#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 4.80 0.02 1.61 1.04 -1.26 -5.09 113.70 114.83 1vae s SER 2 Ca 0.00 -0.25 -0.06 0.00 0.48 0.00 0.00 55.95 56.13 1vae s SER 2 Cb 0.00 -1.83 -0.01 0.00 0.10 0.00 0.00 66.02 64.28 1vae s SER 2 CO 0.00 0.02 0.10 -0.44 0.98 0.00 0.00 173.24 173.90 1vae s SER 3 N 1.28 0.12 0.00 7.02 0.01 -1.26 -5.17 113.70 115.71 1vae s SER 3 Ca 0.04 -0.41 0.00 0.00 1.31 0.00 0.00 55.95 56.89 1vae s SER 3 Cb -0.15 0.21 0.00 0.00 0.21 0.00 0.00 66.02 66.30 1vae s SER 3 CO 0.01 -0.45 0.00 0.61 0.41 0.00 0.00 173.24 173.82 1vae n GLY 4 N 1.07 4.72 3.15 3.44 0.00 -1.26 -5.15 105.19 111.15 1vae n GLY 4 Ca -0.21 -1.98 0.05 0.00 0.00 0.00 0.00 46.02 43.88 1vae n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1vae s SER 5 N 0.09 -0.01 -0.09 1.61 0.15 -1.26 -5.16 113.70 109.03 1vae s SER 5 Ca 0.00 0.01 -0.06 0.00 0.70 0.00 0.00 55.95 56.60 1vae s SER 5 Cb 0.00 1.01 -0.04 0.00 -1.71 0.00 0.00 66.02 65.28 1vae s SER 5 CO 0.00 -0.00 0.16 -0.44 1.20 0.00 0.00 173.24 174.16 1vae s SER 6 N 2.75 6.39 0.00 5.45 0.01 -1.26 -5.06 113.70 121.98 1vae s SER 6 Ca -0.09 0.45 0.00 0.00 1.31 0.00 0.00 55.95 57.62 1vae s SER 6 Cb -0.06 -2.05 0.00 0.00 0.21 0.00 0.00 66.02 64.11 1vae s SER 6 CO -0.09 0.37 0.00 0.61 0.41 0.00 0.00 173.24 174.54 1vae n GLY 7 N 1.68 2.72 3.85 3.44 0.00 -1.26 -5.16 105.19 110.46 1vae n GLY 7 Ca -0.17 -0.73 -0.32 0.00 0.00 0.00 0.00 46.02 44.80 1vae n GLY 7 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1vae s SER 8 N 2.00 6.33 -0.97 1.61 1.04 -1.26 -4.95 113.70 117.50 1vae s SER 8 Ca 0.00 1.51 -0.24 0.00 0.48 0.00 0.00 55.95 57.71 1vae s SER 8 Cb 0.00 -2.49 0.02 0.00 0.10 0.00 0.00 66.02 63.65 1vae s SER 8 CO 0.00 -0.79 1.61 0.00 0.98 0.00 0.00 173.24 175.04 1vae s ALA 9 N -2.90 2.37 -0.20 5.32 0.00 -1.26 -4.85 121.76 120.24 1vae s ALA 9 Ca 0.57 -1.98 -0.30 0.00 0.00 0.00 0.00 51.96 50.26 1vae s ALA 9 Cb -0.11 -4.53 0.14 0.00 0.00 0.00 0.00 23.12 18.63 1vae s ALA 9 CO 0.43 -4.00 1.10 -1.54 0.00 0.00 0.00 175.76 171.75 1vae s SER 10 N 5.97 -0.28 0.66 0.00 1.04 -1.26 -5.16 113.70 114.67 1vae s SER 10 Ca 0.54 0.32 -0.15 0.00 0.48 0.00 0.00 55.95 57.14 1vae s SER 10 Cb -0.02 0.25 0.00 0.00 0.10 0.00 0.00 66.02 66.35 1vae s SER 10 CO -0.06 -0.25 1.11 -0.54 0.98 0.00 0.00 173.24 174.48 1vae s LYS 11 N -1.00 2.78 -0.04 4.02 1.02 -1.26 -5.05 119.74 120.20 1vae s LYS 11 Ca 0.01 1.39 -0.01 0.00 0.02 0.00 0.00 55.97 57.39 1vae s LYS 11 Cb -0.01 -1.95 0.03 0.00 -0.52 0.00 0.00 37.83 35.38 1vae s LYS 11 CO -0.01 -1.27 0.03 -0.98 -0.92 0.00 0.00 175.35 172.19 1vae s ARG 12 N -4.11 0.14 -0.15 1.68 1.70 -1.26 -5.09 118.95 111.87 1vae s ARG 12 Ca 0.67 0.21 -0.01 0.00 -0.47 0.00 0.00 55.73 56.13 1vae s ARG 12 Cb -0.21 -0.52 -0.01 0.00 -0.57 0.00 0.00 34.95 33.64 1vae s ARG 12 CO 0.42 -0.24 -0.11 -1.58 -1.08 0.00 0.00 175.30 172.71 1vae s TRP 13 N 1.59 2.86 1.22 5.89 0.52 -1.26 -2.76 118.94 127.00 1vae s TRP 13 Ca -0.02 -0.66 -0.20 0.00 0.02 0.00 0.00 56.10 55.23 1vae s TRP 13 Cb -0.13 -1.90 0.31 0.00 -1.15 0.00 0.00 33.47 30.61 1vae s TRP 13 CO -0.03 -0.25 0.86 -1.13 0.02 0.00 0.00 176.95 176.42 1vae n SER 14 N 3.74 -3.14 -4.79 2.95 3.41 -1.18 -4.98 113.62 109.64 1vae n SER 14 Ca -0.18 -0.91 -0.36 0.00 -0.26 0.00 0.00 58.87 57.16 1vae n SER 14 Cb 0.52 -0.89 -0.04 0.00 -0.26 0.00 0.00 64.21 63.55 1vae n SER 14 CO 0.00 0.00 0.00 -2.16 -0.16 0.00 0.00 175.04 172.72 1vae s PRO 15 N -5.00 4.04 0.31 4.33 0.04 -1.26 -4.69 135.00 132.77 1vae s PRO 15 Ca 0.61 1.47 -0.28 0.00 0.04 0.00 0.00 61.00 