#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 1.75 -0.23 1.61 0.01 -1.26 -5.05 113.70 110.53 2da0 s SER 2 Ca 0.00 -1.14 0.15 0.00 1.31 0.00 0.00 55.95 56.27 2da0 s SER 2 Cb 0.00 0.01 0.47 0.00 0.21 0.00 0.00 66.02 66.71 2da0 s SER 2 CO 0.00 -0.45 1.17 -1.54 0.41 0.00 0.00 173.24 172.83 2da0 n SER 3 N -0.32 2.88 -0.50 2.44 3.41 -1.26 -5.07 113.62 115.20 2da0 n SER 3 Ca -0.07 -3.02 0.00 0.00 -0.26 0.00 0.00 58.87 55.52 2da0 n SER 3 Cb 0.63 -0.41 0.00 0.00 -0.26 0.00 0.00 64.21 64.17 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 -0.59 -3.57 3.87 5.00 0.00 -1.26 -5.03 105.19 103.61 2da0 n GLY 4 Ca 0.24 -0.78 -0.30 0.00 0.00 0.00 0.00 46.02 45.17 2da0 n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2da0 s SER 5 N 0.00 6.46 -0.40 1.61 0.01 -1.26 -5.01 113.70 115.12 2da0 s SER 5 Ca 0.00 1.25 0.05 0.00 1.31 0.00 0.00 55.95 58.56 2da0 s SER 5 Cb 0.00 -2.38 0.44 0.00 0.21 0.00 0.00 66.02 64.30 2da0 s SER 5 CO 0.00 -0.54 1.30 -1.20 0.41 0.00 0.00 173.24 173.21 2da0 n SER 6 N -1.73 5.29 -3.05 2.44 7.64 -1.26 -4.99 113.62 117.96 2da0 n SER 6 Ca 0.04 -3.75 -0.15 0.00 1.01 0.00 0.00 58.87 56.01 2da0 n SER 6 Cb 0.54 -0.47 0.02 0.00 -1.01 0.00 0.00 64.21 63.28 2da0 n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2da0 n GLY 7 N -0.66 -1.23 0.12 0.23 0.00 -1.26 -4.95 105.19 97.43 2da0 n GLY 7 Ca 0.45 1.00 -0.20 0.00 0.00 0.00 0.00 46.02 47.27 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 2.34 0.41 0.00 1.61 -1.99 -1.94 -3.51 116.97 113.90 2da0 h TYR 8 Ca -0.17 -0.30 0.00 0.00 2.00 0.00 0.00 58.73 60.26 2da0 h TYR 8 Cb 0.97 -0.02 0.00 0.00 2.00 0.00 0.00 36.73 39.68 2da0 h TYR 8 CO 0.05 1.43 0.00 0.41 -0.00 0.00 0.00 178.16 180.05 2da0 n GLY 9 N 1.69 4.14 0.10 3.88 0.00 -1.26 -4.98 105.19 108.76 2da0 n GLY 9 Ca -0.21 -1.14 0.03 0.00 0.00 0.00 0.00 46.02 44.70 2da0 n GLY 9 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 2da0 h SER 10 N 0.00 0.00 -3.39 1.61 0.87 -1.91 -3.37 113.55 107.37 2da0 h SER 10 Ca 0.00 0.00 -0.67 0.00 -1.23 0.00 0.00 61.79 59.89 2da0 h SER 10 Cb 0.00 0.00 -0.15 0.00 -0.44 0.00 0.00 62.40 61.81 2da0 h SER 10 CO 0.00 0.42 -0.64 -0.70 -0.53 0.00 0.00 176.83 175.38 2da0 s GLU 11 N -3.04 2.84 -0.30 2.24 -6.30 -1.26 -4.42 118.70 108.46 2da0 s GLU 11 Ca -0.02 -0.54 -0.15 0.00 -2.50 0.00 0.00 54.97 51.77 2da0 s GLU 11 Cb 0.09 -2.70 0.16 0.00 0.00 0.00 0.00 34.13 31.68 2da0 s GLU 11 CO 0.80 0.66 0.95 0.21 0.02 0.00 0.00 175.26 177.89 2da0 s LYS 12 N -1.25 0.34 -0.23 4.30 2.20 0.35 -5.00 119.74 120.44 2da0 s LYS 12 Ca 0.17 0.81 0.00 0.00 -0.36 0.00 0.00 55.97 56.59 2da0 s LYS 12 Cb -0.11 0.44 0.03 0.00 -1.51 0.00 0.00 37.83 36.68 2da0 s LYS 12 CO 0.07 -0.11 -0.11 0.21 -0.36 0.00 0.00 175.35 175.05 2da0 s LYS 13 N 2.36 2.77 0.00 4.03 2.20 -1.26 -0.29 119.74 129.55 2da0 s LYS 13 Ca -0.04 -1.00 0.00 0.00 -0.36 0.00 0.00 55.97 54.57 2da0 s LYS 13 Cb -0.06 -2.85 0.00 0.00 -1.51 0.00 0.00 37.83 33.41 2da0 s LYS 13 CO -0.17 -0.37 0.00 0.41 -0.36 0.00 0.00 175.35 174.85 2da0 n GLY 14 N 4.61 4.06 3.17 5.54 0.00 -0.69 -5.00 105.19 116.88 2da0 n GLY 14 Ca -0.17 -0.35 -0.14 0.00 0.00 0.00 0.00 46.02 45.36 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 0.21 1.04 0.08 1.61 1.51 -1.26 -1.05 117.35 119.49 2da0 s TYR 15 Ca 0.00 -0.67 -0.13 0.00 -1.01 0.00 0.00 57.07 55.26 2da0 s TYR 15 Cb 0.00 -0.57 0.02 0.00 -0.11 0.00 0.00 41.96 41.30 2da0 s TYR 15 CO 0.00 -0.01 0.30 -0.51 -1.11 0.00 0.00 175.55 174.22 2da0 s LEU 16 N -2.47 0.90 -0.07 -1.29 1.43 0.42 -4.80 118.68 112.80 2da0 s LEU 16 Ca 0.05 -0.37 -0.18 0.00 -1.03 0.00 0.00 54.13 52.60 2da0 s LEU 16 Cb -0.02 1.41 -0.05 0.00 0.03 0.00 0.00 46.19 47.55 