#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vae s SER 2 N 0.00 -0.37 -0.40 1.61 0.15 -1.26 -5.13 113.70 108.30 1vae s SER 2 Ca 0.00 0.43 -0.18 0.00 0.70 0.00 0.00 55.95 56.90 1vae s SER 2 Cb 0.00 0.34 0.01 0.00 -1.71 0.00 0.00 66.02 64.67 1vae s SER 2 CO 0.00 -0.32 0.48 -0.94 1.20 0.00 0.00 173.24 173.66 1vae s SER 3 N -0.99 6.24 -0.36 5.45 1.04 -1.26 -4.96 113.70 118.86 1vae s SER 3 Ca -0.01 -0.46 0.00 0.00 0.48 0.00 0.00 55.95 55.96 1vae s SER 3 Cb -0.01 -2.25 0.19 0.00 0.10 0.00 0.00 66.02 64.05 1vae s SER 3 CO 0.01 -0.58 0.80 -0.83 0.98 0.00 0.00 173.24 173.62 1vae s GLY 4 N 1.83 -1.33 0.40 7.32 0.00 -1.26 -5.03 107.32 109.25 1vae s GLY 4 Ca 0.15 0.82 0.00 0.00 0.00 0.00 0.00 44.72 45.69 1vae s GLY 4 CO 0.14 3.92 0.00 -1.26 0.00 0.00 0.00 173.10 175.90 1vae n SER 5 N 4.35 -2.88 -4.36 1.64 2.88 -1.26 -5.09 113.62 108.91 1vae n SER 5 Ca 0.08 0.76 -0.36 0.00 -1.33 0.00 0.00 58.87 58.02 1vae n SER 5 Cb 0.59 2.75 -0.13 0.00 -0.75 0.00 0.00 64.21 66.67 1vae n SER 5 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1vae s SER 6 N -2.98 4.80 -0.44 -3.46 1.04 -1.26 -5.07 113.70 106.33 1vae s SER 6 Ca 0.00 -0.45 -0.21 0.00 0.48 0.00 0.00 55.95 55.77 1vae s SER 6 Cb 0.00 -1.83 0.02 0.00 0.10 0.00 0.00 66.02 64.31 1vae s SER 6 CO 0.00 -0.08 0.66 -0.83 0.98 0.00 0.00 173.24 173.96 1vae s GLY 7 N 1.52 1.70 -0.27 7.32 0.00 -1.26 -4.54 107.32 111.79 1vae s GLY 7 Ca 0.05 -1.20 -0.04 0.00 0.00 0.00 0.00 44.72 43.52 1vae s GLY 7 CO 0.00 1.56 0.16 1.44 0.00 0.00 0.00 173.10 176.26 1vae n SER 8 N 6.31 -6.62 -4.44 1.64 7.64 -1.26 -5.07 113.62 111.81 1vae n SER 8 Ca -0.01 0.86 -0.22 0.00 1.01 0.00 0.00 58.87 60.51 1vae n SER 8 Cb 0.48 -4.36 -0.10 0.00 -1.01 0.00 0.00 64.21 59.21 1vae n SER 8 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1vae s ALA 9 N -1.61 2.40 0.46 -0.43 0.00 -1.26 -5.00 121.76 116.32 1vae s ALA 9 Ca 0.07 -1.95 0.00 0.00 0.00 0.00 0.00 51.96 50.08 1vae s ALA 9 Cb -0.02 0.25 0.00 0.00 0.00 0.00 0.00 23.12 23.35 1vae s ALA 9 CO 0.60 -0.10 0.00 0.45 0.00 0.00 0.00 175.76 176.71 1vae n SER 10 N -0.62 -7.48 -4.55 0.00 2.88 -1.26 -4.71 113.62 97.87 1vae n SER 10 Ca -0.05 1.02 -0.51 0.00 -1.33 0.00 0.00 58.87 57.99 1vae n SER 10 Cb 0.64 -4.21 -0.05 0.00 -0.75 0.00 0.00 64.21 59.84 1vae n SER 10 CO 0.00 0.00 0.00 2.29 -1.23 0.00 0.00 175.04 176.10 1vae n LYS 11 N -4.10 0.87 -4.07 -1.46 2.85 -1.26 -4.85 118.16 106.14 1vae n LYS 11 Ca -0.05 0.31 -0.28 0.00 -1.05 0.00 0.00 58.31 57.24 1vae n LYS 11 Cb 0.60 -1.81 -0.17 0.00 -0.65 0.00 0.00 35.03 33.01 1vae n LYS 11 CO 0.00 0.00 0.00 -0.98 -0.05 0.00 0.00 177.40 176.37 1vae s ARG 12 N -0.16 1.94 -0.11 -1.58 1.70 -1.26 -5.11 118.95 114.36 1vae s ARG 12 Ca 0.78 -0.43 -0.05 0.00 -0.47 0.00 0.00 55.73 55.57 1vae s ARG 12 Cb -0.95 -1.82 -0.04 0.00 -0.57 0.00 0.00 34.95 31.57 1vae s ARG 12 CO 0.52 -0.21 0.08 -1.58 -1.08 0.00 0.00 175.30 173.03 1vae s TRP 13 N 1.45 3.39 1.20 5.89 0.52 -1.26 -3.32 118.94 126.81 1vae s TRP 13 Ca 0.02 0.36 -0.20 0.00 0.02 0.00 0.00 56.10 56.30 1vae s TRP 13 Cb -0.13 -1.88 0.29 0.00 -1.15 0.00 0.00 33.47 30.60 1vae s TRP 13 CO -0.07 0.59 1.16 0.45 0.02 0.00 0.00 176.95 179.10 1vae s SER 14 N -0.90 0.95 0.48 2.95 0.15 -1.11 -5.01 113.70 111.22 1vae s SER 14 Ca 0.14 0.43 -0.20 0.00 0.70 0.00 0.00 55.95 57.01 1vae s SER 14 Cb -0.12 -0.53 -0.09 0.00 -1.71 0.00 0.00 66.02 63.58 1vae s SER 14 CO 0.03 -4.08 1.04 -2.16 1.20 0.00 0.00 173.24 169.26 1vae s PRO 15 N -5.60 3.83 0.24 5.44 0.04 -1.26 -4.70 135.00 132.99 1vae s PRO 15 Ca 0.73 1.37 -0.30 0.00 0.04 0.00 0.00 61.00 62.84 1vae