#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 -0.34 -0.30 1.61 0.01 -1.26 -5.16 113.70 108.26 1vae s SER 2 Ca 0.00 0.06 -0.19 0.00 1.31 0.00 0.00 55.95 57.14 1vae s SER 2 Cb 0.00 0.34 0.18 0.00 0.21 0.00 0.00 66.02 66.76 1vae s SER 2 CO 0.00 -0.53 1.25 -0.55 0.41 0.00 0.00 173.24 173.82 1vae s SER 3 N -2.24 -0.10 0.00 2.44 0.15 -1.26 -5.13 113.70 107.56 1vae s SER 3 Ca 0.04 0.10 0.00 0.00 0.70 0.00 0.00 55.95 56.79 1vae s SER 3 Cb -0.01 1.10 0.00 0.00 -1.71 0.00 0.00 66.02 65.40 1vae s SER 3 CO -0.07 -0.02 0.00 0.61 1.20 0.00 0.00 173.24 174.96 1vae n GLY 4 N 4.96 0.41 3.55 9.45 0.00 -1.26 -5.01 105.19 117.30 1vae n GLY 4 Ca -0.08 -1.55 0.02 0.00 0.00 0.00 0.00 46.02 44.41 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 -4.00 -0.19 -0.28 1.61 0.15 -1.26 -5.18 113.70 104.55 1vae s SER 5 Ca 0.00 0.30 -0.27 0.00 0.70 0.00 0.00 55.95 56.67 1vae s SER 5 Cb 0.00 1.12 0.19 0.00 -1.71 0.00 0.00 66.02 65.62 1vae s SER 5 CO 0.00 -0.05 1.37 -0.55 1.20 0.00 0.00 173.24 175.21 1vae s SER 6 N 1.37 -0.07 -0.23 5.45 0.15 -1.26 -5.19 113.70 113.93 1vae s SER 6 Ca -0.06 0.10 -0.30 0.00 0.70 0.00 0.00 55.95 56.39 1vae s SER 6 Cb -0.03 0.09 0.16 0.00 -1.71 0.00 0.00 66.02 64.54 1vae s SER 6 CO -0.12 -0.05 1.21 -0.83 1.20 0.00 0.00 173.24 174.65 1vae s GLY 7 N -0.57 -0.09 -0.30 9.45 0.00 -1.26 -5.17 107.32 109.39 1vae s GLY 7 Ca 0.08 2.38 -0.15 0.00 0.00 0.00 0.00 44.72 47.02 1vae s GLY 7 CO -0.11 1.00 0.99 -0.56 0.00 0.00 0.00 173.10 174.42 1vae s SER 8 N -1.22 -0.55 -0.39 1.64 0.01 -1.26 -5.04 113.70 106.89 1vae s SER 8 Ca 0.05 0.78 -0.17 0.00 1.31 0.00 0.00 55.95 57.93 1vae s SER 8 Cb -0.01 1.53 0.02 0.00 0.21 0.00 0.00 66.02 67.77 1vae s SER 8 CO -0.04 -0.11 0.49 0.00 0.41 0.00 0.00 173.24 173.98 1vae n ALA 9 N 4.62 -2.92 -2.93 1.44 0.00 -1.26 -5.03 120.51 114.42 1vae n ALA 9 Ca -0.12 0.87 0.03 0.00 0.00 0.00 0.00 53.44 54.23 1vae n ALA 9 Cb 0.54 -2.93 0.00 0.00 0.00 0.00 0.00 19.45 17.06 1vae n ALA 9 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1vae s SER 10 N -2.18 -0.35 -0.02 0.00 0.01 -1.26 -5.13 113.70 104.77 1vae s SER 10 Ca 0.22 -0.08 -0.30 0.00 1.31 0.00 0.00 55.95 57.10 1vae s SER 10 Cb -0.05 0.77 -0.05 0.00 0.21 0.00 0.00 66.02 66.90 1vae s SER 10 CO 0.76 -0.05 1.37 -0.54 0.41 0.00 0.00 173.24 175.19 1vae s LYS 11 N 2.38 4.29 -0.12 12.44 1.02 -1.26 -4.97 119.74 133.52 1vae s LYS 11 Ca 0.20 1.91 -0.28 0.00 0.02 0.00 0.00 55.97 57.83 1vae s LYS 11 Cb 0.01 -3.59 -0.02 0.00 -0.52 0.00 0.00 37.83 33.71 1vae s LYS 11 