62.84 1vae s PRO 15 Cb -0.09 -2.40 -0.09 0.00 0.04 0.00 0.00 34.50 31.96 1vae s PRO 15 CO 0.49 -0.24 1.07 -1.25 0.04 0.00 0.00 177.00 177.12 1vae s PRO 16 N -2.73 4.52 0.32 0.56 0.04 -1.26 -4.63 135.00 131.82 1vae s PRO 16 Ca 0.61 1.70 -0.05 0.00 0.04 0.00 0.00 61.00 63.30 1vae s PRO 16 Cb -0.20 -3.01 -0.05 0.00 0.04 0.00 0.00 34.50 31.28 1vae s PRO 16 CO 0.25 0.13 0.59 -0.98 0.04 0.00 0.00 177.00 177.03 1vae s ARG 17 N -1.73 3.61 -0.42 4.56 1.70 -0.53 -4.86 118.95 121.28 1vae s ARG 17 Ca 0.48 0.01 -0.11 0.00 -0.47 0.00 0.00 55.73 55.64 1vae s ARG 17 Cb -0.29 -2.61 0.07 0.00 -0.57 0.00 0.00 34.95 31.55 1vae s ARG 17 CO 0.37 0.15 0.27 0.20 -1.08 0.00 0.00 175.30 175.21 1vae s GLY 18 N -3.36 1.97 0.10 3.88 0.00 -1.26 -3.58 107.32 105.07 1vae s GLY 18 Ca 0.44 -2.06 0.01 0.00 0.00 0.00 0.00 44.72 43.11 1vae s GLY 18 CO 0.32 0.96 0.24 -0.42 0.00 0.00 0.00 173.10 174.20 1vae s ILE 19 N 1.49 5.32 -0.16 0.90 1.01 -0.88 -5.00 121.20 123.89 1vae s ILE 19 Ca 0.03 -0.55 -0.05 0.00 0.00 0.00 0.00 60.65 60.08 1vae s ILE 19 Cb -0.22 -3.66 0.06 0.00 0.01 0.00 0.00 42.46 38.64 1vae s ILE 19 CO 0.04 0.03 0.10 -1.38 0.00 0.00 0.00 174.94 173.73 1vae s HIS 20 N -1.62 0.13 0.33 3.97 -3.43 -1.26 -3.11 115.29 110.30 1vae s HIS 20 Ca 0.35 -0.18 -0.12 0.00 -0.80 0.00 0.00 55.06 54.30 1vae s HIS 20 Cb -0.12 -0.63 0.02 0.00 -1.43 0.00 0.00 32.58 30.42 1vae s HIS 20 CO 0.28 -0.48 0.62 -0.59 -2.00 0.00 0.00 174.74 172.57 1vae s PHE 21 N 2.16 0.43 -0.19 0.38 -0.71 -1.19 -4.61 117.98 114.25 1vae s PHE 21 Ca 0.03 -0.88 -0.02 0.00 -1.04 0.00 0.00 56.93 55.02 1vae s PHE 21 Cb -0.15 0.41 -0.01 0.00 -1.21 0.00 0.00 43.02 42.06 1vae s PHE 21 CO -0.09 -1.28 -0.08 0.99 -1.34 0.00 0.00 175.22 173.42 1vae s THR 22 N -3.07 3.19 0.16 -4.49 2.01 -1.26 -2.17 115.64 110.00 1vae s THR 22 Ca 0.21 -0.57 -0.31 0.00 0.31 0.00 0.00 61.69 61.32 1vae s THR 22 Cb -0.03 -2.41 -0.10 0.00 0.01 0.00 0.00 72.50 69.97 1vae s THR 22 CO 0.13 0.47 1.63 -0.69 -0.69 0.00 0.00 174.62 175.47 1vae s VAL 23 N 1.09 2.55 -1.67 3.82 1.01 -1.26 -4.81 120.40 121.13 1vae s VAL 23 Ca 0.01 0.33 0.30 0.00 0.00 0.00 0.00 61.98 62.62 1vae s VAL 23 Cb -0.15 -3.21 0.62 0.00 0.00 0.00 0.00 36.38 33.64 1vae s VAL 23 CO -0.01 0.02 2.05 -0.62 0.00 0.00 0.00 175.10 176.54 1vae n GLU 24 N 4.35 0.68 -3.78 2.72 4.71 -1.26 0.06 120.64 128.11 1vae n GLU 24 Ca 0.15 -0.08 -0.22 0.00 -0.01 0.00 0.00 57.16 56.99 1vae n GLU 24 Cb 0.38 -1.50 -0.01 0.00 -1.01 0.00 0.00 31.44 29.30 1vae n GLU 24 CO 0.00 0.00 0.00 -0.85 0.09 0.00 0.00 177.13 176.37 1vae n GLU 25 N -1.09 -0.71 0.00 3.49 0.28 -1.26 -3.67 120.64 117.67 1vae n GLU 25 Ca 0.17 -0.14 0.00 0.00 -0.16 0.00 0.00 57.16 57.03 1vae n GLU 25 Cb 0.22 -1.14 0.00 0.00 1.43 0.00 0.00 31.44 31.95 1vae n GLU 25 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1vae n GLY 26 N -1.64 0.86 0.00 -1.84 0.00 -1.26 -5.02 105.19 96.29 1vae n GLY 26 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.93 1vae n GLY 26 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1vae n ASP 27 N 0.00 0.00 -4.74 1.61 2.03 -1.24 -5.15 116.55 109.06 1vae n ASP 27 Ca 0.00 0.00 -0.41 0.00 0.52 0.00 0.00 54.79 54.90 1vae n ASP 27 Cb 0.00 0.00 -0.05 0.00 -0.72 0.00 0.00 41.12 40.35 1vae n ASP 27 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1vae s LEU 28 N 0.00 4.57 -0.30 -2.67 1.43 -1.26 -4.74 118.68 115.71 1vae s LEU 28 Ca 0.00 1.88 0.01 0.00 -1.03 0.00 0.00 54.13 54.99 1vae s LEU 28 Cb 0.00 -3.60 0.30 0.00 0.03 0.00 0.00 46.19 42.92 1vae s LEU 28 CO 0.00 0.03 1.76 0.61 0.23 