s PRO 15 Cb -0.06 -2.12 -0.09 0.00 0.04 0.00 0.00 34.50 32.27 1vae s PRO 15 CO 0.55 -0.41 1.09 -1.25 0.04 0.00 0.00 177.00 177.03 1vae s PRO 16 N -3.19 4.64 0.51 0.56 0.04 -1.26 -4.62 135.00 131.68 1vae s PRO 16 Ca 0.67 1.76 -0.02 0.00 0.04 0.00 0.00 61.00 63.45 1vae s PRO 16 Cb -0.17 -3.22 0.01 0.00 0.04 0.00 0.00 34.50 31.16 1vae s PRO 16 CO 0.20 0.18 0.76 1.03 0.04 0.00 0.00 177.00 179.22 1vae s ARG 17 N -1.08 2.93 -0.40 4.56 0.52 -0.10 -4.87 118.95 120.52 1vae s ARG 17 Ca 0.46 -0.37 -0.01 0.00 -0.52 0.00 0.00 55.73 55.29 1vae s ARG 17 Cb -0.31 -2.45 0.11 0.00 0.52 0.00 0.00 34.95 32.82 1vae s ARG 17 CO 0.39 -0.48 0.17 0.20 0.02 0.00 0.00 175.30 175.59 1vae s GLY 18 N -4.28 1.99 0.14 -3.53 0.00 -1.26 -3.76 107.32 96.62 1vae s GLY 18 Ca 0.51 -2.56 -0.03 0.00 0.00 0.00 0.00 44.72 42.64 1vae s GLY 18 CO 0.40 1.01 0.34 -0.42 0.00 0.00 0.00 173.10 174.43 1vae s ILE 19 N 1.03 5.22 -0.16 0.90 1.01 0.11 -4.98 121.20 124.34 1vae s ILE 19 Ca 0.09 -0.16 -0.05 0.00 0.00 0.00 0.00 60.65 60.54 1vae s ILE 19 Cb -0.22 -3.65 0.06 0.00 0.01 0.00 0.00 42.46 38.66 1vae s ILE 19 CO -0.05 0.01 0.09 -1.38 0.00 0.00 0.00 174.94 173.60 1vae s HIS 20 N -1.68 0.20 0.34 3.97 -3.43 -1.26 -2.50 115.29 110.93 1vae s HIS 20 Ca 0.39 -0.28 -0.14 0.00 -0.80 0.00 0.00 55.06 54.23 1vae s HIS 20 Cb -0.12 -0.68 0.03 0.00 -1.43 0.00 0.00 32.58 30.38 1vae s HIS 20 CO 0.26 -0.49 0.69 -0.59 -2.00 0.00 0.00 174.74 172.61 1vae s PHE 21 N 2.13 0.25 -0.22 0.38 -0.71 -1.18 -4.72 117.98 113.91 1vae s PHE 21 Ca 0.02 -0.77 -0.02 0.00 -1.04 0.00 0.00 56.93 55.12 1vae s PHE 21 Cb -0.16 0.58 0.01 0.00 -1.21 0.00 0.00 43.02 42.24 1vae s PHE 21 CO -0.09 -1.36 -0.07 0.99 -1.34 0.00 0.00 175.22 173.35 1vae s THR 22 N -2.96 3.01 0.51 -4.49 2.01 -1.26 -1.35 115.64 111.10 1vae s THR 22 Ca 0.18 -0.73 -0.21 0.00 0.31 0.00 0.00 61.69 61.23 1vae s THR 22 Cb -0.04 -2.41 -0.08 0.00 0.01 0.00 0.00 72.50 69.98 1vae s THR 22 CO 0.12 0.37 0.96 0.52 -0.69 0.00 0.00 174.62 175.89 1vae n VAL 23 N 4.73 2.92 -3.84 3.82 0.31 -1.25 -4.80 118.33 120.22 1vae n VAL 23 Ca -0.18 -0.50 -0.36 0.00 -0.01 0.00 0.00 64.34 63.29 1vae n VAL 23 Cb 0.49 -1.13 -0.13 0.00 -0.91 0.00 0.00 33.84 32.17 1vae n VAL 23 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 1vae s GLU 24 N -2.32 2.46 -0.34 5.55 0.41 -1.26 -1.23 118.70 121.97 1vae s GLU 24 Ca 0.69 -1.29 -0.07 0.00 -0.41 0.00 0.00 54.97 53.89 1vae s GLU 24 Cb -0.49 -3.31 -0.22 0.00 -1.78 0.00 0.00 34.13 28.33 1vae s GLU 24 CO 0.53 -0.68 3.37 0.39 -0.49 0.00 0.00 175.26 178.38 1vae n GLU 25 N 4.68 2.27 0.00 1.61 1.02 -1.26 -3.10 120.64 125.86 1vae n GLU 25 Ca -0.12 -1.21 0.00 0.00 -0.02 0.00 0.00 57.16 55.81 1vae n GLU 25 Cb 0.44 -2.15 0.00 0.00 -0.02 0.00 0.00 31.44 29.71 1vae n GLU 25 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1vae n GLY 26 N 2.75 0.16 3.04 0.62 0.00 -1.26 -5.07 105.19 105.44 1vae n GLY 26 Ca 0.49 -0.09 -0.04 0.00 0.00 0.00 0.00 46.02 46.37 1vae n GLY 26 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1vae s ASP 27 N -1.01 -0.84 0.50 1.61 2.15 -1.18 -4.99 116.67 112.91 1vae s ASP 27 Ca 0.00 -1.12 0.21 0.00 0.43 0.00 0.00 52.55 52.07 1vae s ASP 27 Cb 0.00 1.59 1.31 0.00 -0.30 0.00 0.00 42.92 45.52 1vae s ASP 27 CO 0.00 -0.18 2.08 -0.07 -0.17 0.00 0.00 175.17 176.83 1vae h LEU 28 N 6.77 0.00 0.00 -1.34 3.38 -1.98 -3.43 115.31 118.71 1vae h LEU 28 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1vae h LEU 28 Cb 1.14 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.89 1vae h LEU 28 CO 0.12 0.11 0.00 0.61 0.09 0.00 0.00 178.44 179.37 1vae n GLY 29 