#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2da0 n SER 2 N 0.00 -3.55 -1.73 1.61 7.64 -1.26 -4.77 113.62 111.56 2da0 n SER 2 Ca 0.00 0.35 -0.07 0.00 1.01 0.00 0.00 58.87 60.16 2da0 n SER 2 Cb 0.00 -1.01 -0.03 0.00 -1.01 0.00 0.00 64.21 62.16 2da0 n SER 2 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2da0 n SER 3 N 1.00 5.57 -3.52 6.43 3.41 -1.26 -4.81 113.62 120.44 2da0 n SER 3 Ca 0.04 -2.58 -0.26 0.00 -0.26 0.00 0.00 58.87 55.82 2da0 n SER 3 Cb 0.53 -1.19 0.02 0.00 -0.26 0.00 0.00 64.21 63.31 2da0 n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2da0 n GLY 4 N 1.49 -0.76 3.26 5.00 0.00 -1.26 -4.99 105.19 107.93 2da0 n GLY 4 Ca 0.17 0.86 -0.23 0.00 0.00 0.00 0.00 46.02 46.82 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 -2.40 2.37 -0.09 1.61 1.04 -1.26 -5.06 113.70 109.92 2da0 s SER 5 Ca 0.17 -0.66 -0.25 0.00 0.48 0.00 0.00 55.95 55.69 2da0 s SER 5 Cb -0.02 -0.13 -0.27 0.00 0.10 0.00 0.00 66.02 65.70 2da0 s SER 5 CO 0.86 0.04 0.88 0.28 0.98 0.00 0.00 173.24 176.28 2da0 h SER 6 N 4.19 0.23 0.00 7.02 0.02 -2.04 -3.49 113.55 119.48 2da0 h SER 6 Ca -0.45 -0.93 0.00 0.00 -0.84 0.00 0.00 61.79 59.57 2da0 h SER 6 Cb 1.18 -0.07 0.00 0.00 0.14 0.00 0.00 62.40 63.65 2da0 h SER 6 CO 0.40 1.14 0.00 0.61 -1.14 0.00 0.00 176.83 177.84 2da0 n GLY 7 N 1.50 0.19 0.27 -3.77 0.00 -1.26 -5.03 105.19 97.09 2da0 n GLY 7 Ca -0.11 -0.51 0.05 0.00 0.00 0.00 0.00 46.02 45.45 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 -0.06 0.00 1.61 -1.99 -1.94 -3.47 116.97 111.12 2da0 h TYR 8 Ca 0.00 0.06 0.00 0.00 2.00 0.00 0.00 58.73 60.79 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 -0.24 0.00 0.41 -0.00 0.00 0.00 178.16 178.33 2da0 n GLY 9 N -1.42 4.52 0.13 3.88 0.00 -1.26 -4.99 105.19 106.06 2da0 n GLY 9 Ca 0.13 -1.38 -0.20 0.00 0.00 0.00 0.00 46.02 44.57 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 0.51 -3.16 1.61 4.64 -1.90 -3.34 113.55 111.91 2da0 h SER 10 Ca 0.00 -0.78 -0.68 0.00 -0.47 0.00 0.00 61.79 59.86 2da0 h SER 10 Cb 0.00 -0.16 -0.13 0.00 -0.31 0.00 0.00 62.40 61.79 2da0 h SER 10 CO 0.00 1.66 -0.59 -1.61 -0.87 0.00 0.00 176.83 175.42 2da0 s GLU 11 N -2.59 3.10 -0.23 4.77 8.01 -1.26 -3.93 118.70 126.57 2da0 s GLU 11 Ca -0.14 -0.34 -0.24 0.00 0.01 0.00 0.00 54.97 54.26 2da0 s GLU 11 Cb 0.06 -2.89 0.07 0.00 -4.31 0.00 0.00 34.13 27.06 2da0 s GLU 11 CO 0.84 0.71 0.67 0.21 0.01 0.00 0.00 175.26 177.71 2da0 s LYS 12 N -0.90 0.81 0.04 1.61 2.20 -1.09 -5.05 119.74 117.36 2da0 s LYS 12 Ca 0.13 0.86 0.07 0.00 -0.36 0.00 0.00 55.97 56.68 2da0 s LYS 12 Cb -0.11 0.39 -0.02 0.00 -1.51 0.00 0.00 37.83 36.57 2da0 s LYS 12 CO 0.03 -0.11 -0.20 0.15 -0.36 0.00 0.00 175.35 174.85 2da0 s LYS 13 N 0.20 1.34 0.00 4.03 1.02 -1.26 -1.58 119.74 123.49 2da0 s LYS 13 Ca -0.01 -0.92 0.00 0.00 0.02 0.00 0.00 55.97 55.06 2da0 s LYS 13 Cb -0.04 -1.44 0.00 0.00 -0.52 0.00 0.00 37.83 35.83 2da0 s LYS 13 CO 0.02 0.37 0.00 0.41 -0.92 0.00 0.00 175.35 175.22 2da0 n GLY 14 N 1.87 -0.74 3.13 -3.33 0.00 -1.10 -5.04 105.19 99.99 2da0 n GLY 14 Ca -0.17 0.16 -0.08 0.00 0.00 0.00 0.00 46.02 45.93 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 -1.65 0.35 0.17 1.61 1.51 -1.26 -2.30 117.35 115.78 2da0 s TYR 15 Ca 0.00 -0.82 -0.14 0.00 -1.01 0.00 0.00 57.07 55.09 2da0 s TYR 15 Cb 0.00 -0.24 0.02 0.00 -0.11 0.00 0.00 41.96 41.63 2da0 s TYR 15 CO 0.00 -0.44 0.41 -0.51 -1.11 0.00 0.00 175.55 173.91 2da0 s LEU 16 N -2.81 0.46 0.06 -1.29 1.43 0.43 -4.81 118.68 112.15 2da0 s LEU 16 Ca 0.05 -0.57 -0.05 0.00 -1.03 0.00 0.00 54.13 52.53 2da0 s LEU 16 Cb 0.06 1.76 -0.05 0.00 0.03 0.00 0.00 46.19 47.99 2da0 s LEU 16 CO -0.10 -0.95 0.30 -0.76 0.23 0.00 0.00 