0.00 0.00 176.35 178.98 1vae n GLY 29 N 1.88 3.82 3.76 -3.19 0.00 -1.26 -4.87 105.19 105.32 1vae n GLY 29 Ca 0.00 -0.91 -0.01 0.00 0.00 0.00 0.00 46.02 45.10 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 -1.89 -0.04 0.34 1.61 -0.12 -1.26 0.85 117.98 117.46 1vae s PHE 30 Ca 0.32 -0.21 0.05 0.00 -0.05 0.00 0.00 56.93 57.04 1vae s PHE 30 Cb 0.26 0.62 -0.03 0.00 -0.63 0.00 0.00 43.02 43.24 1vae s PHE 30 CO 0.03 -0.65 0.21 -0.08 -0.05 0.00 0.00 175.22 174.67 1vae s THR 31 N -2.68 0.22 -0.10 -4.49 -1.32 -1.23 -4.87 115.64 101.16 1vae s THR 31 Ca 0.16 -2.00 0.03 0.00 -1.21 0.00 0.00 61.69 58.67 1vae s THR 31 Cb 0.00 -2.46 -0.01 0.00 -1.51 0.00 0.00 72.50 68.52 1vae s THR 31 CO 0.01 0.00 -0.18 -0.76 -2.21 0.00 0.00 174.62 171.48 1vae s LEU 32 N -3.42 2.42 0.04 9.08 1.43 -1.26 -2.77 118.68 124.20 1vae s LEU 32 Ca 0.35 -0.42 0.01 0.00 -1.03 0.00 0.00 54.13 53.04 1vae s LEU 32 Cb 0.03 -1.50 -0.03 0.00 0.03 0.00 0.00 46.19 44.72 1vae s LEU 32 CO 0.21 0.19 -0.05 -0.13 0.23 0.00 0.00 176.35 176.80 1vae s ARG 33 N 0.15 0.49 0.11 1.70 0.52 -1.25 -4.98 118.95 115.70 1vae s ARG 33 Ca -0.10 -0.82 0.00 0.00 -0.52 0.00 0.00 55.73 54.29 1vae s ARG 33 Cb -0.16 -0.07 0.00 0.00 0.52 0.00 0.00 34.95 35.24 1vae s ARG 33 CO 0.06 -0.01 0.00 0.41 0.02 0.00 0.00 175.30 175.78 1vae n GLY 34 N 1.19 -3.09 0.00 -3.53 0.00 -1.26 -1.89 105.19 96.61 1vae n GLY 34 Ca -0.21 -1.88 0.00 0.00 0.00 0.00 0.00 46.02 43.93 1vae n GLY 34 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1vae n ASN 35 N -0.15 0.00 -3.64 1.61 4.13 -1.26 -4.56 115.26 111.39 1vae n ASN 35 Ca 0.00 0.00 -0.09 0.00 1.68 0.00 0.00 54.58 56.17 1vae n ASN 35 Cb 0.00 0.00 -0.07 0.00 -1.54 0.00 0.00 39.78 38.17 1vae n ASN 35 CO 0.00 0.00 0.00 0.28 0.28 0.00 0.00 177.26 177.82 1vae s THR 36 N 0.00 0.00 0.12 3.41 -1.32 -1.26 -3.70 115.64 112.89 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 -0.07 0.00 -1.51 0.00 0.00 72.50 69.92 1vae s THR 36 CO 0.00 0.00 1.14 -2.16 -2.21 0.00 0.00 174.62 171.39 1vae s PRO 37 N 0.35 4.52 0.74 7.08 0.04 -1.25 -4.98 135.00 141.49 1vae s PRO 37 Ca 0.02 1.74 -0.16 0.00 0.04 0.00 0.00 61.00 62.64 1vae s PRO 37 Cb -0.05 -3.31 0.02 0.00 0.04 0.00 0.00 34.50 31.19 1vae s PRO 37 CO -0.06 -0.08 0.98 1.33 0.04 0.00 0.00 177.00 179.21 1vae n VAL 38 N 3.10 2.65 -3.08 -0.36 0.24 -1.24 -4.70 118.33 114.93 1vae n VAL 38 Ca 0.06 -0.35 -0.19 0.00 -2.04 0.00 0.00 64.34 61.82 1vae n VAL 38 Cb 0.46 -1.10 0.04 0.00 -1.47 0.00 0.00 33.84 31.77 1vae n VAL 38 CO 0.00 0.00 0.00 -1.10 -2.14 0.00 0.00 176.83 173.59 1vae s GLN 39 N -3.43 2.49 -0.33 7.34 -0.21 -0.79 -1.44 119.66 123.29 1vae s GLN 39 Ca 0.73 -1.52 -0.00 0.00 0.02 0.00 0.00 55.36 54.59 1vae s GLN 39 Cb -0.33 -2.65 0.08 0.00 1.00 0.00 0.00 33.01 31.10 1vae s GLN 39 CO 0.51 -0.62 0.04 0.08 -2.12 0.00 0.00 175.29 173.18 1vae s VAL 40 N -2.56 2.79 -1.13 1.09 1.01 0.06 -3.74 120.40 117.93 1vae s VAL 40 Ca 0.58 -1.78 -0.05 0.00 0.00 0.00 0.00 61.98 60.73 1vae s VAL 40 Cb -0.07 -2.77 0.27 0.00 0.00 0.00 0.00 36.38 33.81 1vae s VAL 40 CO 0.36 -0.33 1.64 1.57 0.00 0.00 0.00 175.10 178.33 1vae n HIS 41 N 4.51 2.43 -1.19 5.22 -0.00 -1.11 -2.91 115.22 122.17 1vae n HIS 41 Ca -0.07 -2.62 -0.41 0.00 0.46 0.00 0.00 57.72 55.08 1vae n HIS 41 Cb 0.42 -1.43 -0.02 0.00 -0.12 0.00 0.00 29.99 28.84 1vae n HIS 41 CO 0.00 0.00 0.00 1.19 0.46 0.00 0.00 176.34 177.99 1vae n PHE 42 N 1.84 -0.49 -0.03 1.57 3.72 -1.26 -3.51 117.46 119.29 1vae n PHE 42 Ca 0.32 0.81 -0.05 0.00 -0.05 0.00 0.00 57.45 58.49 1vae n PHE 42 Cb 0.33 -1.67 -0.03 0.00 -0.94 0.00 0.00 39.48 37.18 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 1.72 2.70 -4.16 4.37 4.77 0.25 -4.89 117.00 121.76 1vae n LEU 43 Ca 0.15 -0.02 -0.33 0.00 -0.03 0.00 0.00 56.01 55.78 1vae n LEU 43 Cb 0.22 -0.21 -0.16 0.00 -2.33 0.00 0.00 43.42 40.93 1vae n LEU 43 CO 0.48 0.55 -0.54 -1.81 -1.33 0.00 0.00 177.39 174.74 1vae s ASP 44 N -4.72 3.13 0.00 -1.43 1.01 -0.47 -4.98 116.67 109.21 1vae s ASP 44 Ca -0.08 -0.61 0.24 0.00 0.71 0.00 0.00 52.55 52.80 1vae s ASP 44 Cb 0.02 -1.46 1.42 0.00 1.01 0.00 0.00 42.92 43.92 1vae s ASP 44 CO 0.14 0.06 1.79 -0.81 0.21 0.00 0.00 175.17 176.56 1vae n PRO 45 N 4.20 0.75 -2.79 8.23 -0.04 -1.26 -3.28 135.00 140.82 1vae n PRO 45 Ca -0.20 0.00 -0.23 0.00 -0.04 0.00 0.00 63.50 63.03 1vae n PRO 45 Cb 0.51 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.46 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 -1.00 2.73 -4.43 0.54 8.25 -1.26 -4.74 115.22 115.32 1vae n HIS 46 Ca 0.18 -3.49 -0.22 0.00 -0.26 0.00 0.00 57.72 53.92 1vae n HIS 46 Cb 0.08 -0.33 -0.10 0.00 1.12 0.00 0.00 29.99 30.76 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 2.41 -1.26 -0.39 0.00 0.02 -1.90 1.30 113.55 113.73 1vae h SER 48 Ca -0.40 0.17 0.03 0.00 -0.84 0.00 0.00 61.79 60.75 1vae h SER 48 Cb 1.25 0.52 -0.05 0.00 0.14 0.00 0.00 62.40 64.26 1vae h SER 48 CO 0.60 -0.27 -0.23 0.00 -1.14 0.00 0.00 176.83 175.79 1vae n ALA 49 N -2.96 -0.25 -0.12 3.77 0.00 -1.26 0.19 120.51 119.88 1vae n ALA 49 Ca -0.02 0.33 -0.05 0.00 0.00 0.00 0.00 53.44 53.70 1vae n ALA 49 Cb 0.23 0.24 0.01 0.00 0.00 0.00 0.00 19.45 19.93 1vae n ALA 49 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1vae h SER 50 N 0.00 -0.43 -0.05 0.00 0.87 -1.69 0.80 113.55 113.04 1vae h SER 50 Ca 0.06 0.13 0.01 0.00 -1.23 0.00 0.00 61.79 60.76 1vae h SER 50 Cb 0.16 0.27 -0.00 0.00 -0.44 0.00 0.00 62.40 62.39 1vae h SER 50 CO -0.36 -0.15 0.15 -0.07 -0.53 0.00 0.00 176.83 175.86 1vae h LEU 51 N -0.03 0.00 0.15 2.23 3.38 0.51 -0.75 115.31 120.80 1vae h LEU 51 Ca 0.19 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.16 1vae h LEU 51 Cb 0.32 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.07 1vae h LEU 51 CO -0.42 0.00 -0.07 0.00 0.09 0.00 0.00 178.44 178.03 1vae h ALA 52 N 1.74 -0.20 0.00 1.53 0.00 0.90 -3.48 119.26 119.75 1vae h ALA 52 Ca 0.02 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1vae h ALA 52 Cb 0.33 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1vae h ALA 52 CO -0.00 -0.42 0.00 0.41 0.00 0.00 0.00 179.25 179.24 1vae n GLY 53 N -0.09 0.19 0.00 0.00 0.00 -0.29 -4.68 105.19 100.31 1vae n GLY 53 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.93 1vae n GLY 53 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vae n ALA 54 N 0.00 0.00 -3.50 4.61 0.00 -1.24 -4.97 120.51 115.40 1vae n ALA 54 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.33 1vae n ALA 54 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 1vae n ALA 54 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1vae s LYS 55 N -0.04 0.94 -0.06 0.00 1.02 -1.26 -4.96 119.74 115.38 1vae s LYS 55 Ca 0.00 -0.16 -0.30 0.00 0.02 0.00 0.00 55.97 55.53 1vae s LYS 55 Cb 0.00 0.44 -0.05 0.00 -0.52 0.00 0.00 37.83 37.70 1vae s LYS 55 CO 0.00 -0.37 1.58 -2.00 -0.92 0.00 0.00 175.35 173.64 1vae s GLU 56 N -2.56 4.19 0.00 1.68 2.12 -1.26 -2.37 118.70 120.50 1vae s GLU 56 Ca -0.00 2.11 0.00 0.00 0.36 0.00 0.00 54.97 57.44 1vae s GLU 56 Cb -0.01 -3.92 0.00 0.00 0.26 0.00 0.00 34.13 30.47 1vae s GLU 56 CO -0.05 -0.81 0.00 0.41 -0.54 0.00 0.00 175.26 174.28 1vae n GLY 57 N 4.02 0.96 3.72 -1.50 0.00 -1.15 -5.02 105.19 106.23 1vae n GLY 57 Ca 0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 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 -0.95 6.46 -0.57 1.61 1.01 -1.00 -4.66 116.67 118.57 1vae s ASP 58 Ca 0.00 2.78 -0.11 0.00 0.71 0.00 0.00 52.55 55.93 1vae s ASP 58 Cb 0.00 -2.60 0.14 0.00 1.01 0.00 0.00 42.92 41.47 1vae s ASP 58 CO 0.00 -0.90 0.46 -0.31 0.21 0.00 0.00 175.17 174.63 1vae s TYR 59 N 0.97 3.45 -0.80 4.23 1.51 -1.23 -0.76 117.35 124.71 1vae s TYR 59 Ca 0.71 -1.87 -0.28 0.00 -1.01 0.00 0.00 57.07 54.62 1vae s TYR 59 Cb -0.47 -3.59 -0.17 0.00 -0.11 0.00 0.00 41.96 37.63 1vae s TYR 59 CO 0.34 -0.98 2.55 -0.89 -1.11 0.00 0.00 175.55 175.46 1vae n ILE 60 N 4.65 -0.03 -0.02 2.71 5.41 -0.52 -2.92 119.36 128.64 1vae n ILE 60 Ca -0.04 -0.35 -0.22 0.00 1.00 0.00 0.00 62.75 63.15 1vae n ILE 60 Cb 0.41 -1.40 -0.13 0.00 -0.71 0.00 0.00 39.64 37.81 1vae n ILE 60 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 176.55 178.17 1vae h VAL 61 N 7.82 0.81 -3.51 1.39 3.04 -1.08 -3.32 116.25 121.40 1vae h VAL 61 Ca -0.11 -2.33 -0.05 0.00 -1.01 0.00 0.00 66.70 63.20 1vae h VAL 61 Cb 1.27 2.50 -0.11 0.00 -2.01 0.00 0.00 31.29 32.95 1vae h VAL 61 CO 1.30 0.71 -0.10 -0.44 -1.01 0.00 0.00 177.57 178.04 1vae s SER 62 N -7.01 -0.15 -0.15 3.17 0.01 -1.14 0.20 113.70 108.63 1vae s SER 62 Ca -0.23 -0.63 -0.04 0.00 1.31 0.00 0.00 55.95 56.36 1vae s SER 62 Cb 0.06 0.53 0.07 0.00 0.21 0.00 0.00 66.02 66.89 1vae s SER 62 CO 0.73 -1.00 0.18 -0.63 0.41 0.00 0.00 173.24 172.93 1vae s ILE 63 N -3.91 -0.27 0.00 1.44 1.01 -0.02 -0.92 121.20 118.53 1vae s ILE 63 Ca 0.12 0.07 0.00 0.00 0.00 0.00 0.00 60.65 60.84 1vae s ILE 63 Cb 0.00 -0.51 0.00 0.00 0.01 0.00 0.00 42.46 41.96 1vae s ILE 63 CO -0.02 -0.07 0.00 0.00 0.00 0.00 0.00 174.94 174.85 1vae n GLN 64 N 5.32 -0.47 0.00 2.79 1.13 0.40 -1.78 117.38 124.76 1vae n GLN 64 Ca -0.05 0.12 0.00 0.00 -1.94 0.00 0.00 57.00 55.12 1vae n GLN 64 Cb 0.50 -3.61 0.00 0.00 0.11 0.00 0.00 30.24 27.23 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 -1.63 1.20 3.70 1.08 0.00 -1.26 -4.96 105.19 103.32 1vae n GLY 65 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 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 -2.00 4.87 0.07 1.61 1.01 -0.74 -5.04 120.40 120.19 1vae s VAL 66 Ca 0.00 -0.02 -0.31 0.00 0.00 0.00 0.00 61.98 61.65 1vae s VAL 66 Cb 0.00 -3.15 -0.10 0.00 0.00 0.00 0.00 36.38 33.12 1vae s VAL 66 CO 0.00 0.52 1.89 0.47 0.00 0.00 0.00 175.10 177.98 1vae n ASP 67 N 2.94 4.04 0.00 3.32 8.00 -1.26 -0.84 116.55 132.74 1vae n ASP 67 Ca -0.18 0.95 0.00 0.00 0.71 0.00 0.00 54.79 56.28 1vae n ASP 67 Cb 0.53 -1.52 0.00 0.00 -0.02 0.00 0.00 41.12 40.11 1vae n ASP 67 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1vae n LYS 69 N -0.16 0.03 -0.06 0.00 4.81 0.14 -3.47 118.16 119.44 1vae n LYS 69 Ca 0.00 -0.00 -0.08 0.00 -0.87 0.00 0.00 58.31 57.36 1vae n LYS 69 Cb 0.22 -1.50 -0.08 0.00 0.02 0.00 0.00 35.03 33.69 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 -1.48 0.00 -0.57 5.64 7.02 -1.26 -3.92 117.44 122.87 1vae n TRP 70 Ca 0.07 0.00 -0.30 0.00 -1.02 0.00 0.00 57.50 56.25 1vae n TRP 70 Cb 0.33 -0.56 0.22 0.00 -2.42 0.00 0.00 31.31 28.88 1vae n TRP 70 CO 0.00 0.00 0.00 1.28 -2.02 0.00 0.00 177.69 176.95 1vae n LEU 71 N -2.65 0.57 0.00 -0.99 4.77 -1.23 -4.90 117.00 112.57 1vae n LEU 71 Ca -0.22 0.09 0.00 0.00 -0.03 0.00 0.00 56.01 55.85 1vae n LEU 71 Cb 0.83 -1.35 0.00 0.00 -2.33 0.00 0.00 43.42 