CO -0.18 -0.57 0.92 0.50 -0.92 0.00 0.00 175.35 175.10 1vae s ARG 12 N 2.47 4.39 0.20 1.68 3.00 -1.11 -4.96 118.95 124.62 1vae s ARG 12 Ca 0.62 1.22 0.07 0.00 -1.00 0.00 0.00 55.73 56.64 1vae s ARG 12 Cb -0.30 -3.54 -0.04 0.00 0.00 0.00 0.00 34.95 31.07 1vae s ARG 12 CO 0.25 -0.28 0.05 -1.58 0.00 0.00 0.00 175.30 173.75 1vae s TRP 13 N 1.91 2.90 0.74 5.12 0.52 -1.26 0.12 118.94 128.99 1vae s TRP 13 Ca 0.44 -0.13 -0.00 0.00 0.02 0.00 0.00 56.10 56.43 1vae s TRP 13 Cb -0.18 -1.36 0.14 0.00 -1.15 0.00 0.00 33.47 30.92 1vae s TRP 13 CO 0.16 0.54 1.01 0.45 0.02 0.00 0.00 176.95 179.14 1vae s SER 14 N -3.25 4.24 0.47 2.95 0.15 0.36 -4.91 113.70 113.72 1vae s SER 14 Ca 0.30 -0.49 -0.21 0.00 0.70 0.00 0.00 55.95 56.25 1vae s SER 14 Cb -0.09 0.18 -0.09 0.00 -1.71 0.00 0.00 66.02 64.32 1vae s SER 14 CO 0.21 -1.95 1.04 -2.16 1.20 0.00 0.00 173.24 171.58 1vae s PRO 15 N -5.16 3.86 0.23 5.44 0.04 -1.26 -4.29 135.00 133.87 1vae s PRO 15 Ca 0.68 1.39 -0.30 0.00 0.04 0.00 0.00 61.00 62.81 1vae s PRO 15 Cb -0.04 -2.17 -0.09 0.00 0.04 0.00 0.00 34.50 32.24 1vae s PRO 15 CO 0.45 -0.38 1.10 -1.25 0.04 0.00 0.00 177.00 176.95 1vae s PRO 16 N -3.11 4.62 0.75 0.56 0.04 -1.26 -4.37 135.00 132.24 1vae s PRO 16 Ca 0.66 1.76 -0.06 0.00 0.04 0.00 0.00 61.00 63.40 1vae s PRO 16 Cb -0.17 -3.23 0.11 0.00 0.04 0.00 0.00 34.50 31.25 1vae s PRO 16 CO 0.21 0.16 1.05 1.03 0.04 0.00 0.00 177.00 179.49 1vae s ARG 17 N -0.95 1.72 -0.48 4.56 0.52 -0.22 -4.83 118.95 119.27 1vae s ARG 17 Ca 0.47 -0.62 0.03 0.00 -0.52 0.00 0.00 55.73 55.09 1vae s ARG 17 Cb -0.31 -2.18 0.15 0.00 0.52 0.00 0.00 34.95 33.13 1vae s ARG 17 CO 0.38 -1.51 0.29 0.20 0.02 0.00 0.00 175.30 174.68 1vae s GLY 18 N -4.66 1.83 0.24 -3.53 0.00 -1.26 -4.02 107.32 95.92 1vae s GLY 18 Ca 0.65 -2.79 -0.11 0.00 0.00 0.00 0.00 44.72 42.46 1vae s GLY 18 CO 0.46 1.54 0.59 -0.42 0.00 0.00 0.00 173.10 175.27 1vae s ILE 19 N 0.00 4.86 -0.18 0.90 1.01 -0.43 -4.96 121.20 122.41 1vae s ILE 19 Ca 0.21 0.62 -0.03 0.00 0.00 0.00 0.00 60.65 61.45 1vae s ILE 19 Cb -0.17 -3.63 0.06 0.00 0.01 0.00 0.00 42.46 38.73 1vae s ILE 19 CO -0.05 -0.06 0.04 -1.38 0.00 0.00 0.00 174.94 173.49 1vae s HIS 20 N -1.81 0.90 0.34 3.97 -3.43 -1.26 -2.39 115.29 111.60 1vae s HIS 20 Ca 0.48 -0.74 -0.12 0.00 -0.80 0.00 0.00 55.06 53.88 1vae s HIS 20 Cb -0.11 -0.97 0.03 0.00 -1.43 0.00 0.00 32.58 30.09 1vae s HIS 20 CO 0.20 -0.58 0.63 -0.59 -2.00 0.00 0.00 174.74 172.41 1vae s PHE 21 N 1.90 0.41 -0.28 0.38 -0.71 -1.19 -4.76 117.98 113.73 1vae s