176.35 175.07 2da0 s LEU 17 N -2.89 4.34 0.13 1.79 1.43 -0.69 -0.25 118.68 122.54 2da0 s LEU 17 Ca 0.10 0.54 0.07 0.00 -1.03 0.00 0.00 54.13 53.81 2da0 s LEU 17 Cb 0.01 -2.90 -0.04 0.00 0.03 0.00 0.00 46.19 43.29 2da0 s LEU 17 CO -0.04 0.18 -0.16 -0.75 0.23 0.00 0.00 176.35 175.81 2da0 s LYS 18 N -2.11 1.11 0.18 1.70 2.20 0.04 -2.27 119.74 120.60 2da0 s LYS 18 Ca 0.33 -1.29 -0.28 0.00 -0.36 0.00 0.00 55.97 54.37 2da0 s LYS 18 Cb -0.13 -1.09 -0.08 0.00 -1.51 0.00 0.00 37.83 35.02 2da0 s LYS 18 CO 0.20 0.22 0.88 0.21 -0.36 0.00 0.00 175.35 176.50 2da0 s LYS 19 N -2.63 4.72 -0.94 4.03 2.47 -1.21 -0.24 119.74 125.95 2da0 s LYS 19 Ca 0.11 1.36 -0.19 0.00 -1.56 0.00 0.00 55.97 55.69 2da0 s LYS 19 Cb -0.06 -3.30 0.13 0.00 -1.46 0.00 0.00 37.83 33.15 2da0 s LYS 19 CO 0.04 0.47 1.14 0.45 0.16 0.00 0.00 175.35 177.61 2da0 s SER 20 N -0.89 6.63 0.47 1.43 0.15 -0.53 -4.92 113.70 116.04 2da0 s SER 20 Ca 0.40 -2.05 -0.22 0.00 0.70 0.00 0.00 55.95 54.78 2da0 s SER 20 Cb -0.24 -2.40 -0.10 0.00 -1.71 0.00 0.00 66.02 61.56 2da0 s SER 20 CO 0.29 -1.07 0.78 -0.67 1.20 0.00 0.00 173.24 173.77 2da0 n ASP 21 N 6.57 0.14 0.00 5.45 -0.08 -1.26 -4.26 116.55 123.11 2da0 n ASP 21 Ca 0.24 0.92 0.00 0.00 -1.51 0.00 0.00 54.79 54.44 2da0 n ASP 21 Cb 0.49 -1.25 0.00 0.00 2.34 0.00 0.00 41.12 42.70 2da0 n ASP 21 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2da0 n GLY 22 N 1.49 0.53 0.48 0.27 0.00 -1.26 -4.87 105.19 101.83 2da0 n GLY 22 Ca 0.11 -1.88 -0.19 0.00 0.00 0.00 0.00 46.02 44.07 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 0.00 -2.60 -0.61 2.04 -2.07 -3.44 117.51 110.83 2da0 h ILE 23 Ca 0.00 -0.01 -0.47 0.00 1.00 0.00 0.00 64.86 65.39 2da0 h ILE 23 Cb 0.00 0.00 0.01 0.00 -0.74 0.00 0.00 36.82 36.09 2da0 h ILE 23 CO 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 178.15 177.90 2da0 s ARG 24 N -5.66 3.43 -0.37 2.37 1.70 -1.26 -5.09 118.95 114.08 2da0 s ARG 24 Ca -0.18 -0.48 0.03 0.00 -0.47 0.00 0.00 55.73 54.63 2da0 s ARG 24 Cb 0.02 -2.72 0.11 0.00 -0.57 0.00 0.00 34.95 31.78 2da0 s ARG 24 CO 0.54 0.19 0.11 -1.59 -1.08 0.00 0.00 175.30 173.47 2da0 s LYS 25 N -4.24 1.34 0.05 3.89 -2.85 -1.26 -4.56 119.74 112.11 2da0 s LYS 25 Ca 0.39 -1.80 0.09 0.00 -1.00 0.00 0.00 55.97 53.65 2da0 s LYS 25 Cb -0.09 -2.84 -0.03 0.00 -2.06 0.00 0.00 37.83 32.81 2da0 s LYS 25 CO 0.34 -1.00 -0.25 0.14 0.10 0.00 0.00 175.35 174.69 2da0 s VAL 26 N 0.86 2.29 -0.42 1.79 -7.23 -1.26 -4.85 120.40 111.58 2da0 s VAL 26 Ca 0.12 -1.36 -0.28 0.00 -1.81 0.00 0.00 61.98 58.65 2da0 s VAL 26 Cb -0.20 -1.91 0.02 0.00 0.56 0.00 0.00 36.38 34.85 2da0 s VAL 26 CO -0.10 0.35 1.07 0.26 -0.31 0.00 0.00 175.10 176.36 2da0 s TRP 27 N -0.84 2.96 -0.11 2.82 0.52 -1.26 -1.46 118.94 121.57 2da0 s TRP 27 Ca 0.12 0.82 -0.05 0.00 0.02 0.00 0.00 56.10 57.01 2da0 s TRP 27 Cb -0.10 -4.06 -0.04 0.00 -1.15 0.00 0.00 33.47 28.12 2da0 s TRP 27 CO 0.03 -1.04 0.09 -0.65 0.02 0.00 0.00 176.95 175.39 2da0 s GLN 28 N 4.01 3.33 0.15 4.98 -0.21 0.67 -4.82 119.66 127.77 2da0 s GLN 28 Ca 0.45 -0.24 -0.31 0.00 0.02 0.00 0.00 55.36 55.27 2da0 s GLN 28 Cb -0.10 -3.06 -0.09 0.00 1.00 0.00 0.00 33.01 30.77 2da0 s GLN 28 CO 0.25 0.71 1.43 0.50 -2.12 0.00 0.00 175.29 176.06 2da0 s ARG 29 N -0.86 4.29 0.04 2.91 3.52 -1.26 -0.78 118.95 126.82 2da0 s ARG 29 Ca 0.13 2.17 -0.03 0.00 -0.13 0.00 0.00 55.73 57.87 2da0 s ARG 29 Cb -0.12 -3.21 -0.02 0.00 -1.56 0.00 0.00 34.95 30.04 2da0 s ARG 29 CO 0.03 -0.46 0.04 1.03 -0.81 0.00 0.00 175.30 175.12 2da0 s ARG 30 N 0.88 0.58 0.08 5.12 1.81 0.65 -4.92 118.95 123.15 2da0 s ARG 30 Ca 0.65 -0.92 -0.20 0.00 -1.72 0.00 0.00 55.73 53.53 2da0 s ARG 30 Cb -0.39 0.21 -0.07 0.00 -0.45 