2da0 s LEU 16 CO -0.00 -0.72 0.49 -0.76 0.23 0.00 0.00 176.35 175.58 2da0 s LEU 17 N -2.54 4.35 -0.09 1.79 1.43 -0.97 -0.01 118.68 122.63 2da0 s LEU 17 Ca 0.01 0.92 0.04 0.00 -1.03 0.00 0.00 54.13 54.07 2da0 s LEU 17 Cb 0.02 -2.73 0.00 0.00 0.03 0.00 0.00 46.19 43.51 2da0 s LEU 17 CO -0.08 0.09 -0.21 -0.75 0.23 0.00 0.00 176.35 175.62 2da0 s LYS 18 N 0.11 2.72 0.00 1.70 2.20 -0.99 -1.46 119.74 124.02 2da0 s LYS 18 Ca 0.27 -0.77 -0.30 0.00 -0.36 0.00 0.00 55.97 54.81 2da0 s LYS 18 Cb -0.16 -2.08 -0.03 0.00 -1.51 0.00 0.00 37.83 34.04 2da0 s LYS 18 CO 0.12 0.14 1.01 0.21 -0.36 0.00 0.00 175.35 176.47 2da0 s LYS 19 N 0.43 4.54 0.73 4.03 2.20 -1.05 -2.39 119.74 128.23 2da0 s LYS 19 Ca -0.18 1.47 -0.12 0.00 -0.36 0.00 0.00 55.97 56.78 2da0 s LYS 19 Cb -0.17 -3.45 0.19 0.00 -1.51 0.00 0.00 37.83 32.88 2da0 s LYS 19 CO 0.08 -0.09 0.42 0.45 -0.36 0.00 0.00 175.35 175.85 2da0 n SER 20 N 3.95 -3.05 -3.10 1.43 2.88 -1.01 -4.84 113.62 109.89 2da0 n SER 20 Ca 0.07 -0.43 -0.16 0.00 -1.33 0.00 0.00 58.87 57.02 2da0 n SER 20 Cb 0.50 -0.50 0.15 0.00 -0.75 0.00 0.00 64.21 63.61 2da0 n SER 20 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 2da0 n ASP 21 N -4.24 -2.78 -1.40 -3.46 9.92 -1.26 -4.32 116.55 109.02 2da0 n ASP 21 Ca 0.07 -0.54 -0.02 0.00 -0.53 0.00 0.00 54.79 53.77 2da0 n ASP 21 Cb 0.29 -0.51 0.01 0.00 -0.64 0.00 0.00 41.12 40.27 2da0 n ASP 21 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2da0 n GLY 22 N -2.58 2.54 0.57 0.44 0.00 -1.26 -2.10 105.19 102.79 2da0 n GLY 22 Ca 0.07 -0.12 -0.01 0.00 0.00 0.00 0.00 46.02 45.96 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 1.05 0.06 0.00 -0.61 2.08 -1.26 -4.89 119.36 115.79 2da0 n ILE 23 Ca 0.04 -0.02 0.00 0.00 0.56 0.00 0.00 62.75 63.33 2da0 n ILE 23 Cb 0.53 -1.10 0.00 0.00 -0.75 0.00 0.00 39.64 38.32 2da0 n ILE 23 CO 0.00 0.00 0.00 0.54 0.56 0.00 0.00 176.55 177.65 2da0 n ARG 24 N -2.83 1.55 -4.15 0.38 1.74 -1.24 -5.03 116.66 107.08 2da0 n ARG 24 Ca -0.02 0.00 -0.32 0.00 -0.77 0.00 0.00 57.85 56.74 2da0 n ARG 24 Cb 0.52 -0.97 -0.07 0.00 -1.02 0.00 0.00 32.46 30.92 2da0 n ARG 24 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2da0 n LYS 25 N -1.57 -0.80 -3.54 5.56 5.02 -0.89 -4.89 118.16 117.05 2da0 n LYS 25 Ca 0.00 0.07 -0.37 0.00 -2.02 0.00 0.00 58.31 55.99 2da0 n LYS 25 Cb 0.16 -3.06 -0.07 0.00 -0.02 0.00 0.00 35.03 32.05 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 -4.15 5.25 -0.52 -0.18 -7.23 -1.26 -4.59 120.40 107.72 2da0 s VAL 26 Ca 0.09 0.62 -0.28 0.00 -1.81 0.00 0.00 61.98 60.61 2da0 s VAL 26 Cb -0.05 -3.65 0.01 0.00 0.56 0.00 0.00 36.38 33.25 2da0 s VAL 26 CO 0.91 0.45 1.45 0.26 -0.31 0.00 0.00 175.10 177.87 2da0 s TRP 27 N -0.01 2.25 -0.14 2.82 0.52 -1.26 -2.40 118.94 120.72 2da0 s TRP 27 Ca 0.19 0.54 0.01 0.00 0.02 0.00 0.00 56.10 56.86 2da0 s TRP 27 Cb -0.14 -4.35 -0.01 0.00 -1.15 0.00 0.00 33.47 27.83 2da0 s TRP 27 CO 0.07 -2.03 -0.15 -0.65 0.02 0.00 0.00 176.95 174.20 2da0 s GLN 28 N 5.47 3.26 0.24 4.98 -1.52 -1.00 -4.91 119.66 126.18 2da0 s GLN 28 Ca 0.56 -0.74 -0.31 0.00 -1.95 0.00 0.00 55.36 52.92 2da0 s GLN 28 Cb -0.12 -2.59 -0.13 0.00 -0.22 0.00 0.00 33.01 29.95 2da0 s GLN 28 CO 0.27 0.11 1.51 -2.13 -0.25 0.00 0.00 175.29 174.79 2da0 n ARG 29 N 3.80 2.30 -3.95 2.91 0.63 -1.26 -2.35 116.66 118.74 2da0 n ARG 29 Ca -0.19 0.82 -0.15 0.00 -0.92 0.00 0.00 57.85 57.42 2da0 n ARG 29 Cb 0.52 -2.54 -0.15 0.00 0.45 0.00 0.00 32.46 30.74 2da0 n ARG 29 CO 0.00 0.00 0.00 1.03 -2.51 0.00 0.00 177.63 176.15 2da0 s ARG 30 N -0.15 0.18 -0.11 -0.14 1.81 0.99 -4.91 118.95 116.61 2da0 s ARG 30 Ca 0.69 -0.01 -0.29 0.00 -1.72 0.00 0.00 55.73 54.40 2da0 s ARG 30 