40.57 1vae n LEU 71 CO 0.20 -2.82 0.00 0.35 -1.33 0.00 0.00 177.39 173.79 1vae n THR 72 N -4.65 0.00 -0.01 -5.08 -2.24 -1.26 -4.55 114.28 96.49 1vae n THR 72 Ca 0.07 0.00 -0.15 0.00 -2.27 0.00 0.00 64.05 61.69 1vae n THR 72 Cb 0.53 0.00 -0.14 0.00 -2.10 0.00 0.00 70.33 68.62 1vae n THR 72 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 1vae n VAL 73 N 0.00 1.70 0.08 2.28 0.31 -1.26 -3.64 118.33 117.80 1vae n VAL 73 Ca 0.00 -0.72 -0.07 0.00 -0.01 0.00 0.00 64.34 63.53 1vae n VAL 73 Cb 0.00 -1.40 -0.05 0.00 -0.91 0.00 0.00 33.84 31.48 1vae n VAL 73 CO 0.00 0.00 0.00 -1.28 -1.32 0.00 0.00 176.83 174.23 1vae h SER 74 N 0.04 -0.24 -0.79 4.52 0.87 -1.96 -2.02 113.55 113.97 1vae h SER 74 Ca -0.36 -0.15 0.14 0.00 -1.23 0.00 0.00 61.79 60.19 1vae h SER 74 Cb 2.03 0.06 -0.14 0.00 -0.44 0.00 0.00 62.40 63.91 1vae h SER 74 CO 0.08 0.27 -0.31 -0.33 -0.53 0.00 0.00 176.83 176.01 1vae h GLU 75 N -1.02 -0.06 0.63 2.24 5.08 -1.96 0.81 114.58 120.30 1vae h GLU 75 Ca -0.03 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.31 1vae h GLU 75 Cb 0.38 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.64 1vae h GLU 75 CO 0.05 -0.04 -0.36 0.28 -1.00 0.00 0.00 179.01 177.93 1vae h VAL 76 N -0.06 0.26 -1.22 3.13 2.07 -1.67 -0.29 116.25 118.47 1vae h VAL 76 Ca 0.32 0.00 0.43 0.00 0.82 0.00 0.00 66.70 68.27 1vae h VAL 76 Cb 0.58 0.26 -0.14 0.00 -1.52 0.00 0.00 31.29 30.47 1vae h VAL 76 CO -0.83 0.00 0.76 0.24 0.02 0.00 0.00 177.57 177.76 1vae h MET 77 N -0.93 0.08 -0.06 1.57 2.86 -0.21 1.54 114.93 119.77 1vae h MET 77 Ca -0.08 -0.00 -0.16 0.00 -2.06 0.00 0.00 59.70 57.39 1vae h MET 77 Cb 0.74 -0.02 0.01 0.00 0.06 0.00 0.00 31.60 32.40 1vae h MET 77 CO 0.09 0.05 -0.59 0.87 1.06 0.00 0.00 176.91 178.39 1vae h LYS 78 N 0.08 0.51 0.00 1.72 6.56 -0.19 0.13 116.57 125.38 1vae h LYS 78 Ca 0.83 -0.47 -0.01 0.00 -1.06 0.00 0.00 60.65 59.94 1vae h LYS 78 Cb 2.45 0.11 -0.00 0.00 -0.57 0.00 0.00 32.23 34.22 1vae h LYS 78 CO -0.53 1.10 -0.04 1.25 -2.06 0.00 0.00 179.45 179.17 1vae h LEU 79 N 0.09 0.00 0.09 2.94 5.85 0.36 0.76 115.31 125.41 1vae h LEU 79 Ca -0.06 0.00 -0.22 0.00 0.84 0.00 0.00 57.88 58.44 1vae h LEU 79 Cb 1.26 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.29 1vae h LEU 79 CO 0.12 0.04 -1.10 -0.07 -0.34 0.00 0.00 178.44 177.09 1vae h LEU 80 N 0.00 0.31 -0.26 2.25 3.38 0.05 -3.31 115.31 117.72 1vae h LEU 80 Ca -0.00 -0.85 -0.01 0.00 0.09 0.00 0.00 57.88 57.11 1vae h LEU 80 Cb 0.10 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 1vae h LEU 80 CO 0.01 1.48 0.13 0.11 0.09 0.00 0.00 178.44 180.26 1vae h LYS 81 N -0.48 0.37 -1.25 1.13 1.57 -0.08 -1.74 116.57 116.09 1vae h LYS 81 Ca -0.24 -0.05 0.36 0.00 -1.87 0.00 0.00 60.65 58.85 1vae h LYS 81 Cb 1.59 -0.07 -0.07 0.00 0.08 0.00 0.00 32.23 33.77 1vae h LYS 81 CO 0.04 0.35 0.87 1.03 -0.57 0.00 0.00 179.45 181.17 1vae h SER 82 N 0.30 0.11 -1.10 0.86 0.87 0.38 0.83 113.55 115.80 1vae h SER 82 Ca 0.09 0.03 -0.69 0.00 -1.23 0.00 0.00 61.79 59.99 1vae h SER 82 Cb 0.10 0.01 -0.29 0.00 -0.44 0.00 0.00 62.40 61.78 1vae h SER 82 CO -0.01 0.00 0.90 0.49 -0.53 0.00 0.00 176.83 177.68 1vae n PHE 83 N -4.28 3.21 -1.79 2.24 3.72 -0.66 -4.98 117.46 114.93 1vae n PHE 83 Ca 0.28 -2.97 -0.42 0.00 -0.05 0.00 0.00 57.45 54.29 1vae n PHE 83 Cb 1.27 -1.43 -0.03 0.00 -0.94 0.00 0.00 39.48 38.34 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 -1.76 1.29 -1.45 1.37 0.00 0.29 -2.29 107.32 104.76 1vae s GLY 84 Ca 0.64 1.05 -0.08 0.00 0.00 0.00 0.00 44.72 46.33 1vae s GLY 84 CO -0.05 3.38 