PHE 21 Ca -0.00 -0.88 -0.02 0.00 -1.04 0.00 0.00 56.93 54.99 1vae s PHE 21 Cb -0.17 0.43 0.04 0.00 -1.21 0.00 0.00 43.02 42.11 1vae s PHE 21 CO -0.08 -1.31 -0.01 0.99 -1.34 0.00 0.00 175.22 173.48 1vae s THR 22 N -3.01 3.09 0.20 -4.49 2.01 -1.26 -1.45 115.64 110.74 1vae s THR 22 Ca 0.21 -1.18 -0.32 0.00 0.31 0.00 0.00 61.69 60.71 1vae s THR 22 Cb -0.03 -2.68 -0.15 0.00 0.01 0.00 0.00 72.50 69.65 1vae s THR 22 CO 0.13 0.01 1.16 0.52 -0.69 0.00 0.00 174.62 175.75 1vae n VAL 23 N 4.67 1.13 -3.75 3.82 0.31 -1.25 -4.75 118.33 118.51 1vae n VAL 23 Ca -0.14 -0.28 -0.38 0.00 -0.01 0.00 0.00 64.34 63.53 1vae n VAL 23 Cb 0.45 -0.95 -0.12 0.00 -0.91 0.00 0.00 33.84 32.31 1vae n VAL 23 CO 0.00 0.00 0.00 -0.70 -1.32 0.00 0.00 176.83 174.81 1vae s GLU 24 N -0.62 2.97 -0.02 5.55 2.12 -1.26 0.30 118.70 127.72 1vae s GLU 24 Ca 0.69 -0.94 0.05 0.00 0.36 0.00 0.00 54.97 55.13 1vae s GLU 24 Cb -0.80 -3.41 0.19 0.00 0.26 0.00 0.00 34.13 30.37 1vae s GLU 24 CO 0.53 -0.51 1.03 0.39 -0.54 0.00 0.00 175.26 176.17 1vae n GLU 25 N 4.86 1.67 0.00 4.30 -0.58 -1.26 -1.65 120.64 127.98 1vae n GLU 25 Ca -0.14 -0.76 0.00 0.00 -0.42 0.00 0.00 57.16 55.85 1vae n GLU 25 Cb 0.47 -1.36 0.00 0.00 -0.57 0.00 0.00 31.44 29.98 1vae n GLU 25 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1vae n GLY 26 N 0.57 0.07 0.00 0.62 0.00 -1.26 -4.91 105.19 100.28 1vae n GLY 26 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 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 -0.31 0.00 -0.37 1.61 2.03 -1.17 -5.01 116.55 113.33 1vae n ASP 27 Ca 0.00 0.00 0.33 0.00 0.52 0.00 0.00 54.79 55.64 1vae n ASP 27 Cb 0.04 0.00 0.57 0.00 -0.72 0.00 0.00 41.12 41.01 1vae n ASP 27 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1vae n LEU 28 N 0.00 0.22 0.00 -2.67 4.77 -0.66 -4.72 117.00 113.95 1vae n LEU 28 Ca 0.00 1.29 0.00 0.00 -0.03 0.00 0.00 56.01 57.27 1vae n LEU 28 Cb 0.00 -0.63 0.00 0.00 -2.33 0.00 0.00 43.42 40.46 1vae n LEU 28 CO 0.00 -1.41 0.00 0.61 -1.33 0.00 0.00 177.39 175.26 1vae n GLY 29 N -1.38 2.80 0.69 -0.72 0.00 -1.26 -4.53 105.19 100.79 1vae n GLY 29 Ca 0.35 -0.38 -0.06 0.00 0.00 0.00 0.00 46.02 45.92 1vae n GLY 29 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 1vae n PHE 30 N 0.00 0.12 -4.17 1.61 1.16 -1.26 -2.70 117.46 112.22 1vae n PHE 30 Ca 0.00 -0.51 -0.15 0.00 -1.87 0.00 0.00 57.45 54.92 1vae n PHE 30 Cb 0.00 -0.03 -0.07 0.00 -1.61 0.00 0.00 39.48 37.77 1vae n PHE 30 CO 0.00 0.00 0.00 -0.08 -1.87 0.00 0.00 176.76 174.81 1vae s THR 31 N -1.64 