Cb -0.60 -0.25 -0.03 0.00 -0.45 0.00 0.00 34.95 33.62 2da0 s ARG 30 CO 0.46 -0.02 1.47 0.21 -0.68 0.00 0.00 175.30 176.74 2da0 s LYS 31 N 0.34 4.19 0.29 3.54 2.36 -1.26 -0.44 119.74 128.77 2da0 s LYS 31 Ca -0.03 1.92 0.10 0.00 -2.55 0.00 0.00 55.97 55.41 2da0 s LYS 31 Cb -0.05 -3.89 -0.05 0.00 -1.05 0.00 0.00 37.83 32.79 2da0 s LYS 31 CO -0.01 -0.80 -0.07 0.00 1.55 0.00 0.00 175.35 176.02 2da0 s SER 33 N -3.63 -0.57 -0.12 0.00 0.01 -1.13 -1.70 113.70 106.56 2da0 s SER 33 Ca 0.32 0.65 -0.04 0.00 1.31 0.00 0.00 55.95 58.19 2da0 s SER 33 Cb -0.04 0.57 0.05 0.00 0.21 0.00 0.00 66.02 66.81 2da0 s SER 33 CO 0.18 -0.54 0.09 -0.69 0.41 0.00 0.00 173.24 172.69 2da0 s VAL 34 N -1.07 -0.11 -0.18 3.43 1.01 0.60 -1.84 120.40 122.24 2da0 s VAL 34 Ca -0.10 0.06 -0.14 0.00 0.00 0.00 0.00 61.98 61.80 2da0 s VAL 34 Cb -0.01 -0.42 0.05 0.00 0.00 0.00 0.00 36.38 35.99 2da0 s VAL 34 CO 0.08 -0.11 0.45 -1.59 0.00 0.00 0.00 175.10 173.94 2da0 s LYS 35 N 2.16 0.49 -1.60 2.72 -2.85 -0.85 -0.50 119.74 119.32 2da0 s LYS 35 Ca 0.03 0.71 0.00 0.00 -1.00 0.00 0.00 55.97 55.72 2da0 s LYS 35 Cb -0.14 0.16 0.00 0.00 -2.06 0.00 0.00 37.83 35.79 2da0 s LYS 35 CO -0.07 -0.10 0.00 0.09 0.10 0.00 0.00 175.35 175.37 2da0 n ASN 36 N 3.37 -5.08 -1.34 0.03 3.02 -1.26 -2.17 115.26 111.83 2da0 n ASN 36 Ca -0.17 0.14 -0.08 0.00 -0.03 0.00 0.00 54.58 54.43 2da0 n ASN 36 Cb 0.56 -4.14 0.02 0.00 -0.61 0.00 0.00 39.78 35.61 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 -0.96 0.26 2.85 7.41 0.00 -1.26 -4.97 105.19 108.51 2da0 n GLY 37 Ca -0.19 -0.42 -0.17 0.00 0.00 0.00 0.00 46.02 45.23 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 -2.82 0.24 -0.47 -0.61 -1.09 -0.92 -0.85 121.20 114.67 2da0 s ILE 38 Ca 0.13 0.01 -0.11 0.00 -2.23 0.00 0.00 60.65 58.46 2da0 s ILE 38 Cb -0.06 -0.30 0.11 0.00 -1.58 0.00 0.00 42.46 40.63 2da0 s ILE 38 CO 0.16 0.14 0.36 -0.22 -1.23 0.00 0.00 174.94 174.15 2da0 s LEU 39 N 0.80 5.68 0.02 2.97 2.96 -0.52 -2.00 118.68 128.59 2da0 s LEU 39 Ca -0.08 -1.79 -0.24 0.00 -0.22 0.00 0.00 54.13 51.79 2da0 s LEU 39 Cb -0.12 -2.05 -0.05 0.00 0.50 0.00 0.00 46.19 44.48 2da0 s LEU 39 CO -0.01 -0.69 0.74 -0.89 -1.32 0.00 0.00 176.35 174.18 2da0 s THR 40 N 1.42 4.80 -0.20 3.68 2.01 -0.77 -1.69 115.64 124.91 2da0 s THR 40 Ca 0.05 1.57 0.01 0.00 0.31 0.00 0.00 61.69 63.63 2da0 s THR 40 Cb -0.26 -4.09 0.04 0.00 0.01 0.00 0.00 72.50 68.20 2da0 s THR 40 CO 0.01 0.35 -0.13 -0.63 -0.69 0.00 0.00 174.62 173.52 2da0 s ILE 41 N 0.09 1.82 -0.29 1.82 1.01 0.20 -2.84 121.20 123.00 2da0 s ILE 41 Ca 0.38 -1.06 -0.29 0.00 0.00 0.00 0.00 60.65 59.68 2da0 s ILE 41 Cb -0.20 -1.82 -0.01 0.00 0.01 0.00 0.00 42.46 40.45 2da0 s ILE 41 CO 0.22 0.25 1.41 -0.55 0.00 0.00 0.00 174.94 176.26 2da0 s SER 42 N 1.33 6.53 0.14 3.58 0.15 -1.20 -0.69 113.70 123.54 2da0 s SER 42 Ca -0.01 1.27 0.02 0.00 0.70 0.00 0.00 55.95 57.93 2da0 s SER 42 Cb -0.16 -2.54 -0.04 0.00 -1.71 0.00 0.00 66.02 61.58 2da0 s SER 42 CO -0.09 -1.19 0.28 -1.00 1.20 0.00 0.00 173.24 172.45 2da0 s HIS 43 N 4.78 3.49 -0.02 3.44 3.76 -1.26 -4.72 115.29 124.76 2da0 s HIS 43 Ca 0.61 0.17 -0.16 0.00 -0.15 0.00 0.00 55.06 55.54 2da0 s HIS 43 Cb -0.19 -1.71 -0.33 0.00 1.11 0.00 0.00 32.58 31.47 2da0 s HIS 43 CO 0.26 0.52 0.83 0.00 -0.85 0.00 0.00 174.74 175.50 2da0 h ALA 44 N 2.33 -0.03 -3.78 -1.40 0.00 -1.98 -3.44 119.26 110.96 2da0 h ALA 44 Ca -0.48 -0.93 -0.66 0.00 0.00 0.00 0.00 54.91 52.84 2da0 h ALA 44 Cb 1.19 0.28 -0.37 0.00 0.00 0.00 0.00 17.79 18.88 2da0 h ALA 44 CO 0.70 0.73 -0.80 0.99 0.00 0.00 0.00 179.25 180.87 2da0 s THR 45 N -2.54 2.07 0.23 0.00 2.01 -1.26 -5.08 115.64 111.06 2da0 s THR 45 Ca -0.13 -1.53 -0.15 0.00 0.31 0.00 0.00 61.69 60.19 2da0 s THR 45 Cb 0.04 -2.18 0.05 0.00 0.01 0.00 0.00 72.50 70.42 2da0 s THR 45 CO 0.88 -0.00 0.74 -0.24 -0.69 0.00 0.00 174.62 175.30 2da0 n SER 46 N 4.48 -1.61 -3.29 3.53 2.88 -1.26 -5.04 113.62 113.30 2da0 n SER 46 Ca -0.14 -1.99 -0.38 0.00 -1.33 0.00 0.00 58.87 55.02 2da0 n SER 46 Cb 0.43 2.66 -0.03 0.00 -0.75 0.00 0.00 64.21 66.51 2da0 n SER 46 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 2da0 n ASN 47 N -1.29 8.59 -4.04 -3.46 4.13 -1.26 -4.60 115.26 113.33 2da0 n ASN 47 Ca -0.04 -2.64 -0.29 0.00 1.68 0.00 0.00 54.58 53.29 2da0 n ASN 47 Cb 0.47 -1.53 -0.03 0.00 -1.54 0.00 0.00 39.78 37.15 2da0 n ASN 47 CO 0.00 0.00 0.00 0.54 0.28 0.00 0.00 177.26 178.08 2da0 n ARG 48 N 3.32 -3.17 -3.64 3.52 1.74 -1.26 -4.94 116.66 112.23 2da0 n ARG 48 Ca 0.76 0.38 -0.03 0.00 -0.77 0.00 0.00 57.85 58.19 2da0 n ARG 48 Cb 0.25 -4.63 -0.07 0.00 -1.02 0.00 0.00 32.46 27.00 2da0 n ARG 48 CO 0.00 0.00 0.00 1.14 -1.52 0.00 0.00 177.63 177.25 2da0 s GLN 49 N -6.70 0.36 0.00 5.56 -2.07 -1.26 -5.18 119.66 110.36 2da0 s GLN 49 Ca 0.20 0.56 0.00 0.00 -1.82 0.00 0.00 55.36 54.30 2da0 s GLN 49 Cb -0.11 0.10 0.00 0.00 -1.09 0.00 0.00 33.01 31.91 2da0 s GLN 49 CO 0.90 -0.07 0.00 -0.35 -1.32 0.00 0.00 175.29 174.46 2da0 n PRO 50 N 3.21 -0.63 -4.01 9.60 -0.04 -1.26 -4.83 135.00 137.03 2da0 n PRO 50 Ca -0.17 0.00 -0.34 0.00 -0.04 0.00 0.00 63.50 62.95 2da0 n PRO 50 Cb 0.57 0.00 -0.15 0.00 -0.04 0.00 0.00 33.50 33.88 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 -2.98 2.58 -0.05 0.55 0.00 0.13 -4.91 121.76 117.09 2da0 s ALA 51 Ca 0.00 -1.26 -0.03 0.00 0.00 0.00 0.00 51.96 50.67 2da0 s ALA 51 Cb 0.00 -1.48 -0.04 0.00 0.00 0.00 0.00 23.12 21.61 2da0 s ALA 51 CO 0.00 -0.49 0.10 0.15 0.00 0.00 0.00 175.76 175.52 2da0 s LYS 52 N 1.36 3.20 -0.02 0.00 1.02 -1.26 0.59 119.74 124.64 2da0 s LYS 52 Ca 0.04 -0.36 0.05 0.00 0.02 0.00 0.00 55.97 55.72 2da0 s LYS 52 Cb -0.14 -2.97 -0.01 0.00 -0.52 0.00 0.00 37.83 34.19 2da0 s LYS 52 CO -0.08 0.69 -0.18 -0.51 -0.92 0.00 0.00 175.35 174.36 2da0 s LEU 53 N -1.46 2.02 -0.64 3.17 1.43 -0.68 -4.92 118.68 117.60 2da0 s LEU 53 Ca 0.20 -0.33 -0.26 0.00 -1.03 0.00 0.00 54.13 52.71 2da0 s LEU 53 Cb -0.12 -0.93 0.04 0.00 0.03 0.00 0.00 46.19 45.20 2da0 s LEU 53 CO 0.10 0.21 1.14 0.21 0.23 0.00 0.00 176.35 178.25 2da0 s ASN 54 N -0.35 6.29 0.00 2.29 2.47 -1.26 -1.44 114.94 122.94 2da0 s ASN 54 Ca 0.05 -0.31 0.05 0.00 0.42 0.00 0.00 52.86 53.07 2da0 s ASN 54 Cb -0.08 -2.51 0.19 0.00 -1.45 0.00 0.00 41.25 37.40 2da0 s ASN 54 CO -0.00 -1.55 1.14 0.18 -3.72 0.00 0.00 177.10 173.15 2da0 n LEU 55 N 8.46 0.00 0.08 3.21 4.32 -0.03 -1.15 117.00 131.89 2da0 n LEU 55 Ca 0.04 0.49 0.12 0.00 -0.02 0.00 0.00 56.01 56.65 2da0 n LEU 55 Cb 0.48 -0.49 0.46 0.00 -1.62 0.00 0.00 43.42 42.24 2da0 n LEU 55 CO 0.69 -0.42 0.88 0.18 -1.22 0.00 0.00 177.39 177.50 2da0 n LEU 56 N -1.49 0.57 0.00 2.23 4.77 -1.26 -3.57 117.00 118.25 2da0 n LEU 56 Ca 0.01 0.58 0.00 0.00 -0.03 0.00 0.00 56.01 56.57 2da0 n LEU 56 Cb 0.05 -0.43 0.00 0.00 -2.33 0.00 0.00 43.42 40.72 2da0 n LEU 56 CO 0.04 -0.25 0.07 0.35 -1.33 0.00 0.00 177.39 176.27 2da0 n THR 57 N -2.06 0.00 -2.44 -5.08 -2.24 -0.30 -5.08 114.28 97.07 2da0 n THR 57 Ca 0.05 -0.14 -0.39 0.00 -2.27 0.00 0.00 64.05 61.30 2da0 n THR 57 Cb 0.35 1.70 -0.04 0.00 -2.10 0.00 0.00 70.33 70.23 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 -1.80 3.07 -0.66 0.00 2.00 -0.77 -4.96 119.66 116.54 2da0 s GLN 59 Ca 0.49 -0.85 -0.19 0.00 -2.00 0.00 0.00 55.36 52.82 2da0 s GLN 59 Cb -0.30 -3.16 0.11 0.00 0.80 0.00 0.00 33.01 30.46 2da0 s GLN 59 CO 0.39 -0.37 0.79 0.08 -0.50 0.00 0.00 