0.80 0.61 0.00 0.00 0.00 173.10 177.84 1vae n GLY 85 N 4.67 -0.39 0.00 0.20 0.00 0.11 -4.84 105.19 104.94 1vae n GLY 85 Ca 0.21 0.16 0.00 0.00 0.00 0.00 0.00 46.02 46.39 1vae n GLY 85 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1vae n GLU 86 N -4.49 2.10 -2.18 1.61 1.02 -0.97 -4.95 120.64 112.79 1vae n GLU 86 Ca -0.12 -0.25 0.00 0.00 -0.02 0.00 0.00 57.16 56.77 1vae n GLU 86 Cb 0.60 -0.72 0.00 0.00 -0.02 0.00 0.00 31.44 31.29 1vae n GLU 86 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 1vae n GLU 87 N -0.37 -5.26 -4.38 3.49 2.13 -1.26 -5.01 120.64 109.97 1vae n GLU 87 Ca 0.00 3.74 -0.22 0.00 0.66 0.00 0.00 57.16 61.33 1vae n GLU 87 Cb 0.02 -4.28 -0.08 0.00 0.27 0.00 0.00 31.44 27.37 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 -0.52 0.24 -0.28 6.31 -7.23 -0.92 -5.01 120.40 113.00 1vae s VAL 88 Ca 0.00 -2.00 0.03 0.00 -1.81 0.00 0.00 61.98 58.20 1vae s VAL 88 Cb 0.00 -2.42 0.07 0.00 0.56 0.00 0.00 36.38 34.59 1vae s VAL 88 CO 0.00 0.00 -0.05 -1.61 -0.31 0.00 0.00 175.10 173.13 1vae s GLU 89 N -3.57 1.87 -0.10 4.82 2.02 -1.26 -3.16 118.70 119.32 1vae s GLU 89 Ca 0.33 -1.39 -0.18 0.00 0.02 0.00 0.00 54.97 53.75 1vae s GLU 89 Cb 0.02 -2.87 -0.04 0.00 0.10 0.00 0.00 34.13 31.34 1vae s GLU 89 CO 0.22 -0.68 0.50 1.41 0.02 0.00 0.00 175.26 176.72 1vae s MET 90 N 1.14 4.32 -0.11 1.61 -2.45 -1.18 -0.46 119.30 122.17 1vae s MET 90 Ca -0.03 0.50 -0.02 0.00 -1.25 0.00 0.00 55.69 54.89 1vae s MET 90 Cb -0.19 -3.42 -0.03 0.00 1.25 0.00 0.00 34.83 32.44 1vae s MET 90 CO -0.07 0.20 -0.05 0.15 1.05 0.00 0.00 175.02 176.31 1vae s LYS 91 N 0.46 3.19 0.01 4.11 3.01 -0.10 -2.06 119.74 128.36 1vae s LYS 91 Ca 0.27 -0.51 0.01 0.00 -1.01 0.00 0.00 55.97 54.72 1vae s LYS 91 Cb -0.16 -2.76 -0.01 0.00 -1.01 0.00 0.00 37.83 33.89 1vae s LYS 91 CO 0.11 0.49 -0.03 0.14 0.51 0.00 0.00 175.35 176.57 1vae s VAL 92 N -0.31 0.23 -0.01 3.17 -7.23 -1.24 -0.56 120.40 114.45 1vae s VAL 92 Ca 0.05 -0.46 0.08 0.00 -1.81 0.00 0.00 61.98 59.84 1vae s VAL 92 Cb -0.12 -0.26 -0.02 0.00 0.56 0.00 0.00 36.38 36.53 1vae s VAL 92 CO 0.02 -0.15 -0.24 0.68 -0.31 0.00 0.00 175.10 175.10 1vae s VAL 93 N -0.61 1.94 0.05 1.32 -7.23 -1.15 -1.45 120.40 113.27 1vae s VAL 93 Ca -0.05 -1.09 -0.24 0.00 -1.81 0.00 0.00 61.98 58.79 1vae s VAL 93 Cb -0.05 -1.62 -0.06 0.00 0.56 0.00 0.00 36.38 35.22 1vae s VAL 93 CO -0.00 0.51 0.75 -0.44 -0.31 0.00 0.00 175.10 175.60 1vae s SER 94 N -0.68 7.20 -0.32 4.85 0.01 -1.26 -3.57 113.70 119.92 1vae s SER 94 Ca 0.10 1.43 -0.29 0.00 1.31 0.00 0.00 55.95 58.50 1vae s SER 94 Cb -0.09 -2.46 -0.00 0.00 0.21 0.00 0.00 66.02 63.67 1vae s SER 94 CO -0.00 0.04 1.47 -0.22 0.41 0.00 0.00 173.24 174.94 1vae s LEU 95 N -0.16 3.74 -0.00 2.44 0.20 -1.26 -3.13 118.68 120.50 1vae s LEU 95 Ca 0.38 1.18 0.14 0.00 0.69 0.00 0.00 54.13 56.51 1vae s LEU 95 Cb -0.20 -3.54 0.40 0.00 -0.43 0.00 0.00 46.19 42.42 1vae s LEU 95 CO 0.23 -1.32 1.33 0.18 -0.29 0.00 0.00 176.35 176.48 1vae n LEU 96 N 8.54 2.41 -4.86 -0.68 4.32 -1.11 -4.88 117.00 120.74 1vae n LEU 96 Ca 0.17 -1.21 -0.22 0.00 -0.02 0.00 0.00 56.01 54.74 1vae n LEU 96 Cb 0.47 -0.30 -0.04 0.00 -1.62 0.00 0.00 43.42 41.93 1vae n LEU 96 CO 0.67 0.60 -0.13 -0.62 -1.22 0.00 0.00 177.39 176.69 1vae s ASP 97 N -0.99 5.60 0.31 -1.43 2.15 -1.26 -4.79 116.67 116.26 1vae s ASP 97 Ca 0.30 -0.25 0.00 0.00 0.43 0.00 0.00 52.55 53.03 1vae s ASP 97 Cb 0.16 -1.38 0.00 0.00 -0.30 0.00 0.00 42.92 41.40 1vae s ASP 97 CO 0.20 -0.12 0.00 -1.20 -0.17 0.00 0.00 175.17 173.89 1vae n SER 98 N -1.26 -0.54 -2.95 -0.34 7.64 -1.26 -5.11 113.62 109.80 1vae n SER 98 Ca -0.07 0.54 -0.01 0.00 1.01 0.00 0.00 58.87 60.34 1vae n SER 98 Cb 0.58 0.73 -0.01 0.00 -1.01 0.00 0.00 64.21 64.50 1vae n SER 98 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 1vae n THR 99 N -3.49 -5.40 -0.07 0.44 -1.04 -1.26 -4.95 114.28 98.52 1vae n THR 99 Ca 0.00 1.00 -0.10 0.00 -2.04 0.00 0.00 64.05 62.91 1vae n THR 99 Cb 0.00 -4.11 -0.08 0.00 -1.82 0.00 0.00 70.33 64.32 1vae n THR 99 CO 0.00 0.00 0.00 -1.28 -0.64 0.00 0.00 175.07 173.15 1vae h SER 100 N 4.29 0.00 -6.18 8.00 0.87 -2.07 -3.48 113.55 114.98 1vae h SER 100 Ca -0.14 -0.54 -0.39 0.00 -1.23 0.00 0.00 61.79 59.50 1vae h SER 100 Cb 0.53 0.00 0.07 0.00 -0.44 0.00 0.00 62.40 62.56 1vae h SER 100 CO 0.01 0.90 -0.85 -0.24 -0.53 0.00 0.00 176.83 176.13 1vae n SER 101 N -4.63 -5.60 -4.86 6.23 2.88 -1.26 -4.95 113.62 101.42 1vae n SER 101 Ca -0.10 -0.90 -0.37 0.00 -1.33 0.00 0.00 58.87 56.17 1vae n SER 101 Cb 0.35 -3.43 -0.06 0.00 -0.75 0.00 0.00 64.21 60.32 1vae n SER 101 CO 0.00 0.00 0.00 -0.04 -1.23 0.00 0.00 175.04 173.77 1vae s MET 102 N -5.49 3.69 0.49 -1.46 -1.94 -1.26 -5.07 119.30 108.26 1vae s MET 102 Ca 0.37 0.14 -0.22 0.00 -1.71 0.00 0.00 55.69 54.27 1vae s MET 102 Cb -0.13 -3.18 -0.07 0.00 2.01 0.00 0.00 34.83 33.47 1vae s MET 102 CO 0.85 0.71 1.16 -1.58 -0.01 0.00 0.00 175.02 176.15 1vae s HIS 103 N -1.11 2.79 -0.12 -0.03 2.46 -1.26 -5.04 115.29 112.99 1vae s HIS 103 Ca 0.22 1.54 -0.05 0.00 0.47 0.00 0.00 55.06 57.24 1vae s HIS 103 Cb -0.14 -3.36 0.06 0.00 -0.13 0.00 0.00 32.58 29.00 1vae s HIS 103 CO 0.11 -1.56 0.24 1.21 -2.47 0.00 0.00 174.74 172.26 1vae s ASN 104 N -1.48 0.30 0.13 9.88 3.84 -1.26 -5.15 114.94 121.20 1vae s ASN 104 Ca 0.67 0.53 -0.01 0.00 0.21 0.00 0.00 52.86 54.26 1vae s ASN 104 Cb -0.27 0.56 -0.04 0.00 -0.55 0.00 0.00 41.25 40.95 1vae s ASN 104 CO 0.32 -0.23 0.05 -0.75 -2.79 0.00 0.00 177.10 173.71 1vae s LYS 105 N 2.16 0.95 0.21 0.43 2.20 -1.26 -5.17 119.74 119.26 1vae s LYS 105 Ca -0.01 -1.45 0.08 0.00 -0.36 0.00 0.00 55.97 54.23 1vae s LYS 105 Cb -0.12 0.17 -0.04 0.00 -1.51 0.00 0.00 37.83 36.33 1vae s LYS 105 CO -0.08 -0.24 0.04 -1.54 -0.36 0.00 0.00 175.35 173.17 1vae s SER 106 N -3.06 4.86 0.96 1.43 1.04 -1.26 -5.13 113.70 112.54 1vae s SER 106 Ca 0.24 -0.44 -0.01 0.00 0.48 0.00 0.00 55.95 56.22 1vae s SER 106 Cb 0.07 -1.05 0.02 0.00 0.10 0.00 0.00 66.02 65.17 1vae s SER 106 CO 0.02 0.04 0.05 0.61 0.98 0.00 0.00 173.24 174.93 1vae n GLY 107 N -0.53 -3.49 3.61 7.32 0.00 -1.26 -4.85 105.19 105.99 1vae n GLY 107 Ca -0.08 -1.15 -0.43 0.00 0.00 0.00 0.00 46.02 44.36 1vae n GLY 107 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1vae s PRO 108 N -2.92 3.71 -0.37 1.61 0.04 -1.26 -4.93 135.00 130.89 1vae s PRO 108 Ca 0.04 1.10 0.05 0.00 0.04 0.00 0.00 61.00 62.22 1vae s PRO 108 Cb -0.01 -3.97 0.17 0.00 0.04 0.00 0.00 34.50 30.73 1vae s PRO 108 CO 0.03 -1.38 0.48 0.45 0.04 0.00 0.00 177.00 176.61 1vae s SER 109 N 3.53 0.02 0.00 6.66 0.15 -1.26 -5.01 113.70 117.79 1vae s SER 109 Ca 0.60 -1.05 0.00 0.00 0.70 0.00 0.00 55.95 56.20 1vae s SER 109 Cb -0.15 1.18 0.00 0.00 -1.71 0.00 0.00 66.02 65.34 1vae s SER 109 CO 0.29 -0.25 0.00 -1.20 1.20 0.00 0.00 173.24 173.28 1vae n SER 110 N 4.52 0.00 0.00 5.45 7.64 -1.26 -5.19 113.62 124.79 1vae n SER 110 Ca 0.09 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.97 1vae n SER 110 Cb 0.50 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.70 1vae n SER 110 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64