0.00 0.00 34.95 34.26 2da0 s ARG 30 CO 0.32 -0.13 0.61 0.21 -0.68 0.00 0.00 175.30 175.63 2da0 s LYS 31 N -3.02 4.27 0.14 3.54 2.20 -1.26 -0.43 119.74 125.19 2da0 s LYS 31 Ca -0.01 0.81 0.06 0.00 -0.36 0.00 0.00 55.97 56.46 2da0 s LYS 31 Cb 0.01 -3.25 -0.04 0.00 -1.51 0.00 0.00 37.83 33.04 2da0 s LYS 31 CO -0.07 0.60 -0.13 0.00 -0.36 0.00 0.00 175.35 175.40 2da0 s SER 33 N -2.81 -0.82 -0.15 0.00 1.04 -1.12 -2.70 113.70 107.15 2da0 s SER 33 Ca 0.13 1.34 0.01 0.00 0.48 0.00 0.00 55.95 57.92 2da0 s SER 33 Cb -0.02 1.23 0.02 0.00 0.10 0.00 0.00 66.02 67.35 2da0 s SER 33 CO 0.03 -0.23 -0.17 -0.69 0.98 0.00 0.00 173.24 173.17 2da0 s VAL 34 N 1.45 1.76 -0.18 5.02 1.01 -0.62 -0.71 120.40 128.13 2da0 s VAL 34 Ca -0.09 -0.76 -0.14 0.00 0.00 0.00 0.00 61.98 60.99 2da0 s VAL 34 Cb -0.06 -1.62 0.05 0.00 0.00 0.00 0.00 36.38 34.76 2da0 s VAL 34 CO -0.16 0.49 0.47 -0.75 0.00 0.00 0.00 175.10 175.15 2da0 s LYS 35 N 1.33 0.51 -1.49 2.72 2.47 -0.23 -2.66 119.74 122.39 2da0 s LYS 35 Ca 0.03 0.74 -0.05 0.00 -1.56 0.00 0.00 55.97 55.12 2da0 s LYS 35 Cb -0.13 0.17 0.02 0.00 -1.46 0.00 0.00 37.83 36.43 2da0 s LYS 35 CO -0.10 -0.10 0.54 0.09 0.16 0.00 0.00 175.35 175.94 2da0 n ASN 36 N 3.38 -5.49 -1.31 1.43 3.02 -1.26 -1.07 115.26 113.95 2da0 n ASN 36 Ca -0.17 -0.29 -0.12 0.00 -0.03 0.00 0.00 54.58 53.97 2da0 n ASN 36 Cb 0.56 -4.47 -0.01 0.00 -0.61 0.00 0.00 39.78 35.26 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 -1.41 0.08 3.01 7.41 0.00 -1.26 -5.01 105.19 108.01 2da0 n GLY 37 Ca -0.10 -0.39 -0.23 0.00 0.00 0.00 0.00 46.02 45.30 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 -2.58 1.02 -0.37 -0.61 -1.09 -0.23 -2.42 121.20 114.92 2da0 s ILE 38 Ca 0.00 -0.43 -0.08 0.00 -2.23 0.00 0.00 60.65 57.91 2da0 s ILE 38 Cb 0.00 -0.94 0.04 0.00 -1.58 0.00 0.00 42.46 39.98 2da0 s ILE 38 CO 0.00 0.33 0.17 -0.22 -1.23 0.00 0.00 174.94 173.99 2da0 s LEU 39 N 0.60 4.64 -0.05 2.97 2.96 -0.53 -1.06 118.68 128.21 2da0 s LEU 39 Ca -0.12 -1.18 -0.17 0.00 -0.22 0.00 0.00 54.13 52.44 2da0 s LEU 39 Cb -0.15 -1.94 -0.05 0.00 0.50 0.00 0.00 46.19 44.55 2da0 s LEU 39 CO 0.03 -0.39 0.47 -0.89 -1.32 0.00 0.00 176.35 174.24 2da0 s THR 40 N 1.45 5.07 -0.24 3.68 2.01 0.11 -0.51 115.64 127.21 2da0 s THR 40 Ca 0.01 0.95 -0.02 0.00 0.31 0.00 0.00 61.69 62.94 2da0 s THR 40 Cb -0.20 -3.79 0.02 0.00 0.01 0.00 0.00 72.50 68.54 2da0 s THR 40 CO 0.04 0.44 -0.07 -0.63 -0.69 0.00 0.00 174.62 173.71 2da0 s ILE 41 N -0.18 2.84 -0.17 1.82 1.01 0.97 -2.79 121.20 124.70 2da0 s ILE 41 Ca 0.26 -0.98 -0.35 0.00 0.00 0.00 0.00 60.65 59.58 2da0 s ILE 41 Cb -0.16 -2.41 -0.12 0.00 0.01 0.00 0.00 42.46 39.77 2da0 s ILE 41 CO 0.12 0.24 1.93 -1.54 0.00 0.00 0.00 174.94 175.70 2da0 n SER 42 N 4.67 3.09 -0.03 3.58 3.41 -1.20 -2.49 113.62 124.65 2da0 n SER 42 Ca -0.17 0.86 -0.07 0.00 -0.26 0.00 0.00 58.87 59.23 2da0 n SER 42 Cb 0.48 -1.33 -0.02 0.00 -0.26 0.00 0.00 64.21 63.07 2da0 n SER 42 CO 0.00 0.00 0.00 1.57 -0.16 0.00 0.00 175.04 176.45 2da0 n HIS 43 N 7.21 0.00 -3.50 7.33 -0.00 -1.26 -4.84 115.22 120.16 2da0 n HIS 43 Ca 0.26 0.00 -0.09 0.00 0.46 0.00 0.00 57.72 58.35 2da0 n HIS 43 Cb 0.27 -0.25 -0.02 0.00 -0.12 0.00 0.00 29.99 29.86 2da0 n HIS 43 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 2da0 s ALA 44 N -2.15 -1.81 -0.18 1.57 0.00 -1.26 -4.96 121.76 112.96 2da0 s ALA 44 Ca -0.10 1.05 -0.17 0.00 0.00 0.00 0.00 51.96 52.73 2da0 s ALA 44 Cb 0.04 0.31 -0.21 0.00 0.00 0.00 0.00 23.12 23.26 2da0 s ALA 44 CO 0.13 -0.64 0.26 1.79 0.00 0.00 0.00 175.76 177.30 2da0 h THR 45 N 2.10 0.82 0.00 0.00 1.35 -1.98 -3.40 112.91 111.80 2da0 h THR 45 Ca -0.23 -2.23 -0.01 0.00 -0.55 0.00 0.00 66.41 63.40 