0.00 -0.10 1.97 -1.32 -1.25 -4.92 115.64 108.37 1vae s THR 31 Ca 0.02 -1.80 0.00 0.00 -1.21 0.00 0.00 61.69 58.71 1vae s THR 31 Cb 0.00 -2.53 0.02 0.00 -1.51 0.00 0.00 72.50 68.49 1vae s THR 31 CO 0.02 0.00 -0.09 -0.76 -2.21 0.00 0.00 174.62 171.58 1vae s LEU 32 N -3.25 1.29 0.10 9.08 1.43 -1.26 -3.14 118.68 122.94 1vae s LEU 32 Ca 0.35 -0.30 -0.07 0.00 -1.03 0.00 0.00 54.13 53.08 1vae s LEU 32 Cb 0.02 -0.84 -0.01 0.00 0.03 0.00 0.00 46.19 45.39 1vae s LEU 32 CO 0.20 -0.09 0.15 0.00 0.23 0.00 0.00 176.35 176.85 1vae s ARG 33 N 1.47 0.87 0.43 1.70 1.04 -1.25 -4.94 118.95 118.28 1vae s ARG 33 Ca 0.01 -1.10 0.00 0.00 -1.04 0.00 0.00 55.73 53.60 1vae s ARG 33 Cb -0.13 0.31 0.00 0.00 -2.04 0.00 0.00 34.95 33.09 1vae s ARG 33 CO -0.06 -0.27 0.00 0.41 -0.04 0.00 0.00 175.30 175.35 1vae n GLY 34 N -0.06 -1.80 2.24 3.88 0.00 -1.26 -3.35 105.19 104.84 1vae n GLY 34 Ca -0.12 -1.84 -0.12 0.00 0.00 0.00 0.00 46.02 43.93 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 0.13 1.04 -4.82 1.61 6.94 -1.26 -4.67 115.26 114.23 1vae n ASN 35 Ca 0.00 -1.79 -0.38 0.00 -0.02 0.00 0.00 54.58 52.39 1vae n ASN 35 Cb 0.00 -0.29 -0.06 0.00 -2.36 0.00 0.00 39.78 37.07 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 -1.30 4.79 0.10 5.53 -1.32 -1.26 -1.64 115.64 120.54 1vae s THR 36 Ca 0.36 1.11 -0.30 0.00 -1.21 0.00 0.00 61.69 61.64 1vae s THR 36 Cb -0.03 -3.85 -0.06 0.00 -1.51 0.00 0.00 72.50 67.06 1vae s THR 36 CO 0.23 0.50 1.15 -2.16 -2.21 0.00 0.00 174.62 172.13 1vae s PRO 37 N -1.27 4.50 0.53 7.08 0.04 -1.26 -4.95 135.00 139.68 1vae s PRO 37 Ca 0.30 1.73 -0.20 0.00 0.04 0.00 0.00 61.00 62.87 1vae s PRO 37 Cb -0.18 -3.32 -0.08 0.00 0.04 0.00 0.00 34.50 30.96 1vae s PRO 37 CO 0.18 -0.12 0.87 1.33 0.04 0.00 0.00 177.00 179.30 1vae n VAL 38 N 3.29 2.91 -3.81 -0.36 0.24 -0.65 -4.68 118.33 115.28 1vae n VAL 38 Ca 0.06 -0.50 -0.21 0.00 -2.04 0.00 0.00 64.34 61.65 1vae n VAL 38 Cb 0.47 -1.03 -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 -2.33 2.64 -0.21 7.34 -0.21 -1.21 -1.25 119.66 124.42 1vae s GLN 39 Ca 0.70 -1.38 -0.09 0.00 0.02 0.00 0.00 55.36 54.61 1vae s GLN 39 Cb -0.47 -2.41 -0.04 0.00 1.00 0.00 0.00 33.01 31.08 1vae s GLN 39 CO 0.52 0.04 0.10 0.08 -2.12 0.00 0.00 175.29 173.91 1vae s VAL 40 N -2.35 4.94 -0.83 1.09 1.01 0.44 -3.78 120.40 120.91 1vae s VAL 40 Ca 0.42 0.03 0.01 0.00 0.00 0.00 0.00 61.98 62.44 1vae s VAL 40 Cb -0.05 -3.26 0.23 0.00 0.00 0.00 0.00 36.38 33.30 1vae s VAL 40 CO 0.26 0.40 0.83 1.57 0.00 0.00 0.00 175.10 178.17 