEU 39 Cb -0.14 -2.01 -0.08 0.00 0.50 0.00 0.00 46.19 44.46 2da0 s LEU 39 CO -0.01 -0.64 0.65 -0.89 -1.32 0.00 0.00 176.35 174.15 2da0 s THR 40 N 1.40 4.70 -0.22 3.68 2.01 -0.48 -1.28 115.64 125.44 2da0 s THR 40 Ca 0.05 1.07 -0.00 0.00 0.31 0.00 0.00 61.69 63.11 2da0 s THR 40 Cb -0.25 -3.79 0.06 0.00 0.01 0.00 0.00 72.50 68.53 2da0 s THR 40 CO 0.01 0.20 -0.03 -0.63 -0.69 0.00 0.00 174.62 173.48 2da0 s ILE 41 N -1.53 1.19 -0.56 1.82 1.01 -0.37 -3.02 121.20 119.75 2da0 s ILE 41 Ca 0.41 -0.98 -0.28 0.00 0.00 0.00 0.00 60.65 59.81 2da0 s ILE 41 Cb -0.16 -1.53 0.03 0.00 0.01 0.00 0.00 42.46 40.82 2da0 s ILE 41 CO 0.20 -0.12 1.16 -0.44 0.00 0.00 0.00 174.94 175.74 2da0 s SER 42 N 1.55 6.46 0.90 3.58 0.01 -1.15 -2.82 113.70 122.23 2da0 s SER 42 Ca -0.04 0.11 -0.13 0.00 1.31 0.00 0.00 55.95 57.20 2da0 s SER 42 Cb -0.18 -2.54 0.14 0.00 0.21 0.00 0.00 66.02 63.65 2da0 s SER 42 CO -0.07 -1.43 1.18 -1.00 0.41 0.00 0.00 173.24 172.33 2da0 s HIS 43 N 4.79 2.40 0.24 2.43 3.76 -1.26 -4.33 115.29 123.31 2da0 s HIS 43 Ca 0.42 0.72 -0.14 0.00 -0.15 0.00 0.00 55.06 55.92 2da0 s HIS 43 Cb -0.08 -3.53 0.30 0.00 1.11 0.00 0.00 32.58 30.38 2da0 s HIS 43 CO 0.26 -2.31 1.57 0.00 -0.85 0.00 0.00 174.74 173.40 2da0 h ALA 44 N -1.45 0.34 -3.98 -1.40 0.00 -1.97 -3.39 119.26 107.42 2da0 h ALA 44 Ca -0.48 0.29 -0.42 0.00 0.00 0.00 0.00 54.91 54.31 2da0 h ALA 44 Cb 1.32 0.81 -0.29 0.00 0.00 0.00 0.00 17.79 19.62 2da0 h ALA 44 CO 0.58 -0.52 -0.79 -0.08 0.00 0.00 0.00 179.25 178.45 2da0 s THR 45 N -6.11 0.79 -0.34 0.00 -1.32 -1.26 -5.12 115.64 102.27 2da0 s THR 45 Ca -0.14 -0.40 -0.05 0.00 -1.21 0.00 0.00 61.69 59.88 2da0 s THR 45 Cb 0.22 -0.67 0.05 0.00 -1.51 0.00 0.00 72.50 70.59 2da0 s THR 45 CO 0.74 0.23 0.10 -0.55 -2.21 0.00 0.00 174.62 172.93 2da0 s SER 46 N -0.08 5.22 -0.10 8.08 0.15 -1.26 -4.98 113.70 120.72 2da0 s SER 46 Ca 0.01 -1.32 -0.15 0.00 0.70 0.00 0.00 55.95 55.20 2da0 s SER 46 Cb -0.06 -1.83 -0.13 0.00 -1.71 0.00 0.00 66.02 62.30 2da0 s SER 46 CO -0.00 -0.35 0.46 0.78 1.20 0.00 0.00 173.24 175.33 2da0 h ASN 47 N 8.15 -0.05 0.00 5.45 4.21 -2.00 -3.46 115.58 127.89 2da0 h ASN 47 Ca -0.21 -0.44 0.00 0.00 1.21 0.00 0.00 56.30 56.86 2da0 h ASN 47 Cb 1.07 0.01 0.00 0.00 -1.12 0.00 0.00 38.32 38.28 2da0 h ASN 47 CO 0.61 0.65 -0.02 -1.14 -1.29 0.00 0.00 177.43 176.24 2da0 n ARG 48 N -4.75 0.01 -3.93 0.81 3.00 -1.26 -5.11 116.66 105.42 2da0 n ARG 48 Ca -0.05 0.00 -0.10 0.00 -0.00 0.00 0.00 57.85 57.70 2da0 n ARG 48 Cb 0.23 -0.15 -0.11 0.00 0.00 