175.29 175.67 2da0 s VAL 60 N 1.43 4.83 -0.64 1.34 1.01 -1.26 -1.55 120.40 125.56 2da0 s VAL 60 Ca 0.02 -1.14 -0.10 0.00 0.00 0.00 0.00 61.98 60.76 2da0 s VAL 60 Cb -0.16 -4.55 0.16 0.00 0.00 0.00 0.00 36.38 31.83 2da0 s VAL 60 CO -0.01 -1.20 0.53 -0.54 0.00 0.00 0.00 175.10 173.88 2da0 s LYS 61 N 2.60 2.96 0.44 2.72 1.02 -0.31 -4.96 119.74 124.21 2da0 s LYS 61 Ca 0.16 -2.17 -0.24 0.00 0.02 0.00 0.00 55.97 53.75 2da0 s LYS 61 Cb -0.20 -4.11 -0.08 0.00 -0.52 0.00 0.00 37.83 32.93 2da0 s LYS 61 CO 0.03 -1.24 1.17 -1.25 -0.92 0.00 0.00 175.35 173.14 2da0 s PRO 62 N 0.67 3.83 0.72 -1.68 0.04 -1.26 -0.30 135.00 137.02 2da0 s PRO 62 Ca 0.12 1.80 -0.14 0.00 0.04 0.00 0.00 61.00 62.82 2da0 s PRO 62 Cb -0.20 -2.48 0.03 0.00 0.04 0.00 0.00 34.50 31.89 2da0 s PRO 62 CO -0.04 -0.50 1.15 -0.80 0.04 0.00 0.00 177.00 176.85 2da0 s ASN 63 N -1.29 4.53 -0.04 6.66 0.01 0.17 -4.88 114.94 120.10 2da0 s ASN 63 Ca 0.62 2.12 -0.02 0.00 -0.71 0.00 0.00 52.86 54.88 2da0 s ASN 63 Cb -0.29 -2.56 -0.02 0.00 0.41 0.00 0.00 41.25 38.78 2da0 s ASN 63 CO 0.36 -2.02 -0.05 0.00 -1.51 0.00 0.00 177.10 173.87 2da0 n ALA 64 N -2.79 2.53 0.24 0.60 0.00 -1.26 -4.56 120.51 115.26 2da0 n ALA 64 Ca 0.11 -0.18 0.11 0.00 0.00 0.00 0.00 53.44 53.49 2da0 n ALA 64 Cb 0.51 0.43 0.56 0.00 0.00 0.00 0.00 19.45 20.96 2da0 n ALA 64 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 2da0 h GLU 65 N -0.12 0.00 -3.54 0.00 4.11 -2.01 -3.42 114.58 109.60 2da0 h GLU 65 Ca -0.11 0.00 -0.40 0.00 0.07 0.00 0.00 59.36 58.92 2da0 h GLU 65 Cb 1.11 0.00 -0.38 0.00 0.50 0.00 0.00 28.75 29.98 2da0 h GLU 65 CO -0.06 0.18 -0.75 0.34 0.07 0.00 0.00 179.01 178.79 2da0 s ASP 66 N -6.14 1.26 0.90 3.06 2.15 -1.26 -5.15 116.67 111.48 2da0 s ASP 66 Ca -0.01 -0.01 -0.12 0.00 0.43 0.00 0.00 52.55 52.84 2da0 s ASP 66 Cb 0.11 -0.29 0.13 0.00 -0.30 0.00 0.00 42.92 42.57 2da0 s ASP 66 CO 0.61 -0.20 1.13 -0.75 -0.17 0.00 0.00 175.17 175.79 2da0 s LYS 67 N 1.93 1.25 -1.09 4.34 2.20 -1.26 -4.18 119.74 122.93 2da0 s LYS 67 Ca 0.03 0.33 -0.06 0.00 -0.36 0.00 0.00 55.97 55.91 2da0 s LYS 67 Cb -0.12 -1.85 0.01 0.00 -1.51 0.00 0.00 37.83 34.36 2da0 s LYS 67 CO -0.04 -2.13 0.95 1.63 -0.36 0.00 0.00 175.35 175.40 2da0 n LYS 68 N -3.73 -6.37 -3.57 4.03 5.02 -1.26 -5.01 118.16 107.28 2da0 n LYS 68 Ca 0.07 0.68 -0.17 0.00 -2.02 0.00 0.00 58.31 56.87 2da0 n LYS 68 Cb 0.59 -5.28 -0.07 0.00 -0.02 0.00 0.00 35.03 30.26 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 -3.41 -0.59 -0.13 4.39 0.15 -1.26 -3.12 113.70 109.73 2da0 s SER 69 Ca 0.40 0.68 -0.29 0.00 0.70 0.00 0.00 55.95 57.44 2da0 s SER 69 Cb -0.18 0.58 0.08 0.00 -1.71 0.00 0.00 66.02 64.80 2da0 s SER 69 CO 0.60 -0.55 0.75 0.72 1.20 0.00 0.00 173.24 175.96 2da0 s PHE 70 N -1.07 -0.64 -0.15 3.44 -0.71 -1.00 -0.65 117.98 117.20 2da0 s PHE 70 Ca -0.10 1.26 -0.02 0.00 -1.04 0.00 0.00 56.93 57.03 2da0 s PHE 70 Cb -0.01 0.38 -0.02 0.00 -1.21 0.00 0.00 43.02 42.16 2da0 s PHE 70 CO 0.08 -0.50 -0.09 -0.51 -1.34 0.00 0.00 175.22 172.87 2da0 s ASP 71 N -0.72 4.33 -0.44 1.98 1.01 0.59 -2.23 116.67 121.19 2da0 s ASP 71 Ca -0.06 -0.26 -0.14 0.00 0.71 0.00 0.00 52.55 52.80 2da0 s ASP 71 Cb -0.02 -1.69 0.06 0.00 1.01 0.00 0.00 42.92 42.29 2da0 s ASP 71 CO 0.06 0.15 0.33 -0.22 0.21 0.00 0.00 175.17 175.71 2da0 s LEU 72 N 0.43 5.35 -0.41 1.23 2.96 -1.05 -1.17 118.68 126.03 2da0 s LEU 72 Ca -0.07 -1.23 -0.18 0.00 -0.22 0.00 0.00 54.13 52.43 2da0 s LEU 72 Cb -0.15 -2.13 0.02 0.00 0.50 0.00 0.00 46.19 44.42 2da0 s LEU 72 CO 0.04 -0.56 0.49 -0.63 -1.32 0.00 0.00 176.35 174.36 2da0 s ILE 73 N 1.61 5.03 0.50 6.68 1.01 -0.60 -0.79 121.20 134.64 2da0 s ILE 73 Ca 0.04 -0.11 0.04 0.00 