N -1.04 1.04 3.62 0.83 0.00 -1.26 -4.37 105.19 104.01 1vae n GLY 29 Ca -0.02 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.91 1vae n GLY 29 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1vae s PHE 30 N -3.19 0.21 0.32 1.61 -0.12 -1.26 -1.68 117.98 113.86 1vae s PHE 30 Ca 0.00 -0.59 0.05 0.00 -0.05 0.00 0.00 56.93 56.34 1vae s PHE 30 Cb 0.00 0.29 -0.03 0.00 -0.63 0.00 0.00 43.02 42.65 1vae s PHE 30 CO 0.00 -1.01 0.21 -0.08 -0.05 0.00 0.00 175.22 174.29 1vae s THR 31 N -3.98 0.16 -0.04 -4.49 -1.32 -1.14 -4.96 115.64 99.86 1vae s THR 31 Ca 0.19 -2.00 0.07 0.00 -1.21 0.00 0.00 61.69 58.73 1vae s THR 31 Cb -0.01 -2.48 -0.01 0.00 -1.51 0.00 0.00 72.50 68.48 1vae s THR 31 CO 0.07 0.00 -0.25 -0.76 -2.21 0.00 0.00 174.62 171.47 1vae s LEU 32 N -3.38 2.05 0.09 9.08 1.43 -1.26 -1.74 118.68 124.95 1vae s LEU 32 Ca 0.37 -0.47 0.01 0.00 -1.03 0.00 0.00 54.13 53.01 1vae s LEU 32 Cb 0.04 -1.31 -0.04 0.00 0.03 0.00 0.00 46.19 44.91 1vae s LEU 32 CO 0.21 0.27 -0.06 0.00 0.23 0.00 0.00 176.35 177.01 1vae s ARG 33 N -0.36 0.79 0.54 1.70 1.70 -1.25 -4.96 118.95 117.12 1vae s ARG 33 Ca 0.03 -1.31 0.00 0.00 -0.47 0.00 0.00 55.73 53.97 1vae s ARG 33 Cb -0.12 -0.13 0.00 0.00 -0.57 0.00 0.00 34.95 34.13 1vae s ARG 33 CO 0.01 -0.03 0.00 0.41 -1.08 0.00 0.00 175.30 174.61 1vae n GLY 34 N -0.02 -1.75 0.34 3.88 0.00 -1.26 -2.51 105.19 103.87 1vae n GLY 34 Ca -0.12 -1.82 0.00 0.00 0.00 0.00 0.00 46.02 44.08 1vae n GLY 34 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1vae n ASN 35 N 0.01 0.00 -3.65 1.61 6.94 -1.26 -4.66 115.26 114.26 1vae n ASN 35 Ca 0.00 0.00 -0.04 0.00 -0.02 0.00 0.00 54.58 54.52 1vae n ASN 35 Cb 0.00 -0.21 -0.07 0.00 -2.36 0.00 0.00 39.78 37.14 1vae n ASN 35 CO 0.00 0.00 0.00 0.28 -1.03 0.00 0.00 177.26 176.51 1vae s THR 36 N -0.76 0.00 0.11 5.53 -1.32 -1.26 -3.97 115.64 113.97 1vae s THR 36 Ca 0.00 0.00 -0.30 0.00 -1.21 0.00 0.00 61.69 60.18 1vae s THR 36 Cb 0.00 -1.00 -0.06 0.00 -1.51 0.00 0.00 72.50 69.93 1vae s THR 36 CO 0.00 0.00 1.15 -2.16 -2.21 0.00 0.00 174.62 171.40 1vae s PRO 37 N 0.23 4.50 0.94 7.08 0.04 -1.24 -5.03 135.00 141.53 1vae s PRO 37 Ca 0.04 1.73 -0.14 0.00 0.04 0.00 0.00 61.00 62.67 1vae s PRO 37 Cb -0.05 -3.32 -0.00 0.00 0.04 0.00 0.00 34.50 31.17 1vae s PRO 37 CO -0.12 -0.11 0.19 1.33 0.04 0.00 0.00 177.00 178.32 1vae n VAL 38 N 3.27 0.12 -4.23 -0.36 0.24 -1.25 -4.75 118.33 111.36 1vae n VAL 38 Ca 0.06 -0.26 -0.29 0.00 -2.04 0.00 0.00 64.34 61.81 1vae n VAL 38 Cb 0.47 -0.51 -0.03 0.00 -1.47 0.00 0.00 33.84 32.30 1vae n VAL 38 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1vae n GLN 39 N -0.84 0.70 -4.04 7.34 6.02 -1.04 -2.50 117.38 123.02 1vae n GLN 39 Ca 0.05 -3.58 -0.32 0.00 -0.01 0.00 0.00 57.00 53.14 1vae n GLN 39 Cb 0.54 0.62 -0.15 0.00 1.02 0.00 0.00 30.24 32.27 1vae n GLN 39 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1vae s VAL 40 N -2.80 2.31 -0.96 5.09 1.01 0.27 -3.88 120.40 121.45 1vae s VAL 40 Ca 0.19 -1.74 -0.12 0.00 0.00 0.00 0.00 61.98 60.32 1vae s VAL 40 Cb -0.02 -2.42 0.24 0.00 0.00 0.00 0.00 36.38 34.18 1vae s VAL 40 CO 0.12 -0.15 0.93 -2.28 0.00 0.00 0.00 175.10 173.72 1vae s HIS 41 N 1.09 3.98 0.26 5.22 2.46 -0.71 -2.94 115.29 124.64 1vae s HIS 41 Ca -0.05 -2.30 -0.31 0.00 0.47 0.00 0.00 55.06 52.88 1vae s HIS 41 Cb -0.20 -3.84 -0.13 0.00 -0.13 0.00 0.00 32.58 28.29 1vae s HIS 41 CO -0.05 -0.98 1.47 1.19 -2.47 0.00 0.00 174.74 173.90 1vae n PHE 42 N 3.45 2.41 -0.03 3.88 3.72 -1.26 -2.88 117.46 126.75 1vae n PHE 42 Ca 0.19 0.37 -0.06 0.00 -0.05 0.00 0.00 57.45 57.90 1vae n PHE 42 Cb 