2da0 h THR 45 Cb 1.23 2.30 -0.00 0.00 -1.73 0.00 0.00 68.15 69.95 2da0 h THR 45 CO 0.32 0.49 -1.03 -1.54 -0.25 0.00 0.00 175.52 173.51 2da0 n SER 46 N -4.15 0.65 -0.29 5.36 3.41 -1.26 -4.78 113.62 112.56 2da0 n SER 46 Ca -0.32 0.00 -0.02 0.00 -0.26 0.00 0.00 58.87 58.27 2da0 n SER 46 Cb 0.79 -0.01 0.01 0.00 -0.26 0.00 0.00 64.21 64.74 2da0 n SER 46 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2da0 n ASN 47 N -2.94 -0.55 -2.58 4.04 2.85 -1.26 -4.74 115.26 110.08 2da0 n ASN 47 Ca -0.01 1.31 -0.10 0.00 -0.11 0.00 0.00 54.58 55.67 2da0 n ASN 47 Cb 0.51 -0.27 -0.00 0.00 1.24 0.00 0.00 39.78 41.25 2da0 n ASN 47 CO 0.00 0.00 0.00 0.54 -2.11 0.00 0.00 177.26 175.69 2da0 n ARG 48 N -5.06 0.76 -3.22 1.20 1.74 -1.26 -5.11 116.66 105.71 2da0 n ARG 48 Ca 0.06 -2.11 -0.28 0.00 -0.77 0.00 0.00 57.85 54.75 2da0 n ARG 48 Cb 0.28 2.29 -0.02 0.00 -1.02 0.00 0.00 32.46 33.98 2da0 n ARG 48 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 2da0 s GLN 49 N -2.39 3.61 0.90 5.56 -0.21 -1.26 -4.25 119.66 121.61 2da0 s GLN 49 Ca 0.19 0.00 -0.12 0.00 0.02 0.00 0.00 55.36 55.46 2da0 s GLN 49 Cb -0.02 -2.60 0.13 0.00 1.00 0.00 0.00 33.01 31.52 2da0 s GLN 49 CO 0.14 0.13 1.09 -1.25 -2.12 0.00 0.00 175.29 173.28 2da0 s PRO 50 N -3.86 1.24 -0.25 2.91 0.04 -1.26 -4.62 135.00 129.20 2da0 s PRO 50 Ca 0.44 0.81 -0.09 0.00 0.04 0.00 0.00 61.00 62.20 2da0 s PRO 50 Cb -0.10 -1.81 -0.04 0.00 0.04 0.00 0.00 34.50 32.59 2da0 s PRO 50 CO 0.33 -2.25 0.12 0.00 0.04 0.00 0.00 177.00 175.24 2da0 s ALA 51 N -2.94 3.36 -0.28 8.56 0.00 -1.04 -4.94 121.76 124.48 2da0 s ALA 51 Ca 0.63 -1.06 -0.07 0.00 0.00 0.00 0.00 51.96 51.46 2da0 s ALA 51 Cb -0.18 -2.23 -0.01 0.00 0.00 0.00 0.00 23.12 20.70 2da0 s ALA 51 CO 0.57 -0.42 0.08 0.15 0.00 0.00 0.00 175.76 176.14 2da0 s LYS 52 N 1.50 3.37 -0.23 0.00 1.02 -1.26 -0.02 119.74 124.12 2da0 s LYS 52 Ca 0.06 -0.67 -0.10 0.00 0.02 0.00 0.00 55.97 55.28 2da0 s LYS 52 Cb -0.15 -3.37 -0.05 0.00 -0.52 0.00 0.00 37.83 33.74 2da0 s LYS 52 CO 0.06 -0.33 0.15 -0.51 -0.92 0.00 0.00 175.35 173.80 2da0 s LEU 53 N 1.56 4.08 -0.11 3.17 1.43 0.33 -4.94 118.68 124.21 2da0 s LEU 53 Ca 0.05 0.11 -0.30 0.00 -1.03 0.00 0.00 54.13 52.96 2da0 s LEU 53 Cb -0.16 -2.09 -0.02 0.00 0.03 0.00 0.00 46.19 43.95 2da0 s LEU 53 CO 0.03 0.08 1.12 0.21 0.23 0.00 0.00 176.35 178.03 2da0 s ASN 54 N 0.94 7.11 0.16 2.29 3.84 -1.26 -1.45 114.94 126.56 2da0 s ASN 54 Ca 0.07 1.64 -0.01 0.00 0.21 0.00 0.00 52.86 54.77 2da0 s ASN 54 Cb -0.13 -2.55 -0.00 0.00 -0.55 0.00 0.00 41.25 38.01 2da0 s ASN 54 CO 0.03 -0.58 1.38 -0.07 -2.79 0.00 0.00 177.10 175.08 2da0 h LEU 55 N 8.54 0.44 -2.23 3.21 4.07 -1.80 0.17 115.31 127.72 2da0 h LEU 55 Ca -0.30 -0.32 0.05 0.00 0.08 0.00 0.00 57.88 57.39 2da0 h LEU 55 Cb 1.13 -0.13 -0.01 0.00 1.08 0.00 0.00 40.66 42.73 2da0 h LEU 55 CO 0.90 1.09 0.21 -0.07 -1.08 0.00 0.00 178.44 179.49 2da0 h LEU 56 N 0.22 0.00 0.00 1.67 3.38 -1.92 -2.69 115.31 115.96 2da0 h LEU 56 Ca -0.05 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.69 2da0 h LEU 56 Cb 1.44 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 42.14 2da0 h LEU 56 CO 0.14 0.00 -1.86 0.35 0.09 0.00 0.00 178.44 177.16 2da0 n THR 57 N -3.76 0.86 -1.55 0.22 -2.24 -1.17 -5.01 114.28 101.62 2da0 n THR 57 Ca 0.02 -0.43 -0.33 0.00 -2.27 0.00 0.00 64.05 61.04 2da0 n THR 57 Cb 0.33 -0.86 0.07 0.00 -2.10 0.00 0.00 70.33 67.77 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 -4.23 2.95 -0.67 0.00 0.74 0.15 -4.82 119.66 113.77 2da0 s GLN 59 Ca 0.67 -0.83 -0.19 0.00 0.05 0.00 0.00 55.36 55.06 2da0 s GLN 59 Cb -0.22 -2.33 0.11 0.00 1.10 0.00 0.00 33.01 31.68 2da0 s GLN 59 CO 0.46 0.05 0.80 0.08 -0.55 0.00 