0.00 0.00 0.00 60.65 60.62 2da0 s ILE 73 Cb -0.22 -4.04 0.04 0.00 0.01 0.00 0.00 42.46 38.25 2da0 s ILE 73 CO 0.07 -0.40 0.37 -1.20 0.00 0.00 0.00 174.94 173.78 2da0 n SER 74 N 5.75 2.60 -3.75 3.58 7.64 0.19 -1.84 113.62 127.78 2da0 n SER 74 Ca -0.06 -2.72 -0.38 0.00 1.01 0.00 0.00 58.87 56.72 2da0 n SER 74 Cb 0.48 -0.04 -0.12 0.00 -1.01 0.00 0.00 64.21 63.52 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 -1.67 0.59 -4.15 1.43 -0.00 -1.26 0.45 115.22 110.61 2da0 n HIS 75 Ca -0.02 0.40 -0.30 0.00 0.46 0.00 0.00 57.72 58.25 2da0 n HIS 75 Cb 0.57 -1.99 -0.06 0.00 -0.12 0.00 0.00 29.99 28.39 2da0 n HIS 75 CO 0.00 0.00 0.00 -1.71 0.46 0.00 0.00 176.34 175.09 2da0 n ASN 76 N 8.29 -0.15 -3.63 0.26 2.85 -1.26 -4.94 115.26 116.68 2da0 n ASN 76 Ca 0.54 -1.18 -0.15 0.00 -0.11 0.00 0.00 54.58 53.68 2da0 n ASN 76 Cb 0.01 -2.17 -0.07 0.00 1.24 0.00 0.00 39.78 38.78 2da0 n ASN 76 CO 0.00 0.00 0.00 -0.13 -2.11 0.00 0.00 177.26 175.02 2da0 s ARG 77 N -7.05 0.82 -0.22 1.20 0.52 0.17 -5.14 118.95 109.24 2da0 s ARG 77 Ca 0.06 0.73 -0.01 0.00 -0.52 0.00 0.00 55.73 56.00 2da0 s ARG 77 Cb -0.03 0.39 0.06 0.00 0.52 0.00 0.00 34.95 35.90 2da0 s ARG 77 CO 0.95 -0.14 -0.02 0.99 0.02 0.00 0.00 175.30 177.10 2da0 s THR 78 N -0.03 1.16 0.36 0.02 2.01 -1.26 0.53 115.64 118.42 2da0 s THR 78 Ca -0.03 -1.00 0.03 0.00 0.31 0.00 0.00 61.69 61.00 2da0 s THR 78 Cb -0.04 -1.53 -0.01 0.00 0.01 0.00 0.00 72.50 70.93 2da0 s THR 78 CO 0.03 -0.16 0.53 -0.31 -0.69 0.00 0.00 174.62 174.01 2da0 s TYR 79 N 1.56 3.26 -0.23 4.92 2.02 0.03 -4.97 117.35 123.95 2da0 s TYR 79 Ca -0.04 0.04 -0.00 0.00 -0.37 0.00 0.00 57.07 56.70 2da0 s TYR 79 Cb -0.18 -2.01 0.06 0.00 -0.40 0.00 0.00 41.96 39.43 2da0 s TYR 79 CO -0.07 -0.03 -0.02 -1.01 -1.57 0.00 0.00 175.55 172.86 2da0 s HIS 80 N -2.28 2.02 0.16 2.71 3.76 -1.26 -2.53 115.29 117.86 2da0 s HIS 80 Ca 0.43 -1.55 0.10 0.00 -0.15 0.00 0.00 55.06 53.89 2da0 s HIS 80 Cb -0.10 -1.48 -0.04 0.00 1.11 0.00 0.00 32.58 32.07 2da0 s HIS 80 CO 0.34 -0.74 -0.18 -0.06 -0.85 0.00 0.00 174.74 173.24 2da0 s PHE 81 N 1.52 2.47 -0.04 1.40 0.08 -0.95 -2.52 117.98 119.95 2da0 s PHE 81 Ca -0.03 -0.29 -0.01 0.00 0.12 0.00 0.00 56.93 56.72 2da0 s PHE 81 Cb -0.18 -1.26 0.03 0.00 -0.57 0.00 0.00 43.02 41.03 2da0 s PHE 81 CO -0.08 0.45 0.08 -1.14 -0.10 0.00 0.00 175.22 174.42 2da0 s GLN 82 N -2.46 0.03 0.26 0.44 0.74 -0.53 -2.37 119.66 115.76 2da0 s GLN 82 Ca 0.20 0.24 -0.25 0.00 0.05 0.00 0.00 55.36 55.60 2da0 s GLN 82 Cb -0.09 -0.18 -0.09 0.00 1.10 0.00 0.00 33.01 33.75 2da0 s GLN 82 CO 0.11 -0.14 0.87 0.00 -0.55 0.00 0.00 175.29 175.58 2da0 s ALA 83 N 0.93 3.32 0.08 1.58 0.00 -1.18 -2.29 121.76 124.20 2da0 s ALA 83 Ca -0.07 0.44 -0.16 0.00 0.00 0.00 0.00 51.96 52.17 2da0 s ALA 83 Cb -0.10 -3.07 -0.11 0.00 0.00 0.00 0.00 23.12 19.83 2da0 s ALA 83 CO -0.04 0.23 1.36 0.93 0.00 0.00 0.00 175.76 178.25 2da0 h GLU 84 N 3.61 0.64 -4.62 0.00 5.08 -1.91 -3.46 114.58 113.91 2da0 h GLU 84 Ca -0.47 -0.38 -0.22 0.00 -1.00 0.00 0.00 59.36 57.30 2da0 h GLU 84 Cb 1.20 0.04 -0.15 0.00 0.50 0.00 0.00 28.75 30.33 2da0 h GLU 84 CO 0.66 0.99 -0.69 0.16 -1.00 0.00 0.00 179.01 179.13 2da0 s ASP 85 N -6.57 1.08 0.30 1.42 -4.77 -1.26 -5.03 116.67 101.83 2da0 s ASP 85 Ca -0.12 -1.01 0.05 0.00 -3.30 0.00 0.00 52.55 48.16 2da0 s ASP 85 Cb 0.08 0.11 0.73 0.00 -1.09 0.00 0.00 42.92 42.75 2da0 s ASP 85 CO 0.83 -0.48 1.76 -0.33 0.70 0.00 0.00 175.17 177.64 2da0 h GLU 86 N 2.97 0.65 -0.62 2.11 5.08 -1.99 0.28 114.58 123.05 2da0 h GLU 86 Ca -0.35 -0.04 0.06 0.00 -1.00 0.00 0.00 59.36 58.02 2da0 h GLU 86 Cb 1.16 -0.15 -0.04 0.00 0.50 0.00 0.00 28.75 30.23 2da0 h GLU 86 CO 0.65 0.43 0.41 