0.44 -2.51 -0.02 0.00 -0.94 0.00 0.00 39.48 36.44 1vae n PHE 42 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 1vae n LEU 43 N 2.13 1.39 -4.59 4.37 4.77 -0.70 -4.97 117.00 119.39 1vae n LEU 43 Ca 0.10 0.04 -0.36 0.00 -0.03 0.00 0.00 56.01 55.77 1vae n LEU 43 Cb 0.33 -0.20 -0.10 0.00 -2.33 0.00 0.00 43.42 41.12 1vae n LEU 43 CO 0.63 0.31 -0.24 -1.81 -1.33 0.00 0.00 177.39 174.95 1vae s ASP 44 N -5.21 5.63 0.00 -1.43 1.11 -0.68 -4.96 116.67 111.13 1vae s ASP 44 Ca -0.09 0.01 0.23 0.00 0.18 0.00 0.00 52.55 52.89 1vae s ASP 44 Cb 0.03 -1.99 1.25 0.00 1.07 0.00 0.00 42.92 43.28 1vae s ASP 44 CO 0.12 0.09 1.76 -0.81 1.18 0.00 0.00 175.17 177.52 1vae n PRO 45 N 4.09 0.47 -3.16 8.23 -0.04 -1.26 -3.54 135.00 139.79 1vae n PRO 45 Ca -0.16 0.05 -0.22 0.00 -0.04 0.00 0.00 63.50 63.12 1vae n PRO 45 Cb 0.52 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.43 1vae n PRO 45 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 1vae n HIS 46 N -1.19 1.36 -4.47 0.54 8.25 -1.26 -4.85 115.22 113.61 1vae n HIS 46 Ca 0.13 -3.84 -0.25 0.00 -0.26 0.00 0.00 57.72 53.50 1vae n HIS 46 Cb 0.15 -0.44 -0.10 0.00 1.12 0.00 0.00 29.99 30.72 1vae n HIS 46 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1vae h SER 48 N 2.09 -1.26 -0.28 0.00 0.02 -1.88 0.79 113.55 113.03 1vae h SER 48 Ca -0.41 0.14 0.03 0.00 -0.84 0.00 0.00 61.79 60.70 1vae h SER 48 Cb 1.25 0.47 -0.04 0.00 0.14 0.00 0.00 62.40 64.23 1vae h SER 48 CO 0.65 -0.40 -0.18 0.00 -1.14 0.00 0.00 176.83 175.76 1vae h ALA 49 N -0.70 -0.19 -0.40 3.77 0.00 -1.89 0.98 119.26 120.82 1vae h ALA 49 Ca 0.01 0.03 0.08 0.00 0.00 0.00 0.00 54.91 55.03 1vae h ALA 49 Cb 0.56 1.09 -0.09 0.00 0.00 0.00 0.00 17.79 19.34 1vae h ALA 49 CO -0.26 -0.32 -0.30 1.03 0.00 0.00 0.00 179.25 179.40 1vae h SER 50 N -0.01 -1.01 -0.61 0.00 0.87 -1.79 0.96 113.55 111.96 1vae h SER 50 Ca 0.05 0.19 0.18 0.00 -1.23 0.00 0.00 61.79 60.97 1vae h SER 50 Cb 0.13 0.48 -0.02 0.00 -0.44 0.00 0.00 62.40 62.55 1vae h SER 50 CO -0.27 -0.31 0.54 -0.07 -0.53 0.00 0.00 176.83 176.19 1vae h LEU 51 N -0.23 0.00 0.01 2.23 3.38 0.30 0.23 115.31 121.23 1vae h LEU 51 Ca 0.18 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.15 1vae h LEU 51 Cb 0.52 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.27 1vae h LEU 51 CO -0.53 0.00 -0.01 0.00 0.09 0.00 0.00 178.44 177.99 1vae h ALA 52 N 1.50 -0.02 0.00 1.53 0.00 0.87 -3.47 119.26 119.67 1vae h ALA 52 Ca 0.29 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1vae h ALA 52 Cb 1.37 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.17 1vae h ALA 52 CO -0.00 -0.35 0.00 0.41 0.00 0.00 0.00 179.25 179.31 1vae n GLY 53 N -0.24 0.23 3.87 0.00 0.00 0.81 -4.72 105.19 105.14 1vae n GLY 53 Ca -0.08 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.73 1vae n GLY 53 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vae s ALA 54 N -0.29 3.92 0.23 4.61 0.00 -1.22 -4.97 121.76 124.03 1vae s ALA 54 Ca 0.00 -1.68 0.01 0.00 0.00 0.00 0.00 51.96 50.29 1vae s ALA 54 Cb 0.00 -1.19 -0.05 0.00 0.00 0.00 0.00 23.12 21.88 1vae s ALA 54 CO 0.00 -0.04 0.08 -1.59 0.00 0.00 0.00 175.76 174.21 1vae s LYS 55 N -4.04 1.30 0.61 0.00 -2.85 -1.26 -4.76 119.74 108.74 1vae s LYS 55 Ca 0.43 -1.69 -0.15 0.00 -1.00 0.00 0.00 55.97 53.57 1vae s LYS 55 Cb -0.06 -0.19 -0.03 0.00 -2.06 0.00 0.00 37.83 35.49 1vae s LYS 55 CO 0.27 -0.27 1.05 -2.00 0.10 0.00 0.00 175.35 174.50 1vae s GLU 56 N -4.02 3.32 -0.39 1.78 2.12 -1.26 -3.48 118.70 116.77 1vae s GLU 56 Ca 0.34 1.10 0.00 0.00 0.36 0.00 0.00 54.97 56.77 1vae s GLU 56 Cb 0.07 -2.04 0.00 0.00 0.26 