0.00 175.29 176.13 2da0 s VAL 60 N 0.65 4.81 -0.61 1.34 1.01 -1.26 -1.42 120.40 124.91 2da0 s VAL 60 Ca -0.11 -1.12 -0.09 0.00 0.00 0.00 0.00 61.98 60.66 2da0 s VAL 60 Cb -0.16 -4.56 0.16 0.00 0.00 0.00 0.00 36.38 31.82 2da0 s VAL 60 CO 0.02 -1.22 0.49 -0.54 0.00 0.00 0.00 175.10 173.86 2da0 s LYS 61 N 2.66 2.83 0.36 2.72 1.02 -0.38 -5.00 119.74 123.94 2da0 s LYS 61 Ca 0.16 -2.17 -0.27 0.00 0.02 0.00 0.00 55.97 53.71 2da0 s LYS 61 Cb -0.19 -4.02 -0.09 0.00 -0.52 0.00 0.00 37.83 33.00 2da0 s LYS 61 CO 0.03 -1.22 1.21 -1.25 -0.92 0.00 0.00 175.35 173.20 2da0 s PRO 62 N 0.64 4.24 0.84 -1.68 0.04 -1.26 -0.65 135.00 137.17 2da0 s PRO 62 Ca 0.12 1.97 -0.13 0.00 0.04 0.00 0.00 61.00 63.00 2da0 s PRO 62 Cb -0.20 -2.89 0.20 0.00 0.04 0.00 0.00 34.50 31.64 2da0 s PRO 62 CO -0.04 -0.20 0.44 0.27 0.04 0.00 0.00 177.00 177.52 2da0 n ASN 63 N 0.49 -2.98 0.00 6.66 0.23 -1.02 -4.87 115.26 113.77 2da0 n ASN 63 Ca 0.02 -0.45 0.00 0.00 -0.53 0.00 0.00 54.58 53.62 2da0 n ASN 63 Cb 0.45 -0.59 0.00 0.00 -2.08 0.00 0.00 39.78 37.56 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 -4.22 2.41 0.05 -2.53 0.00 -1.26 -4.87 120.51 110.08 2da0 n ALA 64 Ca -0.10 0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.14 2da0 n ALA 64 Cb 0.31 0.21 -0.13 0.00 0.00 0.00 0.00 19.45 19.84 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 0.41 0.00 0.00 4.39 -1.99 -3.46 114.58 113.93 2da0 h GLU 65 Ca 0.00 -0.57 -0.29 0.00 0.34 0.00 0.00 59.36 58.84 2da0 h GLU 65 Cb 0.42 0.19 0.13 0.00 -0.10 0.00 0.00 28.75 29.39 2da0 h GLU 65 CO 0.00 1.23 0.22 -0.25 -1.16 0.00 0.00 179.01 179.06 2da0 n ASP 66 N -4.07 -0.55 0.00 1.42 8.00 -1.26 -5.04 116.55 115.04 2da0 n ASP 66 Ca -0.13 -1.21 0.00 0.00 0.71 0.00 0.00 54.79 54.16 2da0 n ASP 66 Cb 0.82 -0.70 0.00 0.00 -0.02 0.00 0.00 41.12 41.22 2da0 n ASP 66 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 2da0 n LYS 67 N -3.25 1.43 -2.82 -1.24 4.76 -1.26 -4.85 118.16 110.93 2da0 n LYS 67 Ca 0.11 0.00 -0.29 0.00 -2.87 0.00 0.00 58.31 55.26 2da0 n LYS 67 Cb 0.40 -0.88 -0.03 0.00 -1.84 0.00 0.00 35.03 32.69 2da0 n LYS 67 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 2da0 n LYS 68 N -1.97 3.52 -3.76 1.97 5.02 -1.26 -4.82 118.16 116.85 2da0 n LYS 68 Ca 0.00 -4.77 -0.12 0.00 -2.02 0.00 0.00 58.31 51.40 2da0 n LYS 68 Cb 0.38 -2.27 -0.08 0.00 -0.02 0.00 0.00 35.03 33.04 2da0 n LYS 68 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 2da0 s SER 69 N -3.19 -0.14 -0.23 4.39 0.01 -1.26 -1.58 113.70 111.70 2da0 s SER 69 Ca 0.48 -0.09 -0.27 0.00 1.31 0.00 0.00 55.95 57.37 2da0 s SER 69 Cb 0.29 0.33 0.12 0.00 0.21 0.00 0.00 66.02 66.98 2da0 s SER 69 CO -0.15 -0.55 1.01 0.72 0.41 0.00 0.00 173.24 174.68 2da0 s PHE 70 N -2.07 -0.44 -0.14 2.43 -0.12 -1.12 -2.43 117.98 114.08 2da0 s PHE 70 Ca -0.08 0.97 -0.05 0.00 -0.05 0.00 0.00 56.93 57.71 2da0 s PHE 70 Cb -0.03 0.39 -0.04 0.00 -0.63 0.00 0.00 43.02 42.72 2da0 s PHE 70 CO -0.00 -0.28 0.04 -0.51 -0.05 0.00 0.00 175.22 174.42 2da0 s ASP 71 N -0.29 5.50 -0.42 1.98 1.01 0.18 -2.56 116.67 122.07 2da0 s ASP 71 Ca 0.01 0.12 -0.08 0.00 0.71 0.00 0.00 52.55 53.31 2da0 s ASP 71 Cb -0.03 -1.82 0.09 0.00 1.01 0.00 0.00 42.92 42.17 2da0 s ASP 71 CO -0.03 0.26 0.25 -0.22 0.21 0.00 0.00 175.17 175.64 2da0 s LEU 72 N -0.14 5.21 -0.33 1.23 2.96 -1.01 -1.25 118.68 125.35 2da0 s LEU 72 Ca 0.06 -1.68 -0.27 0.00 -0.22 0.00 0.00 54.13 52.02 2da0 s LEU 72 Cb -0.12 -1.95 0.01 0.00 0.50 0.00 0.00 46.19 44.64 2da0 s LEU 72 CO 0.01 -0.56 1.00 -0.63 -1.32 0.00 0.00 176.35 174.86 2da0 s ILE 73 N 1.35 4.56 0.72 6.68 1.01 -0.51 -0.76 121.20 134.25 2da0 s ILE 73 Ca 0.04 1.53 -0.10 0.00 0.00 0.00 0.00 60.65 62.13 