0.00 0.00 32.46 32.44 2da0 n ARG 48 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.63 176.98 2da0 s GLN 49 N -1.17 0.34 0.45 -0.14 -0.21 -1.26 -5.17 119.66 112.49 2da0 s GLN 49 Ca -0.01 -0.47 -0.08 0.00 0.02 0.00 0.00 55.36 54.83 2da0 s GLN 49 Cb 0.00 0.13 0.11 0.00 1.00 0.00 0.00 33.01 34.25 2da0 s GLN 49 CO 0.01 -0.07 0.40 -0.35 -2.12 0.00 0.00 175.29 173.16 2da0 n PRO 50 N 1.72 -1.80 -3.07 2.91 -0.04 -1.26 -4.99 135.00 128.47 2da0 n PRO 50 Ca -0.22 -0.64 -0.40 0.00 -0.04 0.00 0.00 63.50 62.20 2da0 n PRO 50 Cb 0.56 -0.60 -0.05 0.00 -0.04 0.00 0.00 33.50 33.37 2da0 n PRO 50 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2da0 s ALA 51 N -2.99 3.50 -0.30 0.55 0.00 -1.13 -4.93 121.76 116.46 2da0 s ALA 51 Ca 0.26 -0.13 -0.07 0.00 0.00 0.00 0.00 51.96 52.01 2da0 s ALA 51 Cb -0.03 -3.01 0.01 0.00 0.00 0.00 0.00 23.12 20.10 2da0 s ALA 51 CO 0.20 -0.47 0.10 0.15 0.00 0.00 0.00 175.76 175.73 2da0 s LYS 52 N 1.71 3.11 -0.35 0.00 -0.14 -1.26 -1.24 119.74 121.57 2da0 s LYS 52 Ca 0.32 -0.85 -0.06 0.00 -1.36 0.00 0.00 55.97 54.02 2da0 s LYS 52 Cb -0.16 -3.41 0.05 0.00 -1.68 0.00 0.00 37.83 32.62 2da0 s LYS 52 CO 0.12 -0.45 0.12 -0.51 -0.76 0.00 0.00 175.35 173.87 2da0 s LEU 53 N 1.52 4.45 -0.00 3.17 1.43 -0.41 -4.96 118.68 123.88 2da0 s LEU 53 Ca 0.03 -1.23 -0.30 0.00 -1.03 0.00 0.00 54.13 51.59 2da0 s LEU 53 Cb -0.17 -1.88 -0.05 0.00 0.03 0.00 0.00 46.19 44.12 2da0 s LEU 53 CO 0.03 -0.36 1.36 0.21 0.23 0.00 0.00 176.35 177.82 2da0 s ASN 54 N 1.51 6.89 0.17 2.29 2.47 -1.26 -0.89 114.94 126.12 2da0 s ASN 54 Ca -0.01 2.06 0.01 0.00 0.42 0.00 0.00 52.86 55.35 2da0 s ASN 54 Cb -0.20 -2.56 0.03 0.00 -1.45 0.00 0.00 41.25 37.07 2da0 s ASN 54 CO 0.02 -0.68 1.41 -0.07 -3.72 0.00 0.00 177.10 174.06 2da0 h LEU 55 N 8.19 0.33 -0.91 3.21 4.07 -1.81 0.05 115.31 128.43 2da0 h LEU 55 Ca -0.37 -0.24 0.00 0.00 0.08 0.00 0.00 57.88 57.34 2da0 h LEU 55 Cb 1.18 -0.10 0.00 0.00 1.08 0.00 0.00 40.66 42.82 2da0 h LEU 55 CO 0.89 1.01 0.16 0.18 -1.08 0.00 0.00 178.44 179.61 2da0 n LEU 56 N -3.73 0.36 0.00 1.67 4.77 -1.26 -2.30 117.00 116.50 2da0 n LEU 56 Ca -0.04 0.60 0.00 0.00 -0.03 0.00 0.00 56.01 56.54 2da0 n LEU 56 Cb 0.76 -0.60 0.00 0.00 -2.33 0.00 0.00 43.42 41.26 2da0 n LEU 56 CO 0.48 -0.72 -0.46 0.35 -1.33 0.00 0.00 177.39 175.71 2da0 n THR 57 N -2.00 0.00 -2.00 -5.08 -2.24 -1.15 -5.04 114.28 96.75 2da0 n THR 57 Ca -0.01 0.00 -0.41 0.00 -2.27 0.00 0.00 64.05 61.36 2da0 n THR 57 Cb 0.18 -0.59 -0.02 0.00 -2.10 0.00 0.00 70.33 67.81 