1vae n HIS 41 N 4.00 3.66 -1.64 5.22 -0.00 -1.19 -3.40 115.22 121.87 1vae n HIS 41 Ca -0.16 -3.95 -0.64 0.00 0.46 0.00 0.00 57.72 53.43 1vae n HIS 41 Cb 0.52 -0.92 -0.09 0.00 -0.12 0.00 0.00 29.99 29.38 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 1.72 1.26 -0.07 1.57 3.72 -1.26 -3.94 117.46 120.45 1vae n PHE 42 Ca 0.24 1.11 -0.07 0.00 -0.05 0.00 0.00 57.45 58.68 1vae n PHE 42 Cb 0.37 -2.16 -0.12 0.00 -0.94 0.00 0.00 39.48 36.63 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 2.88 0.00 -4.15 4.37 4.77 -1.14 -4.95 117.00 118.77 1vae n LEU 43 Ca 0.26 0.00 -0.27 0.00 -0.03 0.00 0.00 56.01 55.97 1vae n LEU 43 Cb 0.00 0.37 -0.16 0.00 -2.33 0.00 0.00 43.42 41.30 1vae n LEU 43 CO 0.77 0.37 -0.51 -0.62 -1.33 0.00 0.00 177.39 176.06 1vae s ASP 44 N -4.86 2.34 0.00 -1.43 2.15 -1.10 -5.00 116.67 108.78 1vae s ASP 44 Ca -0.08 -0.39 0.23 0.00 0.43 0.00 0.00 52.55 52.74 1vae s ASP 44 Cb 0.05 -0.73 1.10 0.00 -0.30 0.00 0.00 42.92 43.04 1vae s ASP 44 CO 0.63 0.16 1.73 -0.81 -0.17 0.00 0.00 175.17 176.71 1vae n PRO 45 N 3.21 0.25 -2.75 4.34 -0.04 -1.26 -3.27 135.00 135.48 1vae n PRO 45 Ca -0.18 0.08 -0.21 0.00 -0.04 0.00 0.00 63.50 63.15 1vae n PRO 45 Cb 0.53 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.48 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 -1.33 2.49 -4.06 0.54 8.25 -1.26 -4.83 115.22 115.02 1vae n HIS 46 Ca 0.10 -3.36 -0.27 0.00 -0.26 0.00 0.00 57.72 53.92 1vae n HIS 46 Cb 0.20 -0.31 -0.05 0.00 1.12 0.00 0.00 29.99 30.95 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 2.58 -1.71 -0.53 0.00 0.02 -1.88 0.94 113.55 112.96 1vae h SER 48 Ca -0.47 0.25 0.06 0.00 -0.84 0.00 0.00 61.79 60.78 1vae h SER 48 Cb 1.19 0.73 -0.09 0.00 0.14 0.00 0.00 62.40 64.38 1vae h SER 48 CO 0.64 -0.36 -0.52 0.00 -1.14 0.00 0.00 176.83 175.45 1vae h ALA 49 N 0.29 -0.67 -0.33 3.77 0.00 -1.93 1.16 119.26 121.54 1vae h ALA 49 Ca 0.12 0.03 0.07 0.00 0.00 0.00 0.00 54.91 55.13 1vae h ALA 49 Cb 0.57 1.17 -0.06 0.00 0.00 0.00 0.00 17.79 19.47 1vae h ALA 49 CO -0.65 -0.96 -0.07 1.03 0.00 0.00 0.00 179.25 178.60 1vae h SER 50 N -0.26 -0.27 0.00 0.00 0.87 -1.46 0.61 113.55 113.03 1vae h SER 50 Ca 0.09 0.09 0.00 0.00 -1.23 0.00 0.00 61.79 60.74 1vae h SER 50 Cb 0.49 0.19 0.00 0.00 -0.44 0.00 0.00 62.40 62.65 1vae h SER 50 CO -0.64 -0.09 0.01 -0.07 -0.53 0.00 0.00 176.83 175.51 1vae h LEU 51 N 0.02 0.00 0.14 2.23 3.38 0.32 -2.22 115.31 119.18 1vae h LEU 51 Ca 0.16 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.12 1vae h LEU 