2da0 s ILE 73 Cb -0.23 -4.36 0.16 0.00 0.01 0.00 0.00 42.46 38.03 2da0 s ILE 73 CO 0.00 -0.47 0.97 -1.20 0.00 0.00 0.00 174.94 174.25 2da0 n SER 74 N 6.77 0.35 0.10 3.58 7.64 0.16 -0.68 113.62 131.54 2da0 n SER 74 Ca 0.10 -1.52 -0.13 0.00 1.01 0.00 0.00 58.87 58.33 2da0 n SER 74 Cb 0.47 -0.72 -0.06 0.00 -1.01 0.00 0.00 64.21 62.89 2da0 n SER 74 CO 0.00 0.00 0.00 1.12 -3.01 0.00 0.00 175.04 173.15 2da0 h HIS 75 N -1.32 -0.94 -0.82 1.43 2.07 -1.94 -3.31 115.15 110.33 2da0 h HIS 75 Ca -0.32 0.02 -0.38 0.00 -2.85 0.00 0.00 60.37 56.84 2da0 h HIS 75 Cb 0.94 0.40 -0.41 0.00 2.57 0.00 0.00 27.41 30.91 2da0 h HIS 75 CO 0.00 -0.44 -1.03 0.27 -3.07 0.00 0.00 177.93 173.65 2da0 n ASN 76 N -5.43 2.59 -3.68 3.10 6.94 -1.26 -5.08 115.26 112.45 2da0 n ASN 76 Ca -0.06 -2.79 -0.03 0.00 -0.02 0.00 0.00 54.58 51.68 2da0 n ASN 76 Cb 0.34 -0.47 -0.01 0.00 -2.36 0.00 0.00 39.78 37.28 2da0 n ASN 76 CO 0.00 0.00 0.00 -0.60 -1.03 0.00 0.00 177.26 175.63 2da0 s ARG 77 N -3.52 0.89 -0.05 -3.83 3.52 -1.25 -5.17 118.95 109.54 2da0 s ARG 77 Ca 0.34 -0.47 0.04 0.00 -0.13 0.00 0.00 55.73 55.51 2da0 s ARG 77 Cb 0.39 0.32 -0.00 0.00 -1.56 0.00 0.00 34.95 34.10 2da0 s ARG 77 CO -0.02 -0.41 -0.18 0.99 -0.81 0.00 0.00 175.30 174.87 2da0 s THR 78 N -2.99 1.52 0.27 4.11 2.01 -1.26 0.40 115.64 119.70 2da0 s THR 78 Ca 0.12 -0.76 0.10 0.00 0.31 0.00 0.00 61.69 61.46 2da0 s THR 78 Cb 0.00 -1.31 -0.04 0.00 0.01 0.00 0.00 72.50 71.16 2da0 s THR 78 CO -0.01 0.44 -0.05 -0.31 -0.69 0.00 0.00 174.62 174.00 2da0 s TYR 79 N 0.11 2.60 -0.11 4.92 1.51 0.06 -4.93 117.35 121.50 2da0 s TYR 79 Ca -0.06 -0.25 0.00 0.00 -1.01 0.00 0.00 57.07 55.75 2da0 s TYR 79 Cb -0.13 -1.16 0.02 0.00 -0.11 0.00 0.00 41.96 40.59 2da0 s TYR 79 CO 0.03 0.64 -0.10 -1.01 -1.11 0.00 0.00 175.55 174.00 2da0 s HIS 80 N -2.37 1.60 0.15 2.71 3.76 -1.26 -2.41 115.29 117.47 2da0 s HIS 80 Ca 0.31 -0.78 0.06 0.00 -0.15 0.00 0.00 55.06 54.50 2da0 s HIS 80 Cb -0.06 -1.26 -0.04 0.00 1.11 0.00 0.00 32.58 32.33 2da0 s HIS 80 CO 0.19 -0.49 -0.13 -0.06 -0.85 0.00 0.00 174.74 173.40 2da0 s PHE 81 N 1.44 1.45 -0.12 1.40 0.08 -1.06 -3.31 117.98 117.86 2da0 s PHE 81 Ca 0.01 -0.62 -0.06 0.00 0.12 0.00 0.00 56.93 56.37 2da0 s PHE 81 Cb -0.13 -0.72 0.05 0.00 -0.57 0.00 0.00 43.02 41.64 2da0 s PHE 81 CO -0.06 0.19 0.27 -1.14 -0.10 0.00 0.00 175.22 174.38 2da0 s GLN 82 N -3.29 0.23 0.48 0.44 0.74 -0.96 -2.78 119.66 114.52 2da0 s GLN 82 Ca 0.15 0.58 -0.19 0.00 0.05 0.00 0.00 55.36 55.95 2da0 s GLN 82 Cb -0.01 -0.10 -0.09 0.00 1.10 0.00 0.00 33.01 33.90 2da0 s GLN 82 CO 0.03 -0.17 0.98 0.00 -0.55 0.00 0.00 175.29 175.58 2da0 s ALA 83 N 1.36 3.01 -0.16 1.58 0.00 -0.61 -1.70 121.76 125.23 2da0 s ALA 83 Ca -0.09 0.36 -0.23 0.00 0.00 0.00 0.00 51.96 52.00 2da0 s ALA 83 Cb -0.10 -3.16 -0.24 0.00 0.00 0.00 0.00 23.12 19.62 2da0 s ALA 83 CO -0.09 -0.11 0.51 0.93 0.00 0.00 0.00 175.76 177.00 2da0 h GLU 84 N 1.45 0.06 -6.46 0.00 5.08 -1.89 -3.45 114.58 109.36 2da0 h GLU 84 Ca -0.48 -0.09 -0.63 0.00 -1.00 0.00 0.00 59.36 57.15 2da0 h GLU 84 Cb 1.19 0.04 -0.15 0.00 0.50 0.00 0.00 28.75 30.32 2da0 h GLU 84 CO 0.61 1.05 -0.75 -0.51 -1.00 0.00 0.00 179.01 178.40 2da0 s ASP 85 N -6.65 4.01 0.26 1.42 1.01 -1.26 -5.03 116.67 110.42 2da0 s ASP 85 Ca -0.23 -0.69 -0.02 0.00 0.71 0.00 0.00 52.55 52.32 2da0 s ASP 85 Cb 0.02 -0.58 0.44 0.00 1.01 0.00 0.00 42.92 43.82 2da0 s ASP 85 CO 0.67 0.10 1.83 -0.08 0.21 0.00 0.00 175.17 177.90 2da0 h GLU 86 N 2.88 0.89 -0.58 8.23 4.81 -1.93 -1.53 114.58 127.35 2da0 h GLU 86 Ca -0.46 -0.05 -0.05 0.00 -0.13 0.00 0.00 59.36 58.66 2da0 h GLU 86 Cb 1.21 -0.20 -0.02 0.00 0.63 0.00 0.00 28.75 30.37 2da0 h GLU 86 CO 0.53 0.59 0.15 