1.96 -1.00 0.00 0.00 179.01 181.46 2da0 h GLN 87 N 0.67 0.62 0.01 2.33 1.08 -1.99 0.10 115.11 117.93 2da0 h GLN 87 Ca 0.57 -0.04 -0.23 0.00 -1.45 0.00 0.00 58.65 57.51 2da0 h GLN 87 Cb 0.94 -0.14 0.02 0.00 -0.05 0.00 0.00 27.48 28.25 2da0 h GLN 87 CO -0.42 0.41 -0.90 0.22 -0.95 0.00 0.00 178.83 177.19 2da0 h ASP 88 N 0.64 0.78 0.73 1.46 3.58 -0.91 -2.90 116.42 119.81 2da0 h ASP 88 Ca 0.26 -0.75 -0.04 0.00 0.42 0.00 0.00 57.03 56.93 2da0 h ASP 88 Cb 0.23 -0.24 0.01 0.00 1.72 0.00 0.00 39.33 41.05 2da0 h ASP 88 CO -0.08 1.43 -0.35 0.22 -2.88 0.00 0.00 179.24 177.58 2da0 h TYR 89 N 0.22 -0.91 -0.73 0.28 3.20 -0.61 0.84 116.97 119.27 2da0 h TYR 89 Ca -0.11 -0.02 0.16 0.00 3.14 0.00 0.00 58.73 61.89 2da0 h TYR 89 Cb 1.58 0.30 -0.11 0.00 1.54 0.00 0.00 36.73 40.04 2da0 h TYR 89 CO 0.12 -0.57 0.13 0.28 -1.64 0.00 0.00 178.16 176.49 2da0 h VAL 90 N -1.24 0.48 0.56 1.81 2.07 -0.97 -1.14 116.25 117.82 2da0 h VAL 90 Ca -0.10 -0.08 -0.03 0.00 0.82 0.00 0.00 66.70 67.32 2da0 h VAL 90 Cb 0.75 0.24 0.01 0.00 -1.52 0.00 0.00 31.29 30.76 2da0 h VAL 90 CO 0.16 0.04 -0.27 0.00 0.02 0.00 0.00 177.57 177.53 2da0 h ALA 91 N 1.62 -0.94 -0.98 1.67 0.00 -1.51 -2.28 119.26 116.84 2da0 h ALA 91 Ca 0.41 -0.16 0.09 0.00 0.00 0.00 0.00 54.91 55.24 2da0 h ALA 91 Cb 0.70 0.29 -0.12 0.00 0.00 0.00 0.00 17.79 18.67 2da0 h ALA 91 CO -0.54 -0.88 -0.57 0.91 0.00 0.00 0.00 179.25 178.17 2da0 n TRP 92 N -4.56 -0.42 -0.30 0.00 5.03 0.29 0.10 117.44 117.59 2da0 n TRP 92 Ca -0.09 1.23 0.12 0.00 3.03 0.00 0.00 57.50 61.78 2da0 n TRP 92 Cb 0.30 -0.59 0.36 0.00 -1.03 0.00 0.00 31.31 30.34 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 0.81 -0.62 -0.99 1.08 -1.29 0.12 117.51 116.63 2da0 h ILE 93 Ca 0.16 -0.25 -0.08 0.00 -0.39 0.00 0.00 64.86 64.30 2da0 h ILE 93 Cb 0.41 0.01 -0.02 0.00 -3.07 0.00 0.00 36.82 34.15 2da0 h ILE 93 CO -0.92 0.13 0.06 -1.28 -0.69 0.00 0.00 178.15 175.45 2da0 h SER 94 N 0.73 1.00 0.00 1.72 0.87 0.13 -2.82 113.55 115.19 2da0 h SER 94 Ca 0.48 -0.25 0.00 0.00 -1.23 0.00 0.00 61.79 60.79 2da0 h SER 94 Cb 0.75 -0.27 0.00 0.00 -0.44 0.00 0.00 62.40 62.45 2da0 h SER 94 CO -0.24 1.02 0.00 0.52 -0.53 0.00 0.00 176.83 177.60 2da0 n VAL 95 N -4.20 0.00 -0.25 2.23 0.31 0.41 -0.51 118.33 116.33 2da0 n VAL 95 Ca 0.04 0.66 0.23 0.00 -0.01 0.00 0.00 64.34 65.26 2da0 n VAL 95 Cb 0.31 -1.60 0.42 0.00 -0.91 0.00 0.00 33.84 32.06 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 -1.87 0.21 0.04 7.52 4.77 0.25 0.20 117.00 128.11 2da0 n LEU 96 Ca 0.00 1.07 -0.22 0.00 -0.03 0.00 0.00 56.01 56.83 2da0 n LEU 96 Cb 0.00 -0.52 -0.14 0.00 -2.33 0.00 0.00 43.42 40.42 2da0 n LEU 96 CO 0.00 -1.19 -0.37 0.74 -1.33 0.00 0.00 177.39 175.25 2da0 h THR 97 N 0.00 1.10 0.43 -5.08 2.02 -1.60 -3.32 112.91 106.47 2da0 h THR 97 Ca 0.58 -2.47 -0.02 0.00 0.77 0.00 0.00 66.41 65.28 2da0 h THR 97 Cb 1.64 2.82 -0.01 0.00 -1.74 0.00 0.00 68.15 70.87 2da0 h THR 97 CO -0.46 0.75 -0.31 0.78 0.37 0.00 0.00 175.52 176.65 2da0 h ASN 98 N -0.19 -0.80 -0.99 4.18 2.35 0.48 -2.53 115.58 118.08 2da0 h ASN 98 Ca -0.29 0.05 0.36 0.00 -0.55 0.00 0.00 56.30 55.87 2da0 h ASN 98 Cb 1.85 0.24 -0.17 0.00 0.05 0.00 0.00 38.32 40.30 2da0 h ASN 98 CO 0.12 -0.45 0.49 -1.28 -1.65 0.00 0.00 177.43 174.65 2da0 h SER 99 N -0.71 0.31 -0.76 5.81 0.87 -1.10 0.99 113.55 118.96 2da0 h SER 99 Ca -0.06 0.23 0.04 0.00 -1.23 0.00 0.00 61.79 60.77 2da0 h SER 99 Cb 0.58 0.24 -0.05 0.00 -0.44 0.00 0.00 62.40 62.73 2da0 h SER 99 CO 0.03 -0.30 0.47 0.50 -0.53 0.00 0.00 176.83 177.00 2da0 h LYS 100 N 0.14 0.88 0.00 2.24 3.11 -1.56 -0.53 116.57 120.85 2da0 h LYS 100 Ca 0.77 -0.05 -0.18 0.00 -2.81 0.00 0.00 60.65 58.37 2da0 h