51 Cb 0.24 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.99 1vae h LEU 51 CO -0.33 0.00 -0.07 0.00 0.09 0.00 0.00 178.44 178.14 1vae h ALA 52 N 1.98 -0.19 0.00 1.53 0.00 0.69 -3.49 119.26 119.79 1vae h ALA 52 Ca 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1vae h ALA 52 Cb 0.01 0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1vae h ALA 52 CO 0.00 -0.19 0.00 0.41 0.00 0.00 0.00 179.25 179.47 1vae n GLY 53 N 1.19 -0.03 3.46 0.00 0.00 -0.46 -4.76 105.19 104.59 1vae n GLY 53 Ca -0.04 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.71 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 0.00 2.62 -0.01 4.61 0.00 -1.22 -4.90 121.76 122.86 1vae s ALA 54 Ca 0.00 -1.57 0.04 0.00 0.00 0.00 0.00 51.96 50.43 1vae s ALA 54 Cb 0.00 -0.44 -0.01 0.00 0.00 0.00 0.00 23.12 22.67 1vae s ALA 54 CO 0.00 0.46 -0.13 -1.59 0.00 0.00 0.00 175.76 174.51 1vae s LYS 55 N -2.61 1.02 -0.20 0.00 -2.85 -1.26 -4.66 119.74 109.18 1vae s LYS 55 Ca 0.21 -0.45 -0.42 0.00 -1.00 0.00 0.00 55.97 54.31 1vae s LYS 55 Cb -0.08 -0.99 -0.19 0.00 -2.06 0.00 0.00 37.83 34.51 1vae s LYS 55 CO 0.11 0.27 1.35 -1.91 0.10 0.00 0.00 175.35 175.26 1vae n GLU 56 N 2.78 0.20 0.00 1.78 2.13 -1.26 -2.86 120.64 123.40 1vae n GLU 56 Ca -0.14 0.07 0.00 0.00 0.66 0.00 0.00 57.16 57.75 1vae n GLU 56 Cb 0.56 -1.60 0.00 0.00 0.27 0.00 0.00 31.44 30.66 1vae n GLU 56 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1vae n GLY 57 N 2.75 1.74 3.65 8.31 0.00 -1.22 -5.06 105.19 115.36 1vae n GLY 57 Ca 0.24 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.86 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 -2.00 6.76 -0.63 1.61 1.11 -1.14 -4.74 116.67 117.64 1vae s ASP 58 Ca 0.00 0.92 -0.15 0.00 0.18 0.00 0.00 52.55 53.50 1vae s ASP 58 Cb 0.00 -2.38 0.16 0.00 1.07 0.00 0.00 42.92 41.76 1vae s ASP 58 CO 0.00 -0.35 0.58 -0.31 1.18 0.00 0.00 175.17 176.27 1vae s TYR 59 N 2.18 3.41 -0.82 4.23 1.51 -1.24 -0.42 117.35 126.20 1vae s TYR 59 Ca 0.31 -1.52 -0.25 0.00 -1.01 0.00 0.00 57.07 54.61 1vae s TYR 59 Cb -0.16 -3.80 -0.19 0.00 -0.11 0.00 0.00 41.96 37.70 1vae s TYR 59 CO 0.10 -1.01 2.48 -0.89 -1.11 0.00 0.00 175.55 175.12 1vae n ILE 60 N 4.85 -0.03 0.02 2.71 5.41 -0.38 -2.85 119.36 129.10 1vae n ILE 60 Ca -0.05 -0.40 -0.05 0.00 1.00 0.00 0.00 62.75 63.25 1vae n ILE 60 Cb 0.42 -1.30 -0.10 0.00 -0.71 0.00 0.00 39.64 37.95 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 7.69 0.90 -1.86 1.39 3.04 -0.84 -3.40 116.25 123.17 1vae h VAL 61 Ca -0.08 -2.58 0.11 