0.00 0.00 34.13 32.42 1vae s GLU 56 CO 0.11 -0.80 0.00 0.41 -0.54 0.00 0.00 175.26 174.44 1vae n GLY 57 N -1.35 0.65 3.73 -1.50 0.00 -1.15 -4.99 105.19 100.58 1vae n GLY 57 Ca 0.08 -0.44 -0.41 0.00 0.00 0.00 0.00 46.02 45.25 1vae n GLY 57 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1vae s ASP 58 N -2.54 7.48 -0.34 1.61 1.01 -1.23 -4.62 116.67 118.04 1vae s ASP 58 Ca 0.00 1.80 -0.08 0.00 0.71 0.00 0.00 52.55 54.97 1vae s ASP 58 Cb 0.00 -2.59 0.02 0.00 1.01 0.00 0.00 42.92 41.37 1vae s ASP 58 CO 0.00 -0.09 0.13 -0.31 0.21 0.00 0.00 175.17 175.12 1vae s TYR 59 N 0.07 3.22 0.28 4.23 1.51 -1.18 -0.57 117.35 124.91 1vae s TYR 59 Ca 0.47 -1.11 -0.30 0.00 -1.01 0.00 0.00 57.07 55.12 1vae s TYR 59 Cb -0.23 -2.33 -0.11 0.00 -0.11 0.00 0.00 41.96 39.18 1vae s TYR 59 CO 0.30 -0.65 1.57 0.42 -1.11 0.00 0.00 175.55 176.08 1vae s ILE 60 N 1.49 2.19 -0.03 2.71 1.01 -1.04 -2.76 121.20 124.77 1vae s ILE 60 Ca 0.01 0.16 0.01 0.00 0.00 0.00 0.00 60.65 60.83 1vae s ILE 60 Cb -0.19 -3.10 -0.02 0.00 0.01 0.00 0.00 42.46 39.16 1vae s ILE 60 CO 0.04 0.03 -0.02 1.33 0.00 0.00 0.00 174.94 176.31 1vae n VAL 61 N 2.27 0.19 -3.72 2.92 0.24 -0.87 -3.90 118.33 115.45 1vae n VAL 61 Ca 0.08 -0.08 -0.10 0.00 -2.04 0.00 0.00 64.34 62.20 1vae n VAL 61 Cb 0.38 -0.67 -0.05 0.00 -1.47 0.00 0.00 33.84 32.03 1vae n VAL 61 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 1vae s SER 62 N -4.14 -0.20 -0.25 -1.34 0.01 -1.25 0.20 113.70 106.73 1vae s SER 62 Ca -0.04 -0.46 -0.02 0.00 1.31 0.00 0.00 55.95 56.74 1vae s SER 62 Cb 0.01 0.50 0.12 0.00 0.21 0.00 0.00 66.02 66.86 1vae s SER 62 CO 0.08 -0.93 0.25 -0.63 0.41 0.00 0.00 173.24 172.43 1vae s ILE 63 N -3.85 -0.35 -0.96 1.44 1.01 -0.17 -2.87 121.20 115.45 1vae s ILE 63 Ca 0.07 -0.35 -0.01 0.00 0.00 0.00 0.00 60.65 60.36 1vae s ILE 63 Cb 0.01 -0.86 0.00 0.00 0.01 0.00 0.00 42.46 41.63 1vae s ILE 63 CO -0.07 -0.37 0.15 0.00 0.00 0.00 0.00 174.94 174.64 1vae n GLN 64 N 5.31 -1.74 0.00 2.79 1.13 -0.89 -2.01 117.38 121.98 1vae n GLN 64 Ca -0.04 0.55 0.00 0.00 -1.94 0.00 0.00 57.00 55.57 1vae n GLN 64 Cb 0.47 -4.67 0.00 0.00 0.11 0.00 0.00 30.24 26.16 1vae n GLN 64 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1vae n GLY 65 N -1.09 2.41 3.81 1.08 0.00 -1.26 -5.00 105.19 105.14 1vae n GLY 65 Ca -0.11 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.60 1vae n GLY 65 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1vae s VAL 66 N -2.32 3.79 -0.02 1.61 1.01 -0.85 -5.02 120.40 118.61 1vae s VAL 66 Ca 0.00 0.58 -0.21 0.00 0.00 0.00 0.00 61.98 62.36 1vae s VAL 66 Cb 0.00 -3.28 -0.05 0.00 0.00 0.00 0.00 36.38 33.05 1vae s VAL 66 CO 0.00 -0.76 0.59 -0.62 0.00 0.00 0.00 175.10 174.31 1vae s ASP 67 N -3.73 6.96 -0.08 3.32 2.15 -1.26 -1.00 116.67 123.02 1vae s ASP 67 Ca 0.59 1.14 0.19 0.00 0.43 0.00 0.00 52.55 54.90 1vae s ASP 67 Cb -0.15 -2.36 0.36 0.00 -0.30 0.00 0.00 42.92 40.47 1vae s ASP 67 CO 0.55 0.08 1.15 0.00 -0.17 0.00 0.00 175.17 176.79 1vae n LYS 69 N -0.00 1.15 -0.01 0.00 4.81 -0.49 -3.36 118.16 120.25 1vae n LYS 69 Ca -0.03 -0.04 0.06 0.00 -0.87 0.00 0.00 58.31 57.44 1vae n LYS 69 Cb 0.96 -1.43 -0.10 0.00 0.02 0.00 0.00 35.03 34.48 1vae n LYS 69 CO 0.00 0.00 0.00 0.91 1.17 0.00 0.00 177.40 179.48 1vae n TRP 70 N -2.53 0.00 -1.69 5.64 7.02 -1.26 -3.70 117.44 120.91 1vae n TRP 70 Ca -0.23 0.00 -0.36 0.00 -1.02 0.00 0.00 57.50 55.89 1vae n TRP 70 Cb 0.94 -0.31 0.07 0.00 -2.42 0.00 0.00 31.31 29.60 1vae n TRP 70 CO 0.00 0.00 0.00 -0.51 -2.02 0.00 0.00 177.69 175.16 1vae s LEU 71 N -3.93 3.53 0.00 -0.99 1.43 -1.26 -4.89 118.68 