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 -1.33 3.42 -0.72 0.00 0.74 0.05 -4.81 119.66 117.01 2da0 s GLN 59 Ca 0.54 -0.64 -0.22 0.00 0.05 0.00 0.00 55.36 55.08 2da0 s GLN 59 Cb -0.42 -3.38 0.07 0.00 1.10 0.00 0.00 33.01 30.39 2da0 s GLN 59 CO 0.52 -0.31 1.03 0.08 -0.55 0.00 0.00 175.29 176.06 2da0 s VAL 60 N 1.58 4.32 -0.67 1.34 1.01 -1.26 -1.16 120.40 125.55 2da0 s VAL 60 Ca 0.05 -0.49 -0.11 0.00 0.00 0.00 0.00 61.98 61.43 2da0 s VAL 60 Cb -0.16 -4.73 0.17 0.00 0.00 0.00 0.00 36.38 31.66 2da0 s VAL 60 CO 0.04 -1.52 0.57 -0.54 0.00 0.00 0.00 175.10 173.65 2da0 s LYS 61 N 4.04 3.06 0.27 2.72 1.02 0.37 -4.95 119.74 126.27 2da0 s LYS 61 Ca 0.26 -2.23 -0.29 0.00 0.02 0.00 0.00 55.97 53.72 2da0 s LYS 61 Cb -0.14 -4.15 -0.10 0.00 -0.52 0.00 0.00 37.83 32.92 2da0 s LYS 61 CO 0.07 -1.25 1.25 -1.25 -0.92 0.00 0.00 175.35 173.25 2da0 s PRO 62 N 0.56 4.44 1.14 -1.68 0.04 -1.26 -0.47 135.00 137.76 2da0 s PRO 62 Ca 0.13 2.05 -0.17 0.00 0.04 0.00 0.00 61.00 63.05 2da0 s PRO 62 Cb -0.18 -3.15 0.21 0.00 0.04 0.00 0.00 34.50 31.42 2da0 s PRO 62 CO -0.04 -0.11 0.42 0.27 0.04 0.00 0.00 177.00 177.57 2da0 n ASN 63 N 1.58 -3.09 0.00 6.66 0.23 0.87 -4.90 115.26 116.62 2da0 n ASN 63 Ca 0.02 -0.44 0.00 0.00 -0.53 0.00 0.00 54.58 53.63 2da0 n ASN 63 Cb 0.43 -0.88 0.00 0.00 -2.08 0.00 0.00 39.78 37.25 2da0 n ASN 63 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2da0 n ALA 64 N -4.76 1.86 -0.06 -2.53 0.00 -1.26 -4.89 120.51 108.87 2da0 n ALA 64 Ca 0.06 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.48 2da0 n ALA 64 Cb 0.47 0.27 -0.01 0.00 0.00 0.00 0.00 19.45 20.18 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 0.00 0.00 0.00 5.08 -1.97 -3.47 114.58 114.21 2da0 h GLU 65 Ca 0.00 0.00 -0.19 0.00 -1.00 0.00 0.00 59.36 58.17 2da0 h GLU 65 Cb 0.73 0.00 0.11 0.00 0.50 0.00 0.00 28.75 30.09 2da0 h GLU 65 CO 0.00 0.03 -0.09 -3.47 -1.00 0.00 0.00 179.01 174.48 2da0 n ASP 66 N -4.72 -3.02 -0.02 1.42 2.03 -1.26 -5.00 116.55 105.97 2da0 n ASP 66 Ca -0.03 -0.46 -0.03 0.00 0.52 0.00 0.00 54.79 54.79 2da0 n ASP 66 Cb 0.10 -0.59 -0.03 0.00 -0.72 0.00 0.00 41.12 39.89 2da0 n ASP 66 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 2da0 n LYS 67 N -3.25 2.16 -3.26 -0.67 4.76 -1.26 -4.84 118.16 111.80 2da0 n LYS 67 Ca 0.07 0.01 -0.25 0.00 -2.87 0.00 0.00 58.31 55.27 2da0 n LYS 67 Cb 0.32 -1.11 -0.07 0.00 -1.84 0.00 0.00 35.03 32.33 2da0 n LYS 67 CO 0.00 0.00 0.00 0.36 -1.37 0.00 0.00 177.40 176.39 2da0 n LYS 68 N -2.34 1.60 -3.75 1.97 2.85 -1.26 -4.79 118.16 112.44 2da0 n LYS 68 Ca -0.08 -3.90 -0.12 0.00 -1.05 0.00 0.00 58.31 53.15 2da0 n LYS 68 Cb 0.63 -1.72 -0.12 0.00 -0.65 0.00 0.00 35.03 33.16 2da0 n LYS 68 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 177.40 176.23 2da0 s SER 69 N -1.94 -0.27 -0.06 -5.58 0.01 -1.26 -2.67 113.70 101.93 2da0 s SER 69 Ca 0.38 0.53 -0.09 0.00 1.31 0.00 0.00 55.95 58.08 2da0 s SER 69 Cb 0.18 0.45 0.02 0.00 0.21 0.00 0.00 66.02 66.88 2da0 s SER 69 CO -0.07 -0.14 0.22 0.72 0.41 0.00 0.00 173.24 174.38 2da0 s PHE 70 N 0.89 -0.19 -0.13 2.43 -0.71 -1.13 -0.09 117.98 119.05 2da0 s PHE 70 Ca -0.06 0.44 -0.04 0.00 -1.04 0.00 0.00 56.93 56.23 2da0 s PHE 70 Cb -0.07 0.06 -0.03 0.00 -1.21 0.00 0.00 43.02 41.76 2da0 s PHE 70 CO -0.06 -0.18 0.00 -0.51 -1.34 0.00 0.00 175.22 173.13 2da0 s ASP 71 N -0.31 5.17 -0.42 1.98 1.11 0.38 -2.34 116.67 122.24 2da0 s ASP 71 Ca -0.04 0.04 -0.08 0.00 0.18 0.00 0.00 52.55 52.64 2da0 s ASP 71 Cb -0.03 -1.69 0.09 0.00 1.07 0.00 0.00 42.92 42.36 2da0 s ASP 71 CO 0.01 0.26 0.26 -0.22 1.18 0.00 0.00 175.17 176.66 2da0 s LEU 72 N -0.19 5.21 -0.35 1.23 2.96 -0.39 -0.47 118.68 126.67 2da0 s LEU 72 Ca 0.05 -1.62 -0.25 0.00 -0.22 0.00 0.00 54.13 52.09 2da0 s LEU 72 Cb -0.13 -1.96 0.01 0.00 0.50 0.00 0.00 46.19 44.61 2da0 s LEU 72 CO 0.02 -0.55 0.89 -0.63 -1.32 0.00 0.00 176.35 174.76 2da0 s ILE 73 N 1.38 4.63 0.19 6.68 1.01 -0.31 0.30 121.20 135.08 2da0 s ILE 73 Ca 0.04 1.19 0.01 0.00 0.00 0.00 0.00 60.65 61.88 2da0 s ILE 73 Cb -0.23 -4.29 -0.04 0.00 0.01 0.00 0.00 42.46 37.91 2da0 s ILE 73 CO 0.01 -0.47 0.36 -0.55 0.00 0.00 0.00 174.94 174.29 2da0 s SER 74 N 1.81 6.36 -0.70 3.58 0.15 0.20 -0.77 113.70 124.32 2da0 s SER 74 Ca 0.37 0.29 -0.36 0.00 0.70 0.00 0.00 55.95 56.95 2da0 s SER 74 Cb -0.12 -1.96 -0.19 0.00 -1.71 0.00 0.00 66.02 62.03 2da0 s SER 74 CO 0.17 -0.03 2.29 0.00 1.20 0.00 0.00 173.24 176.87 2da0 n HIS 75 N -0.75 0.82 -3.49 3.44 1.44 -1.26 0.16 115.22 115.58 2da0 n HIS 75 Ca -0.06 0.55 -0.20 0.00 -2.01 0.00 0.00 57.72 56.00 2da0 n HIS 75 Cb 0.54 -2.21 0.08 0.00 0.12 0.00 0.00 29.99 28.52 2da0 n HIS 75 CO 0.00 0.00 0.00 0.09 -2.81 0.00 0.00 176.34 173.62 2da0 n ASN 76 N 8.50 -4.04 -3.57 4.39 4.13 -1.26 -4.98 115.26 118.41 2da0 n ASN 76 Ca 0.57 -0.57 -0.06 0.00 1.68 0.00 0.00 54.58 56.20 2da0 n ASN 76 Cb -0.01 -5.01 -0.02 0.00 -1.54 0.00 0.00 39.78 33.20 2da0 n ASN 76 CO 0.00 0.00 0.00 -0.60 0.28 0.00 0.00 177.26 176.94 2da0 s ARG 77 N -5.79 0.44 -0.05 3.52 3.52 0.43 -5.17 