1.96 -0.73 0.00 0.00 179.01 181.51 2da0 h GLN 87 N 0.92 0.93 -0.56 1.92 1.08 -1.98 -2.18 115.11 115.23 2da0 h GLN 87 Ca 0.43 -0.22 0.05 0.00 -1.45 0.00 0.00 58.65 57.47 2da0 h GLN 87 Cb 0.36 -0.12 -0.05 0.00 -0.05 0.00 0.00 27.48 27.62 2da0 h GLN 87 CO -0.24 0.85 0.29 0.22 -0.95 0.00 0.00 178.83 179.00 2da0 h ASP 88 N 0.84 0.42 0.08 1.46 3.58 -1.70 -1.72 116.42 119.37 2da0 h ASP 88 Ca 0.18 0.03 -0.00 0.00 0.42 0.00 0.00 57.03 57.66 2da0 h ASP 88 Cb 0.33 -0.05 0.00 0.00 1.72 0.00 0.00 39.33 41.34 2da0 h ASP 88 CO 0.00 0.28 -0.04 0.22 -2.88 0.00 0.00 179.24 176.82 2da0 h TYR 89 N 0.55 -0.10 -0.89 0.28 3.20 -1.24 0.13 116.97 118.92 2da0 h TYR 89 Ca 0.25 -0.00 0.28 0.00 3.14 0.00 0.00 58.73 62.40 2da0 h TYR 89 Cb 0.16 0.03 -0.16 0.00 1.54 0.00 0.00 36.73 38.30 2da0 h TYR 89 CO -0.10 -0.06 0.15 0.28 -1.64 0.00 0.00 178.16 176.79 2da0 n VAL 90 N -2.35 -0.37 0.25 1.81 0.31 -0.84 -0.34 118.33 116.79 2da0 n VAL 90 Ca -0.01 1.91 -0.13 0.00 -0.01 0.00 0.00 64.34 66.09 2da0 n VAL 90 Cb 0.04 -2.87 -0.07 0.00 -0.91 0.00 0.00 33.84 30.03 2da0 n VAL 90 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2da0 h ALA 91 N 1.77 -0.66 -0.46 3.52 0.00 -1.30 -2.73 119.26 119.40 2da0 h ALA 91 Ca 0.60 -0.19 0.05 0.00 0.00 0.00 0.00 54.91 55.37 2da0 h ALA 91 Cb 1.35 0.26 -0.07 0.00 0.00 0.00 0.00 17.79 19.33 2da0 h ALA 91 CO -0.79 -0.68 -0.40 -1.49 0.00 0.00 0.00 179.25 175.89 2da0 h TRP 92 N -1.03 -1.24 -0.94 0.00 -0.00 0.14 0.24 115.95 113.12 2da0 h TRP 92 Ca -0.07 0.07 0.23 0.00 -0.00 0.00 0.00 58.89 59.12 2da0 h TRP 92 Cb 0.59 0.60 -0.12 0.00 -0.00 0.00 0.00 29.16 30.23 2da0 h TRP 92 CO 0.01 -0.30 0.48 0.82 -0.00 0.00 0.00 178.44 179.45 2da0 h ILE 93 N -0.16 0.51 -0.60 1.49 1.08 -1.33 0.20 117.51 118.71 2da0 h ILE 93 Ca 0.08 -0.17 -0.02 0.00 -0.39 0.00 0.00 64.86 64.36 2da0 h ILE 93 Cb 0.36 -0.02 -0.03 0.00 -3.07 0.00 0.00 36.82 34.06 2da0 h ILE 93 CO -0.52 0.09 0.30 -1.28 -0.69 0.00 0.00 178.15 176.06 2da0 h SER 94 N 0.49 0.77 0.02 1.72 0.87 -0.31 -2.53 113.55 114.58 2da0 h SER 94 Ca 0.59 -0.12 -0.00 0.00 -1.23 0.00 0.00 61.79 61.04 2da0 h SER 94 Cb 1.12 -0.20 0.00 0.00 -0.44 0.00 0.00 62.40 62.88 2da0 h SER 94 CO -0.50 0.67 -0.01 0.58 -0.53 0.00 0.00 176.83 177.04 2da0 h VAL 95 N 0.81 0.00 -0.67 2.23 2.07 0.17 -0.57 116.25 120.28 2da0 h VAL 95 Ca 0.21 -0.02 0.10 0.00 0.82 0.00 0.00 66.70 67.80 2da0 h VAL 95 Cb 0.09 0.00 -0.10 0.00 -1.52 0.00 0.00 31.29 29.76 2da0 h VAL 95 CO -0.03 0.00 -0.29 0.18 0.02 0.00 0.00 177.57 177.45 2da0 n LEU 96 N -2.14 -0.49 -0.13 2.57 4.77 0.23 0.14 117.00 121.95 2da0 n LEU 96 Ca -0.00 1.18 -0.10 0.00 -0.03 0.00 0.00 56.01 57.06 2da0 n LEU 96 Cb 0.01 -0.25 -0.01 0.00 -2.33 0.00 0.00 43.42 40.84 2da0 n LEU 96 CO 0.01 -1.04 0.81 0.74 -1.33 0.00 0.00 177.39 176.57 2da0 h THR 97 N 0.00 1.25 0.06 -5.08 2.02 -1.57 -3.09 112.91 106.51 2da0 h THR 97 Ca 0.21 -0.94 -0.00 0.00 0.77 0.00 0.00 66.41 66.44 2da0 h THR 97 Cb 0.38 1.10 -0.00 0.00 -1.74 0.00 0.00 68.15 67.88 2da0 h THR 97 CO -0.66 0.32 -0.05 0.78 0.37 0.00 0.00 175.52 176.27 2da0 h ASN 98 N 0.51 -0.14 -0.83 4.18 2.35 0.29 -1.91 115.58 120.03 2da0 h ASN 98 Ca 0.11 0.01 0.30 0.00 -0.55 0.00 0.00 56.30 56.17 2da0 h ASN 98 Cb 0.43 0.05 -0.15 0.00 0.05 0.00 0.00 38.32 38.69 2da0 h ASN 98 CO 0.01 -0.07 0.27 -0.24 -1.65 0.00 0.00 177.43 175.76 2da0 n SER 99 N -2.56 0.13 0.20 5.81 2.88 0.56 -0.58 113.62 120.07 2da0 n SER 99 Ca -0.01 1.38 -0.08 0.00 -1.33 0.00 0.00 58.87 58.83 2da0 n SER 99 Cb 0.05 -0.61 -0.04 0.00 -0.75 0.00 0.00 64.21 62.87 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 -0.49 -0.41 -1.46 3.64 -1.38 -1.11 116.57 115.37 2da0 h LYS 100 Ca 0.62 0.03 0.07 0.00 -1.27 