112.56 1vae s LEU 71 Ca -0.05 2.57 0.00 0.00 -1.03 0.00 0.00 54.13 55.62 1vae s LEU 71 Cb 0.08 -4.61 0.00 0.00 0.03 0.00 0.00 46.19 41.69 1vae s LEU 71 CO 0.55 -2.04 0.00 0.35 0.23 0.00 0.00 176.35 175.43 1vae n THR 72 N -2.05 0.00 0.05 5.49 -2.24 -1.26 -4.42 114.28 109.86 1vae n THR 72 Ca 0.15 0.00 -0.19 0.00 -2.27 0.00 0.00 64.05 61.74 1vae n THR 72 Cb 0.49 -1.71 -0.10 0.00 -2.10 0.00 0.00 70.33 66.91 1vae n THR 72 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 1vae h VAL 73 N -0.11 1.30 0.36 2.28 2.07 -1.83 -2.98 116.25 117.34 1vae h VAL 73 Ca 0.00 -2.30 -0.02 0.00 0.82 0.00 0.00 66.70 65.20 1vae h VAL 73 Cb 0.00 2.41 0.00 0.00 -1.52 0.00 0.00 31.29 32.19 1vae h VAL 73 CO 0.00 0.71 -0.17 -1.28 0.02 0.00 0.00 177.57 176.85 1vae h SER 74 N 0.36 -0.40 -0.15 0.57 0.87 -1.95 -2.34 113.55 110.51 1vae h SER 74 Ca -0.13 -0.14 0.01 0.00 -1.23 0.00 0.00 61.79 60.31 1vae h SER 74 Cb 1.70 0.10 -0.02 0.00 -0.44 0.00 0.00 62.40 63.74 1vae h SER 74 CO 0.20 0.03 -0.12 -0.33 -0.53 0.00 0.00 176.83 176.09 1vae h GLU 75 N -0.97 -0.04 -0.46 2.24 3.07 -1.94 0.20 114.58 116.68 1vae h GLU 75 Ca -0.05 0.00 0.05 0.00 -0.50 0.00 0.00 59.36 58.86 1vae h GLU 75 Cb 0.52 0.01 -0.08 0.00 -0.84 0.00 0.00 28.75 28.36 1vae h GLU 75 CO 0.08 -0.02 -0.51 0.28 -1.40 0.00 0.00 179.01 177.44 1vae h VAL 76 N -0.04 0.00 -0.60 3.13 2.07 -1.64 0.17 116.25 119.34 1vae h VAL 76 Ca 0.02 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.60 1vae h VAL 76 Cb 0.10 0.00 -0.07 0.00 -1.52 0.00 0.00 31.29 29.80 1vae h VAL 76 CO -0.16 0.00 -0.35 0.23 0.02 0.00 0.00 177.57 177.30 1vae n MET 77 N -5.10 -0.26 -0.26 1.57 2.81 -0.63 0.19 117.12 115.44 1vae n MET 77 Ca -0.02 1.27 0.20 0.00 -1.81 0.00 0.00 57.70 57.34 1vae n MET 77 Cb 0.30 -1.88 0.52 0.00 -0.71 0.00 0.00 33.22 31.45 1vae n MET 77 CO 0.00 0.00 0.00 0.87 1.51 0.00 0.00 175.97 178.35 1vae h LYS 78 N 0.00 0.38 0.00 0.03 1.57 0.27 1.34 116.57 120.16 1vae h LYS 78 Ca 0.10 -0.02 -0.08 0.00 -1.87 0.00 0.00 60.65 58.78 1vae h LYS 78 Cb 0.25 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.46 1vae h LYS 78 CO -0.57 0.25 -0.37 1.25 -0.57 0.00 0.00 179.45 179.44 1vae h LEU 79 N 0.39 0.00 0.04 2.94 6.46 0.51 -1.74 115.31 123.91 1vae h LEU 79 Ca 0.49 0.00 -0.08 0.00 -0.12 0.00 0.00 57.88 58.17 1vae h LEU 79 Cb 1.25 0.00 0.01 0.00 -0.73 0.00 0.00 40.66 41.19 1vae h LEU 79 CO -0.19 0.37 -0.34 -0.07 -0.62 0.00 0.00 178.44 177.59 1vae h LEU 80 N 0.00 0.23 -0.32 2.25 3.38 0.65 -3.29 115.31 118.22 1vae h LEU 80 Ca -0.00 -0.89 0.07 0.00 0.09 0.00 0.00 57.88 57.14 1vae h LEU 80 Cb 0.67 -0.07 -0.08 0.00 0.09 0.00 0.00 40.66 41.27 1vae h LEU 80 CO 0.05 1.10 -0.20 0.11 0.09 0.00 0.00 178.44 179.59 1vae h LYS 81 N -0.61 -0.16 -1.14 1.13 6.56 -0.30 0.23 116.57 122.28 1vae h LYS 81 Ca -0.05 0.01 0.36 0.00 -1.06 0.00 0.00 60.65 59.91 1vae h LYS 81 Cb 1.19 0.04 -0.13 0.00 -0.57 0.00 0.00 32.23 32.75 1vae h LYS 81 CO 0.06 -0.10 0.70 1.03 -2.06 0.00 0.00 179.45 179.09 1vae h SER 82 N -0.16 0.38 -0.91 0.86 0.87 -1.42 1.39 113.55 114.56 1vae h SER 82 Ca 0.17 0.15 -0.60 0.00 -1.23 0.00 0.00 61.79 60.28 1vae h SER 82 Cb 0.42 0.12 -0.27 0.00 -0.44 0.00 0.00 62.40 62.23 1vae h SER 82 CO -0.42 -0.13 0.77 0.49 -0.53 0.00 0.00 176.83 177.01 1vae n PHE 83 N -4.83 2.92 -2.27 2.24 3.72 0.80 -4.97 117.46 115.07 1vae n PHE 83 Ca 0.33 -2.70 -0.42 0.00 -0.05 0.00 0.00 57.45 54.61 1vae n PHE 83 Cb 1.17 -1.31 -0.03 0.00 -0.94 0.00 0.00 39.48 38.38 1vae n PHE 83 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 1vae s GLY 84 N -1.43 1.94 -1.15 1.37 0.00 0.48 -2.66 107.32 