118.95 115.86 2da0 s ARG 77 Ca 0.27 -0.15 0.02 0.00 -0.13 0.00 0.00 55.73 55.75 2da0 s ARG 77 Cb -0.12 0.20 0.01 0.00 -1.56 0.00 0.00 34.95 33.49 2da0 s ARG 77 CO 0.72 -0.19 -0.09 0.99 -0.81 0.00 0.00 175.30 175.92 2da0 s THR 78 N -2.50 0.86 0.19 4.11 2.01 -1.26 0.60 115.64 119.65 2da0 s THR 78 Ca 0.08 -0.34 0.10 0.00 0.31 0.00 0.00 61.69 61.84 2da0 s THR 78 Cb -0.01 -0.80 -0.04 0.00 0.01 0.00 0.00 72.50 71.65 2da0 s THR 78 CO -0.06 0.29 -0.17 -0.31 -0.69 0.00 0.00 174.62 173.68 2da0 s TYR 79 N 0.60 2.46 -0.11 4.92 1.51 0.15 -4.91 117.35 121.97 2da0 s TYR 79 Ca -0.11 -0.29 0.03 0.00 -1.01 0.00 0.00 57.07 55.69 2da0 s TYR 79 Cb -0.13 -1.20 -0.01 0.00 -0.11 0.00 0.00 41.96 40.51 2da0 s TYR 79 CO 0.02 0.52 -0.20 -1.01 -1.11 0.00 0.00 175.55 173.76 2da0 s HIS 80 N -1.73 2.65 0.07 2.71 3.76 -1.26 -1.26 115.29 120.22 2da0 s HIS 80 Ca 0.23 -0.88 0.02 0.00 -0.15 0.00 0.00 55.06 54.28 2da0 s HIS 80 Cb -0.08 -1.75 -0.03 0.00 1.11 0.00 0.00 32.58 31.82 2da0 s HIS 80 CO 0.13 -0.33 -0.06 -0.06 -0.85 0.00 0.00 174.74 173.56 2da0 s PHE 81 N 0.31 0.75 0.03 1.40 0.08 -0.99 -3.10 117.98 116.45 2da0 s PHE 81 Ca -0.15 -0.78 -0.07 0.00 0.12 0.00 0.00 56.93 56.05 2da0 s PHE 81 Cb -0.17 -0.45 -0.00 0.00 -0.57 0.00 0.00 43.02 41.83 2da0 s PHE 81 CO 0.08 -0.16 0.14 -1.14 -0.10 0.00 0.00 175.22 174.04 2da0 s GLN 82 N -3.00 0.59 0.03 0.44 0.74 -1.15 -2.83 119.66 114.47 2da0 s GLN 82 Ca 0.03 -0.62 0.03 0.00 0.05 0.00 0.00 55.36 54.85 2da0 s GLN 82 Cb -0.00 0.24 -0.04 0.00 1.10 0.00 0.00 33.01 34.31 2da0 s GLN 82 CO -0.03 -0.15 -0.01 0.00 -0.55 0.00 0.00 175.29 174.55 2da0 s ALA 83 N -2.24 3.25 0.04 1.58 0.00 -1.09 -1.64 121.76 121.67 2da0 s ALA 83 Ca -0.08 -1.01 -0.33 0.00 0.00 0.00 0.00 51.96 50.54 2da0 s ALA 83 Cb -0.03 -1.27 -0.19 0.00 0.00 0.00 0.00 23.12 21.63 2da0 s ALA 83 CO -0.03 0.66 1.42 0.93 0.00 0.00 0.00 175.76 178.74 2da0 h GLU 84 N 4.10 -1.09 -6.69 0.00 3.07 -1.89 -3.45 114.58 108.63 2da0 h GLU 84 Ca -0.48 0.07 -0.69 0.00 -0.50 0.00 0.00 59.36 57.76 2da0 h GLU 84 Cb 1.17 0.25 -0.23 0.00 -0.84 0.00 0.00 28.75 29.10 2da0 h GLU 84 CO 0.58 -0.72 -0.84 -0.51 -1.40 0.00 0.00 179.01 176.12 2da0 s ASP 85 N -4.24 3.54 0.48 1.42 1.01 -1.26 -5.01 116.67 112.61 2da0 s ASP 85 Ca -0.18 -0.53 0.30 0.00 0.71 0.00 0.00 52.55 52.85 2da0 s ASP 85 Cb 0.02 -0.45 1.38 0.00 1.01 0.00 0.00 42.92 44.88 2da0 s ASP 85 CO 0.54 0.24 1.76 -0.33 0.21 0.00 0.00 175.17 177.59 2da0 h GLU 86 N 4.45 0.15 -0.16 8.23 3.07 -1.89 0.20 114.58 128.63 2da0 h GLU 86 Ca -0.48 -0.01 -0.00 0.00 -0.50 0.00 0.00 59.36 58.37 2da0 h GLU 86 Cb 1.15 -0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 29.02 2da0 h GLU 86 CO 0.45 0.10 0.08 -0.56 -1.40 0.00 0.00 179.01 177.68 2da0 h GLN 87 N 0.16 0.23 -0.43 2.33 3.07 -1.95 -0.62 115.11 117.90 2da0 h GLN 87 Ca 0.63 -0.03 -0.03 0.00 0.09 0.00 0.00 58.65 59.31 2da0 h GLN 87 Cb 2.10 -0.04 -0.02 0.00 0.08 0.00 0.00 27.48 29.59 2da0 h GLN 87 CO -0.17 0.26 0.15 0.22 0.09 0.00 0.00 178.83 179.37 2da0 h ASP 88 N 0.15 0.57 0.46 0.06 3.58 -1.03 -2.86 116.42 117.35 2da0 h ASP 88 Ca 0.06 -0.07 -0.02 0.00 0.42 0.00 0.00 57.03 57.41 2da0 h ASP 88 Cb 0.10 -0.15 0.00 0.00 1.72 0.00 0.00 39.33 41.00 2da0 h ASP 88 CO -0.01 0.54 -0.22 0.22 -2.88 0.00 0.00 179.24 176.89 2da0 h TYR 89 N 0.62 -0.57 -1.27 0.28 3.20 -1.06 -1.33 116.97 116.84 2da0 h TYR 89 Ca 0.15 -0.01 0.44 0.00 3.14 0.00 0.00 58.73 62.44 2da0 h TYR 89 Cb 0.17 0.19 -0.14 0.00 1.54 0.00 0.00 36.73 38.49 2da0 h TYR 89 CO 0.01 -0.36 0.80 0.28 -1.64 0.00 0.00 178.16 177.25 2da0 h VAL 90 N -0.92 0.09 0.17 1.81 2.07 -1.11 -1.08 116.25 117.28 2da0 h VAL 90 Ca -0.06 -0.02 -0.01 0.00 0.82 0.00 0.00 66.70 67.43 2da0 h VAL 90 Cb 0.47 0.01 0.00 0.00 -1.52 0.00 0.00 31.29 30.26 2da0 h VAL 90 CO 0.10 0.01 -0.08 0.00 0.02 0.00 0.00 177.57 177.62 2da0 h ALA 91 N 1.68 -0.34 -0.80 1.67 0.00 -1.47 -3.21 119.26 116.79 2da0 h ALA 91 Ca 0.84 -0.05 0.07 0.00 0.00 0.00 0.00 54.91 55.77 2da0 h ALA 91 Cb 2.54 0.09 -0.10 0.00 0.00 0.00 0.00 17.79 20.32 2da0 h ALA 91 CO -0.50 -0.32 -0.47 0.91 0.00 0.00 0.00 179.25 178.87 2da0 n TRP 92 N -3.82 -0.35 -0.26 0.00 7.02 -0.48 0.74 117.44 120.28 2da0 n TRP 92 Ca -0.03 1.00 0.03 0.00 -1.02 0.00 0.00 57.50 57.48 2da0 n TRP 92 Cb 0.09 -0.56 0.12 0.00 -2.42 0.00 0.00 31.31 28.54 2da0 n TRP 92 CO 0.00 0.00 0.00 0.82 -2.02 0.00 0.00 177.69 176.49 2da0 h ILE 93 N 0.00 0.28 -0.70 -0.99 1.08 -1.50 0.29 117.51 115.97 2da0 h ILE 93 Ca 0.13 -0.01 0.07 0.00 -0.39 0.00 0.00 64.86 64.66 2da0 h ILE 93 Cb 0.33 0.24 -0.06 0.00 -3.07 0.00 0.00 36.82 34.25 2da0 h ILE 93 CO -0.75 0.01 0.38 -1.28 -0.69 0.00 0.00 178.15 175.82 2da0 h SER 94 N 0.04 0.54 0.00 1.72 0.87 0.32 -1.78 113.55 115.27 2da0 h SER 94 Ca 0.39 0.04 0.00 0.00 -1.23 0.00 0.00 61.79 60.99 2da0 h SER 94 Cb 0.64 -0.06 0.00 0.00 -0.44 0.00 0.00 62.40 62.54 2da0 h SER 94 CO -0.73 0.34 0.00 0.52 -0.53 0.00 0.00 176.83 176.43 2da0 n VAL 95 N -4.80 0.00 -0.24 2.23 0.31 0.70 -0.67 118.33 115.86 2da0 n VAL 95 Ca 0.10 0.93 0.06 0.00 -0.01 0.00 0.00 