0.00 0.00 60.65 60.10 2da0 h LYS 100 Cb 1.53 0.11 -0.09 0.00 -0.41 0.00 0.00 32.23 33.37 2da0 h LYS 100 CO -0.69 -0.33 -0.43 0.93 -2.27 0.00 0.00 179.45 176.66 2da0 h GLU 101 N -0.53 -0.31 0.00 1.90 4.39 -0.05 0.93 114.58 120.92 2da0 h GLU 101 Ca -0.05 0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.67 2da0 h GLU 101 Cb 0.39 0.07 0.00 0.00 -0.10 0.00 0.00 28.75 29.11 2da0 h GLU 101 CO 0.09 -0.21 0.16 0.93 -1.16 0.00 0.00 179.01 178.81 2da0 h GLU 102 N -0.33 0.00 0.00 2.33 5.08 -1.12 0.26 114.58 120.80 2da0 h GLU 102 Ca 0.14 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.34 2da0 h GLU 102 Cb 0.58 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.80 2da0 h GLU 102 CO -0.58 0.00 -1.76 0.00 -1.00 0.00 0.00 179.01 175.67 2da0 n ALA 103 N -1.90 2.11 -0.08 3.43 0.00 0.27 -3.98 120.51 120.36 2da0 n ALA 103 Ca -0.02 -0.70 -0.14 0.00 0.00 0.00 0.00 53.44 52.58 2da0 n ALA 103 Cb 0.21 -0.73 -0.09 0.00 0.00 0.00 0.00 19.45 18.83 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 0.00 -0.92 0.00 3.38 0.31 -2.87 115.31 115.21 2da0 h LEU 104 Ca -0.20 -0.56 0.19 0.00 0.09 0.00 0.00 57.88 57.40 2da0 h LEU 104 Cb 1.54 0.00 -0.11 0.00 0.09 0.00 0.00 40.66 42.18 2da0 h LEU 104 CO 0.03 1.08 0.48 0.00 0.09 0.00 0.00 178.44 180.12 2da0 h THR 105 N -1.00 0.63 -0.00 0.22 1.03 -1.00 0.17 112.91 112.96 2da0 h THR 105 Ca -0.13 -0.20 -0.17 0.00 -0.01 0.00 0.00 66.41 65.90 2da0 h THR 105 Cb 0.91 -0.01 -0.02 0.00 -1.07 0.00 0.00 68.15 67.96 2da0 h THR 105 CO -0.08 0.11 -0.79 0.00 -0.01 0.00 0.00 175.52 174.75 2da0 h MET 106 N 0.59 0.04 -7.32 0.00 -0.00 -1.72 -3.46 114.93 103.06 2da0 h MET 106 Ca 0.54 -0.04 -0.46 0.00 -0.00 0.00 0.00 59.70 59.74 2da0 h MET 106 Cb 0.89 0.01 0.16 0.00 -0.00 0.00 0.00 31.60 32.66 2da0 h MET 106 CO -0.43 0.80 0.18 0.00 -0.00 0.00 0.00 176.91 177.47 2da0 s ALA 107 N -3.25 0.90 0.26 -3.00 0.00 0.58 -4.98 121.76 112.28 2da0 s ALA 107 Ca -0.01 -0.25 -0.29 0.00 0.00 0.00 0.00 51.96 51.41 2da0 s ALA 107 Cb 0.11 -3.16 -0.09 0.00 0.00 0.00 0.00 23.12 19.98 2da0 s ALA 107 CO 0.79 -2.87 1.18 -0.06 0.00 0.00 0.00 175.76 174.80 2da0 s PHE 108 N -2.89 3.42 -0.28 0.00 0.40 -1.26 -4.95 117.98 112.42 2da0 s PHE 108 Ca 0.65 1.55 -0.06 0.00 -0.60 0.00 0.00 56.93 58.47 2da0 s PHE 108 Cb -0.19 -3.42 0.00 0.00 0.51 0.00 0.00 43.02 39.92 2da0 s PHE 108 CO 0.58 -1.05 0.06 -1.12 0.70 0.00 0.00 175.22 174.39 2da0 s SER 109 N -0.47 4.98 0.00 1.36 0.01 -1.26 -4.80 113.70 113.53 2da0 s SER 109 Ca 0.48 -0.62 0.00 0.00 1.31 0.00 0.00 55.95 57.12 2da0 s SER 109 Cb -0.34 -1.86 0.00 0.00 0.21 0.00 0.00 66.02 64.04 2da0 s SER 109 CO 0.42 -0.15 0.00 0.61 0.41 0.00 0.00 173.24 174.53 2da0 n GLY 110 N 4.85 -0.08 3.64 3.44 0.00 -1.26 -5.01 105.19 110.77 2da0 n GLY 110 Ca -0.15 -0.52 -0.43 0.00 0.00 0.00 0.00 46.02 44.92 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 -0.71 3.98 0.15 1.61 0.04 -1.26 -5.01 135.00 133.80 2da0 s PRO 111 Ca 0.00 1.82 0.08 0.00 0.04 0.00 0.00 61.00 62.94 2da0 s PRO 111 Cb 0.00 -3.98 -0.04 0.00 0.04 0.00 0.00 34.50 30.52 2da0 s PRO 111 CO 0.00 -1.06 -0.11 0.45 0.04 0.00 0.00 177.00 176.32 2da0 s SER 112 N 3.60 4.24 -0.44 6.66 0.15 -1.26 -5.03 113.70 121.61 2da0 s SER 112 Ca 0.69 -0.52 -0.41 0.00 0.70 0.00 0.00 55.95 56.41 2da0 s SER 112 Cb -0.27 -0.73 -0.17 0.00 -1.71 0.00 0.00 66.02 63.14 2da0 s SER 112 CO 0.27 0.13 1.62 -1.54 1.20 0.00 0.00 173.24 174.92 2da0 n SER 113 N 0.32 0.90 0.00 5.45 3.41 -1.26 -5.28 113.62 117.17 2da0 n SER 113 Ca -0.12 0.87 0.00 0.00 -0.26 0.00 0.00 58.87 59.36 2da0 n SER 113 Cb 0.54 -0.79 0.00 0.00 -0.26 0.00 0.00 64.21 63.70 2da0 n SER 113 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49