105.87 1vae s GLY 84 Ca 0.58 0.85 -0.02 0.00 0.00 0.00 0.00 44.72 46.13 1vae s GLY 84 CO 0.01 2.42 0.23 0.61 0.00 0.00 0.00 173.10 176.37 1vae n GLY 85 N 3.56 -0.19 2.78 0.20 0.00 -0.36 -4.94 105.19 106.24 1vae n GLY 85 Ca 0.12 -0.21 -0.21 0.00 0.00 0.00 0.00 46.02 45.73 1vae n GLY 85 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1vae s GLU 86 N -5.05 0.42 -0.15 1.61 2.02 -1.09 -4.90 118.70 111.57 1vae s GLU 86 Ca 0.11 0.13 -0.32 0.00 0.02 0.00 0.00 54.97 54.92 1vae s GLU 86 Cb -0.05 -0.75 -0.09 0.00 0.10 0.00 0.00 34.13 33.34 1vae s GLU 86 CO 0.14 -0.24 2.07 -1.91 0.02 0.00 0.00 175.26 175.34 1vae n GLU 87 N 4.80 2.05 -4.50 1.61 2.13 -1.26 -3.83 120.64 121.65 1vae n GLU 87 Ca -0.13 0.67 -0.24 0.00 0.66 0.00 0.00 57.16 58.12 1vae n GLU 87 Cb 0.50 -2.88 -0.10 0.00 0.27 0.00 0.00 31.44 29.22 1vae n GLU 87 CO 0.00 0.00 0.00 0.14 -0.41 0.00 0.00 177.13 176.86 1vae s VAL 88 N 6.14 2.06 -0.41 6.31 -7.23 -0.46 -4.97 120.40 121.84 1vae s VAL 88 Ca 0.98 -2.19 -0.05 0.00 -1.81 0.00 0.00 61.98 58.90 1vae s VAL 88 Cb -0.55 -2.55 0.10 0.00 0.56 0.00 0.00 36.38 33.93 1vae s VAL 88 CO 0.44 -0.25 0.21 -0.70 -0.31 0.00 0.00 175.10 174.49 1vae s GLU 89 N -3.64 2.24 0.09 4.82 2.12 -1.26 -3.11 118.70 119.96 1vae s GLU 89 Ca 0.31 -1.68 -0.14 0.00 0.36 0.00 0.00 54.97 53.82 1vae s GLU 89 Cb 0.02 -3.63 -0.06 0.00 0.26 0.00 0.00 34.13 30.72 1vae s GLU 89 CO 0.15 -1.02 0.49 1.41 -0.54 0.00 0.00 175.26 175.75 1vae s MET 90 N 1.24 3.96 -0.07 4.30 -2.45 -1.04 -2.08 119.30 123.17 1vae s MET 90 Ca 0.05 0.46 0.04 0.00 -1.25 0.00 0.00 55.69 54.99 1vae s MET 90 Cb -0.23 -3.07 0.00 0.00 1.25 0.00 0.00 34.83 32.79 1vae s MET 90 CO -0.02 0.57 -0.18 0.15 1.05 0.00 0.00 175.02 176.59 1vae s LYS 91 N -1.59 2.12 0.17 4.11 1.02 -1.14 -0.71 119.74 123.73 1vae s LYS 91 Ca 0.32 -0.63 0.04 0.00 0.02 0.00 0.00 55.97 55.72 1vae s LYS 91 Cb -0.16 -1.73 -0.05 0.00 -0.52 0.00 0.00 37.83 35.37 1vae s LYS 91 CO 0.18 0.17 -0.06 0.14 -0.92 0.00 0.00 175.35 174.85 1vae s VAL 92 N 0.30 1.07 -0.00 3.17 -7.23 -1.25 -2.04 120.40 114.42 1vae s VAL 92 Ca -0.11 -2.04 -0.00 0.00 -1.81 0.00 0.00 61.98 58.01 1vae s VAL 92 Cb -0.15 -2.02 0.00 0.00 0.56 0.00 0.00 36.38 34.78 1vae s VAL 92 CO 0.04 -0.60 0.01 0.68 -0.31 0.00 0.00 175.10 174.93 1vae s VAL 93 N -3.39 -0.00 0.03 1.32 -7.23 -1.11 -0.92 120.40 109.10 1vae s VAL 93 Ca 0.21 0.00 -0.23 0.00 -1.81 0.00 0.00 61.98 60.15 1vae s VAL 93 Cb 0.04 -0.03 -0.06 0.00 0.56 0.00 0.00 36.38 36.90 1vae s VAL 93 CO 0.03 0.00 0.71 -0.44 -0.31 0.00 0.00 175.10 175.09 1vae s SER 94 N 0.02 7.14 -0.02 4.85 0.01 -1.26 -3.12 113.70 121.32 1vae s SER 94 Ca -0.00 1.36 -0.27 0.00 1.31 0.00 0.00 55.95 58.34 1vae s SER 94 Cb -0.00 -2.43 -0.03 0.00 0.21 0.00 0.00 66.02 63.76 1vae s SER 94 CO -0.00 0.06 0.86 -0.22 0.41 0.00 0.00 173.24 174.35 1vae s LEU 95 N -0.16 4.35 0.00 2.44 0.20 -1.26 -2.74 118.68 121.51 1vae s LEU 95 Ca 0.36 1.47 0.00 0.00 0.69 0.00 0.00 54.13 56.65 1vae s LEU 95 Cb -0.20 -3.37 -0.00 0.00 -0.43 0.00 0.00 46.19 42.19 1vae s LEU 95 CO 0.21 -0.19 0.00 0.18 -0.29 0.00 0.00 176.35 176.26 1vae n LEU 96 N 3.79 0.00 -3.64 -0.68 4.77 -1.21 -5.02 117.00 115.00 1vae n LEU 96 Ca 0.03 -0.03 -0.09 0.00 -0.03 0.00 0.00 56.01 55.89 1vae n LEU 96 Cb 0.51 0.01 -0.02 0.00 -2.33 0.00 0.00 43.42 41.59 1vae n LEU 96 CO 0.50 -0.00 0.49 -0.62 -1.33 0.00 0.00 177.39 176.42 1vae s ASP 97 N -1.03 -0.38 -0.07 -1.43 -1.08 -1.26 -4.54 116.67 106.89 1vae s ASP 97 Ca 0.00 -0.29 -0.03 0.00 -0.52 0.00 0.00 52.55 51.70 1vae s ASP 97 Cb 0.00 0.62 -0.01 0.00 -1.46 0.00 0.00 42.92 42.07 1vae s ASP 97 