64.34 65.41 2da0 n VAL 95 Cb 0.21 -1.87 0.12 0.00 -0.91 0.00 0.00 33.84 31.39 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 -1.85 -0.19 -0.06 7.52 4.77 0.55 0.22 117.00 127.95 2da0 n LEU 96 Ca 0.00 1.15 -0.15 0.00 -0.03 0.00 0.00 56.01 56.98 2da0 n LEU 96 Cb 0.00 -0.37 -0.06 0.00 -2.33 0.00 0.00 43.42 40.67 2da0 n LEU 96 CO 0.00 -1.13 0.41 0.74 -1.33 0.00 0.00 177.39 176.08 2da0 h THR 97 N 0.00 1.29 0.13 -5.08 2.02 -1.41 -3.23 112.91 106.63 2da0 h THR 97 Ca 0.35 -1.75 -0.01 0.00 0.77 0.00 0.00 66.41 65.77 2da0 h THR 97 Cb 0.59 1.78 -0.00 0.00 -1.74 0.00 0.00 68.15 68.78 2da0 h THR 97 CO -0.68 0.56 -0.08 0.78 0.37 0.00 0.00 175.52 176.47 2da0 h ASN 98 N 0.53 -0.21 -1.05 4.18 2.35 0.49 -1.59 115.58 120.28 2da0 h ASN 98 Ca -0.00 0.01 0.39 0.00 -0.55 0.00 0.00 56.30 56.15 2da0 h ASN 98 Cb 1.16 0.06 -0.13 0.00 0.05 0.00 0.00 38.32 39.46 2da0 h ASN 98 CO 0.12 -0.13 0.64 -0.24 -1.65 0.00 0.00 177.43 176.17 2da0 n SER 99 N -2.69 0.23 0.11 5.81 2.88 0.10 0.95 113.62 121.02 2da0 n SER 99 Ca -0.02 1.28 -0.13 0.00 -1.33 0.00 0.00 58.87 58.67 2da0 n SER 99 Cb 0.08 -0.63 -0.08 0.00 -0.75 0.00 0.00 64.21 62.83 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 -0.29 0.80 -1.46 3.64 -1.49 -2.48 116.57 115.30 2da0 h LYS 100 Ca 0.74 0.02 -0.04 0.00 -1.27 0.00 0.00 60.65 60.10 2da0 h LYS 100 Cb 2.22 0.07 0.01 0.00 -0.41 0.00 0.00 32.23 34.12 2da0 h LYS 100 CO -0.51 0.05 -0.39 0.93 -2.27 0.00 0.00 179.45 177.27 2da0 h GLU 101 N -0.70 -1.04 -0.06 1.90 5.08 0.16 -1.03 114.58 118.88 2da0 h GLU 101 Ca -0.03 0.07 0.02 0.00 -1.00 0.00 0.00 59.36 58.42 2da0 h GLU 101 Cb 0.48 0.24 -0.00 0.00 0.50 0.00 0.00 28.75 29.97 2da0 h GLU 101 CO 0.05 -0.68 0.48 0.93 -1.00 0.00 0.00 179.01 178.79 2da0 h GLU 102 N -1.17 0.00 0.00 2.33 4.39 -0.84 0.85 114.58 120.14 2da0 h GLU 102 Ca -0.11 0.00 -0.24 0.00 0.34 0.00 0.00 59.36 59.35 2da0 h GLU 102 Cb 0.84 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 29.45 2da0 h GLU 102 CO 0.18 0.00 -1.52 0.00 -1.16 0.00 0.00 179.01 176.51 2da0 h ALA 103 N 1.11 0.70 0.00 3.43 0.00 -0.92 -3.27 119.26 120.31 2da0 h ALA 103 Ca 0.03 -1.19 -0.12 0.00 0.00 0.00 0.00 54.91 53.63 2da0 h ALA 103 Cb 0.98 0.36 -0.02 0.00 0.00 0.00 0.00 17.79 19.11 2da0 h ALA 103 CO -0.00 1.31 -0.67 -0.07 0.00 0.00 0.00 179.25 179.82 2da0 h LEU 104 N 0.00 0.00 -1.70 0.00 3.38 0.18 -3.28 115.31 113.89 2da0 h LEU 104 Ca -0.22 -0.74 0.10 0.00 0.09 0.00 0.00 57.88 57.12 2da0 h LEU 104 Cb 1.83 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 