LYS 100 Cb 1.88 -0.20 -0.03 0.00 -1.00 0.00 0.00 32.23 32.88 2da0 h LYS 100 CO -0.71 0.58 -0.88 0.93 -2.81 0.00 0.00 179.45 176.56 2da0 h GLU 101 N 0.90 0.00 0.00 1.90 5.08 0.11 -2.63 114.58 119.95 2da0 h GLU 101 Ca 0.31 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.65 2da0 h GLU 101 Cb 0.06 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.31 2da0 h GLU 101 CO -0.13 0.88 -0.09 0.93 -1.00 0.00 0.00 179.01 179.60 2da0 h GLU 102 N 0.00 0.00 0.00 2.33 4.39 0.21 -0.66 114.58 120.85 2da0 h GLU 102 Ca -0.01 0.00 -0.18 0.00 0.34 0.00 0.00 59.36 59.51 2da0 h GLU 102 Cb 1.65 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 30.27 2da0 h GLU 102 CO 0.11 0.09 -1.84 0.00 -1.16 0.00 0.00 179.01 176.21 2da0 n ALA 103 N -2.15 2.03 0.02 3.43 0.00 -0.27 -4.07 120.51 119.51 2da0 n ALA 103 Ca 0.00 -0.77 -0.20 0.00 0.00 0.00 0.00 53.44 52.48 2da0 n ALA 103 Cb 0.36 -0.68 -0.14 0.00 0.00 0.00 0.00 19.45 18.99 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 0.39 -2.94 0.00 3.38 -1.29 -2.85 115.31 112.01 2da0 h LEU 104 Ca -0.24 -0.92 0.00 0.00 0.09 0.00 0.00 57.88 56.81 2da0 h LEU 104 Cb 1.63 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 42.25 2da0 h LEU 104 CO 0.03 1.41 0.01 0.00 0.09 0.00 0.00 178.44 179.98 2da0 h THR 105 N -0.44 0.03 0.00 0.22 1.03 -1.33 0.92 112.91 113.35 2da0 h THR 105 Ca -0.17 0.00 0.00 0.00 -0.01 0.00 0.00 66.41 66.23 2da0 h THR 105 Cb 1.60 0.99 0.00 0.00 -1.07 0.00 0.00 68.15 69.67 2da0 h THR 105 CO 0.10 0.00 -1.16 1.15 -0.01 0.00 0.00 175.52 175.60 2da0 n MET 106 N -3.12 0.17 -3.47 0.00 0.00 -1.24 -4.96 117.12 104.50 2da0 n MET 106 Ca -0.03 -0.04 -0.21 0.00 0.00 0.00 0.00 57.70 57.43 2da0 n MET 106 Cb 0.08 -1.52 -0.02 0.00 0.00 0.00 0.00 33.22 31.77 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 -3.13 4.21 0.98 3.17 0.00 0.32 -5.10 121.76 122.21 2da0 s ALA 107 Ca 0.04 -1.82 -0.12 0.00 0.00 0.00 0.00 51.96 50.07 2da0 s ALA 107 Cb 0.15 -1.11 0.13 0.00 0.00 0.00 0.00 23.12 22.29 2da0 s ALA 107 CO 0.86 -0.29 0.82 1.97 0.00 0.00 0.00 175.76 179.11 2da0 n PHE 108 N -1.66 -0.31 -3.94 0.00 1.16 -1.26 -4.90 117.46 106.55 2da0 n PHE 108 Ca 0.05 0.25 -0.24 0.00 -1.87 0.00 0.00 57.45 55.64 2da0 n PHE 108 Cb 0.62 -1.86 -0.05 0.00 -1.61 0.00 0.00 39.48 36.58 2da0 n PHE 108 CO 0.00 0.00 0.00 -1.12 -1.87 0.00 0.00 176.76 173.77 2da0 s SER 109 N -2.36 4.64 0.00 5.98 0.01 -1.26 -4.95 113.70 115.75 2da0 s SER 109 Ca 0.63 -1.03 0.00 0.00 1.31 0.00 0.00 55.95 56.86 2da0 s SER 109 Cb -0.22 -0.31 0.00 0.00 0.21 0.00 0.00 66.02 65.71 2da0 s SER 109 CO 0.63 -0.69 0.00 0.61 0.41 0.00 0.00 173.24 174.19 2da0 n GLY 110 N -1.43 -0.30 0.19 3.44 0.00 -1.26 -4.93 105.19 100.91 2da0 n GLY 110 Ca -0.00 0.21 0.14 0.00 0.00 0.00 0.00 46.02 46.37 2da0 n GLY 110 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2da0 h PRO 111 N 0.00 0.00 -0.94 1.61 0.13 -1.93 -3.15 132.00 127.72 2da0 h PRO 111 Ca 0.00 0.00 0.15 0.00 -0.87 0.00 0.00 66.00 65.28 2da0 h PRO 111 Cb 0.00 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 31.03 2da0 h PRO 111 CO 0.00 0.00 0.55 0.66 -0.23 0.00 0.00 178.00 178.98 2da0 h SER 112 N 0.00 0.73 -3.30 1.44 4.64 -1.95 -3.21 113.55 111.90 2da0 h SER 112 Ca 0.00 0.08 -0.77 0.00 -0.47 0.00 0.00 61.79 60.63 2da0 h SER 112 Cb 0.41 -0.05 -0.25 0.00 -0.31 0.00 0.00 62.40 62.20 2da0 h SER 112 CO 0.00 0.32 0.52 -0.55 -0.87 0.00 0.00 176.83 176.25 2da0 s SER 113 N -5.50 7.03 0.00 4.97 0.15 -1.19 -5.26 113.70 113.90 2da0 s SER 113 Ca -0.12 -3.04 0.00 0.00 0.70 0.00 0.00 55.95 53.50 2da0 s SER 113 Cb 0.23 -2.26 0.00 0.00 -1.71 0.00 0.00 66.02 62.28 2da0 s SER 113 CO 0.80 -0.54 0.00 0.61 1.20 0.00 0.00 173.24 175.31