CO 0.00 -1.09 -0.07 0.28 0.52 0.00 0.00 175.17 174.82 1vae h SER 98 N 2.00 0.00 -4.27 -0.34 0.02 -1.94 -3.48 113.55 105.53 1vae h SER 98 Ca -0.26 0.00 -0.50 0.00 -0.84 0.00 0.00 61.79 60.19 1vae h SER 98 Cb 1.27 0.00 0.06 0.00 0.14 0.00 0.00 62.40 63.88 1vae h SER 98 CO 0.30 0.35 0.38 0.28 -1.14 0.00 0.00 176.83 177.00 1vae s THR 99 N -1.54 4.18 0.00 -2.27 -1.32 -1.26 -5.04 115.64 108.39 1vae s THR 99 Ca -0.05 0.86 0.00 0.00 -1.21 0.00 0.00 61.69 61.29 1vae s THR 99 Cb 0.01 -3.54 0.00 0.00 -1.51 0.00 0.00 72.50 67.46 1vae s THR 99 CO 0.08 -0.78 0.00 -0.24 -2.21 0.00 0.00 174.62 171.47 1vae n SER 100 N -2.46 0.00 -3.81 8.08 2.88 -1.26 -5.15 113.62 111.90 1vae n SER 100 Ca 0.07 0.00 -0.22 0.00 -1.33 0.00 0.00 58.87 57.39 1vae n SER 100 Cb 0.53 0.00 -0.17 0.00 -0.75 0.00 0.00 64.21 63.82 1vae n SER 100 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1vae s SER 101 N 0.00 1.42 0.10 -3.46 0.15 -1.26 -5.14 113.70 105.50 1vae s SER 101 Ca 0.00 -0.11 0.06 0.00 0.70 0.00 0.00 55.95 56.61 1vae s SER 101 Cb 0.00 -0.46 -0.03 0.00 -1.71 0.00 0.00 66.02 63.82 1vae s SER 101 CO 0.00 -0.15 -0.16 -0.32 1.20 0.00 0.00 173.24 173.81 1vae s MET 102 N 1.65 0.98 -0.13 5.44 1.75 -1.26 -5.15 119.30 122.57 1vae s MET 102 Ca 0.00 -1.11 -0.29 0.00 -1.25 0.00 0.00 55.69 53.04 1vae s MET 102 Cb -0.13 -1.02 0.08 0.00 2.84 0.00 0.00 34.83 36.61 1vae s MET 102 CO -0.04 0.22 0.78 -1.58 -0.65 0.00 0.00 175.02 173.75 1vae s HIS 103 N -1.52 -0.62 0.00 4.11 2.46 -1.26 -5.16 115.29 113.30 1vae s HIS 103 Ca 0.04 1.20 0.00 0.00 0.47 0.00 0.00 55.06 56.77 1vae s HIS 103 Cb -0.08 0.39 0.00 0.00 -0.13 0.00 0.00 32.58 32.75 1vae s HIS 103 CO 0.03 -0.48 0.00 -1.71 -2.47 0.00 0.00 174.74 170.11 1vae n ASN 104 N 1.34 0.00 -4.23 9.88 5.15 -1.26 -5.17 115.26 120.97 1vae n ASN 104 Ca -0.16 0.00 -0.27 0.00 -0.60 0.00 0.00 54.58 53.55 1vae n ASN 104 Cb 0.57 0.00 -0.15 0.00 -0.53 0.00 0.00 39.78 39.66 1vae n ASN 104 CO 0.00 0.00 0.00 -0.75 1.40 0.00 0.00 177.26 177.91 1vae s LYS 105 N 0.00 1.68 -0.29 1.20 2.47 -1.26 -5.12 119.74 118.42 1vae s LYS 105 Ca 0.00 -0.79 -0.26 0.00 -1.56 0.00 0.00 55.97 53.36 1vae s LYS 105 Cb 0.00 -1.65 0.19 0.00 -1.46 0.00 0.00 37.83 34.91 1vae s LYS 105 CO 0.00 0.45 1.41 -1.54 0.16 0.00 0.00 175.35 175.83 1vae s SER 106 N -0.60 -0.05 0.00 1.43 1.04 -1.26 -5.18 113.70 109.08 1vae s SER 106 Ca 0.08 0.08 0.00 0.00 0.48 0.00 0.00 55.95 56.59 1vae s SER 106 Cb -0.08 0.08 0.00 0.00 0.10 0.00 0.00 66.02 66.12 1vae s SER 106 CO -0.00 -0.03 0.00 0.61 0.98 0.00 0.00 173.24 174.80 1vae n GLY 107 N 1.22 2.88 3.28 7.32 0.00 -1.26 -5.17 105.19 113.47 1vae n GLY 107 Ca -0.07 -0.23 -0.26 0.00 0.00 0.00 0.00 46.02 45.45 1vae n GLY 107 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1vae n PRO 108 N -0.65 -2.04 -3.63 1.61 -0.04 -1.26 -5.10 135.00 123.90 1vae n PRO 108 Ca 0.00 -1.70 -0.02 0.00 -0.04 0.00 0.00 63.50 61.75 1vae n PRO 108 Cb 0.00 -1.34 -0.04 0.00 -0.04 0.00 0.00 33.50 32.07 1vae n PRO 108 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1vae s SER 109 N -4.74 -1.06 0.86 3.54 0.15 -1.26 -5.17 113.70 106.02 1vae s SER 109 Ca 0.65 1.49 -0.12 0.00 0.70 0.00 0.00 55.95 58.67 1vae s SER 109 Cb -0.04 2.11 0.10 0.00 -1.71 0.00 0.00 66.02 66.48 1vae s SER 109 CO 0.48 -0.21 1.12 -0.44 1.20 0.00 0.00 173.24 175.39 1vae s SER 110 N 2.66 3.99 0.00 5.45 0.01 -1.26 -5.38 113.70 119.16 1vae s SER 110 Ca -0.06 1.13 0.00 0.00 1.31 0.00 0.00 55.95 58.32 1vae s SER 110 Cb -0.10 -1.78 0.00 0.00 0.21 0.00 0.00 66.02 64.35 1vae s SER 110 CO -0.19 -2.27 0.00 0.61 0.41 0.00 0.00 173.24 171.80