42.55 2da0 h LEU 104 CO 0.07 1.26 0.38 0.00 0.09 0.00 0.00 178.44 180.24 2da0 h THR 105 N -1.00 0.88 0.00 0.22 1.03 -0.76 0.42 112.91 113.70 2da0 h THR 105 Ca -0.18 -0.12 0.00 0.00 -0.01 0.00 0.00 66.41 66.10 2da0 h THR 105 Cb 1.16 0.51 0.00 0.00 -1.07 0.00 0.00 68.15 68.75 2da0 h THR 105 CO -0.11 0.06 0.00 1.15 -0.01 0.00 0.00 175.52 176.61 2da0 n MET 106 N -4.46 0.42 -0.13 0.00 0.00 -1.23 -3.60 117.12 108.12 2da0 n MET 106 Ca 0.09 0.01 -0.23 0.00 0.00 0.00 0.00 57.70 57.58 2da0 n MET 106 Cb 0.38 -1.50 -0.11 0.00 0.00 0.00 0.00 33.22 31.99 2da0 n MET 106 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2da0 n ALA 107 N -1.28 1.31 -3.19 3.17 0.00 0.14 -4.75 120.51 115.91 2da0 n ALA 107 Ca 0.14 -1.07 -0.45 0.00 0.00 0.00 0.00 53.44 52.06 2da0 n ALA 107 Cb 0.23 -0.05 -0.01 0.00 0.00 0.00 0.00 19.45 19.61 2da0 n ALA 107 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 2da0 s PHE 108 N -2.51 3.71 -0.02 0.00 0.08 -0.54 -4.99 117.98 113.71 2da0 s PHE 108 Ca -0.36 -2.05 0.02 0.00 0.12 0.00 0.00 56.93 54.66 2da0 s PHE 108 Cb 0.11 -4.00 0.00 0.00 -0.57 0.00 0.00 43.02 38.57 2da0 s PHE 108 CO 0.57 -1.15 -0.07 0.45 -0.10 0.00 0.00 175.22 174.92 2da0 s SER 109 N 2.38 0.93 0.00 1.36 0.15 -1.26 -4.87 113.70 112.39 2da0 s SER 109 Ca 0.28 -0.14 0.00 0.00 0.70 0.00 0.00 55.95 56.79 2da0 s SER 109 Cb -0.08 -0.23 0.00 0.00 -1.71 0.00 0.00 66.02 64.00 2da0 s SER 109 CO -0.08 0.05 0.00 0.61 1.20 0.00 0.00 173.24 175.02 2da0 n GLY 110 N 3.28 -1.72 3.77 9.45 0.00 -1.26 -4.76 105.19 113.95 2da0 n GLY 110 Ca -0.17 -1.54 -0.33 0.00 0.00 0.00 0.00 46.02 43.98 2da0 n GLY 110 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2da0 s PRO 111 N -2.36 2.71 -1.47 1.61 0.04 -1.26 -3.62 135.00 130.65 2da0 s PRO 111 Ca 0.00 1.35 -0.07 0.00 0.04 0.00 0.00 61.00 62.33 2da0 s PRO 111 Cb 0.00 -1.94 0.01 0.00 0.04 0.00 0.00 34.50 32.61 2da0 s PRO 111 CO 0.00 -1.31 0.90 0.45 0.04 0.00 0.00 177.00 177.08 2da0 n SER 112 N -2.60 -6.30 -0.04 6.66 2.88 -1.26 -4.92 113.62 108.05 2da0 n SER 112 Ca 0.10 -0.41 -0.15 0.00 -1.33 0.00 0.00 58.87 57.07 2da0 n SER 112 Cb 0.52 -5.02 -0.13 0.00 -0.75 0.00 0.00 64.21 58.83 2da0 n SER 112 CO 0.00 0.00 0.00 -1.28 -1.23 0.00 0.00 175.04 172.53 2da0 h SER 113 N -2.06 0.12 0.00 -3.46 0.87 -1.86 -3.52 113.55 103.64 2da0 h SER 113 Ca -0.55 -0.95 0.00 0.00 -1.23 0.00 0.00 61.79 59.06 2da0 h SER 113 Cb 1.37 -0.04 0.00 0.00 -0.44 0.00 0.00 62.40 63.29 2da0 h SER 113 CO 0.57 1.05 0.00 0.61 -0.53 0.00 0.00 176.83 178.53