0.00 -1.01 0.00 0.00 66.70 63.14 1vae h VAL 61 Cb 1.22 2.38 -0.19 0.00 -2.01 0.00 0.00 31.29 32.69 1vae h VAL 61 CO 1.31 0.51 0.55 -0.44 -1.01 0.00 0.00 177.57 178.50 1vae s SER 62 N -6.15 -0.34 -0.11 3.17 0.01 -1.12 0.30 113.70 109.46 1vae s SER 62 Ca -0.02 0.19 -0.01 0.00 1.31 0.00 0.00 55.95 57.42 1vae s SER 62 Cb 0.08 0.32 0.03 0.00 0.21 0.00 0.00 66.02 66.67 1vae s SER 62 CO 0.81 -0.45 -0.03 -0.63 0.41 0.00 0.00 173.24 173.36 1vae s ILE 63 N -2.09 0.71 0.00 1.44 1.01 -1.09 -1.00 121.20 120.18 1vae s ILE 63 Ca 0.02 -0.19 0.00 0.00 0.00 0.00 0.00 60.65 60.48 1vae s ILE 63 Cb -0.01 -0.86 0.00 0.00 0.01 0.00 0.00 42.46 41.60 1vae s ILE 63 CO -0.03 0.23 0.00 0.00 0.00 0.00 0.00 174.94 175.13 1vae n GLN 64 N 5.03 0.00 0.00 2.79 1.13 0.27 -2.49 117.38 124.11 1vae n GLN 64 Ca -0.10 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 54.96 1vae n GLN 64 Cb 0.49 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.84 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 0.00 0.00 3.26 1.08 0.00 -1.26 -4.79 105.19 103.48 1vae n GLY 65 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.77 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 0.00 1.69 -0.32 1.61 1.01 -1.04 -5.10 120.40 118.26 1vae s VAL 66 Ca 0.00 -1.30 -0.29 0.00 0.00 0.00 0.00 61.98 60.39 1vae s VAL 66 Cb 0.00 -1.49 0.01 0.00 0.00 0.00 0.00 36.38 34.90 1vae s VAL 66 CO 0.00 0.13 1.14 -0.62 0.00 0.00 0.00 175.10 175.75 1vae s ASP 67 N -1.39 6.85 -0.36 3.32 -1.08 -1.26 -2.67 116.67 120.08 1vae s ASP 67 Ca 0.07 1.07 0.08 0.00 -0.52 0.00 0.00 52.55 53.24 1vae s ASP 67 Cb -0.09 -2.54 0.44 0.00 -1.46 0.00 0.00 42.92 39.27 1vae s ASP 67 CO 0.02 -0.95 1.13 0.00 0.52 0.00 0.00 175.17 175.89 1vae n LYS 69 N -0.55 0.65 -0.04 0.00 4.81 -1.21 -4.17 118.16 117.65 1vae n LYS 69 Ca 0.37 -0.08 -0.06 0.00 -0.87 0.00 0.00 58.31 57.67 1vae n LYS 69 Cb 0.80 -1.43 -0.03 0.00 0.02 0.00 0.00 35.03 34.39 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 -1.79 0.00 -1.22 5.64 7.02 -1.26 -3.98 117.44 121.84 1vae n TRP 70 Ca 0.00 0.00 -0.39 0.00 -1.02 0.00 0.00 57.50 56.10 1vae n TRP 70 Cb 0.40 -0.28 0.02 0.00 -2.42 0.00 0.00 31.31 29.02 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 -2.95 -3.84 0.00 -0.99 4.77 -1.26 -4.74 117.00 107.99 1vae n LEU 71 Ca -0.14 0.59 0.00 0.00 -0.03 0.00 0.00 56.01 56.44 1vae n LEU 71 Cb 0.63 -0.85 0.00 0.00 -2.33 0.00 0.00 43.42 40.87 1vae n LEU 71 CO 0.05 -4.90 0.00 0.35 -1.33 0.00 0.00 177.39 171.56 1vae n THR 72 N -1.65 0.00 -0.03 -5.08 -2.24 -1.26 -4.51 114.28 99.51 1vae n THR 72 Ca 0.07 0.00 -0.15 0.00 -2.27 0.00 0.00 64.05 61.70 1vae n THR 72 Cb 0.48 -1.10 -0.10 0.00 -2.10 0.00 0.00 70.33 67.51 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 0.00 1.46 0.71 2.28 2.07 -1.92 -2.94 116.25 117.91 1vae h VAL 73 Ca 0.00 -1.72 -0.03 0.00 0.82 0.00 0.00 66.70 65.77 1vae h VAL 73 Cb 0.00 2.43 -0.00 0.00 -1.52 0.00 0.00 31.29 32.20 1vae h VAL 73 CO 0.00 0.48 -0.41 -1.28 0.02 0.00 0.00 177.57 176.38 1vae h SER 74 N -0.29 -1.04 -0.01 0.57 0.87 -1.95 0.60 113.55 112.31 1vae h SER 74 Ca -0.02 0.05 0.00 0.00 -1.23 0.00 0.00 61.79 60.60 1vae h SER 74 Cb 0.92 0.30 -0.00 0.00 -0.44 0.00 0.00 62.40 63.18 1vae h SER 74 CO 0.05 -0.65 -0.00 -0.33 -0.53 0.00 0.00 176.83 175.37 1vae h GLU 75 N -1.04 -0.00 -0.61 2.24 5.08 -1.95 0.17 114.58 118.47 1vae h GLU 75 Ca -0.10 0.00 0.08 0.00 -1.00 0.00 0.00 59.36 58.34 1vae h GLU 75 Cb 0.83 0.00 -0.10 0.00 0.50 0.00 0.00 28.75 29.98 1vae h GLU 75 CO 0.11 -0.00 -0.49 0.28 -1.00 0.00 0.00 179.01 177.91 1vae h VAL 76 N -0.00 0.04 -0.92 3.13 2.07 -1.54 0.50 116.25 119.53 1vae h VAL 76 Ca 0.00 0.00 0.32 0.00 0.82 0.00 0.00 66.70 67.85 1vae h VAL 76 Cb 0.00 0.04 -0.17 0.00 -1.52 0.00 0.00 31.29 29.65 1vae h VAL 76 CO -0.01 0.00 0.27 0.23 0.02 0.00 0.00 177.57 178.09 1vae n MET 77 N -5.38 -0.06 -0.03 1.57 2.81 0.20 0.19 117.12 116.42 1vae n MET 77 Ca 0.01 1.32 -0.16 0.00 -1.81 0.00 0.00 57.70 57.06 1vae n MET 77 Cb 0.34 -2.24 -0.09 0.00 -0.71 0.00 0.00 33.22 30.52 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 0.44 -0.20 0.03 1.57 0.17 0.42 116.57 119.01 1vae h LYS 78 Ca 0.68 -0.37 0.06 0.00 -1.87 0.00 0.00 60.65 59.15 1vae h LYS 78 Cb 1.64 0.08 -0.01 0.00 0.08 0.00 0.00 32.23 34.02 1vae h LYS 78 CO -0.78 1.00 0.21 1.25 -0.57 0.00 0.00 179.45 180.57 1vae h LEU 79 N -0.00 0.00 0.06 2.94 6.46 0.47 0.27 115.31 125.51 1vae h LEU 79 Ca -0.03 0.00 -0.22 0.00 -0.12 0.00 0.00 57.88 57.51 1vae h LEU 79 Cb 1.09 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 41.01 1vae h LEU 79 CO 0.09 0.00 -1.16 -0.07 -0.62 0.00 0.00 178.44 176.68 1vae h LEU 80 N 0.00 0.19 -0.31 2.25 3.38 0.25 -3.32 115.31 117.75 1vae h LEU 80 Ca 0.09 -0.76 0.06 0.00 0.09 0.00 0.00 57.88 57.36 1vae h LEU 80 Cb 0.52 -0.06 -0.06 0.00 0.09 0.00 0.00 40.66 41.15 1vae h LEU 80 CO -0.00 1.49 -0.08 0.11 0.09 0.00 0.00 178.44 180.05 1vae h LYS 81 N -0.63 -0.01 -0.81 1.13 1.57 0.34 -0.97 116.57 117.19 1vae h LYS 81 Ca -0.28 0.00 0.19 0.00 -1.87 0.00 0.00 60.65 58.69 1vae h LYS 81 Cb 1.50 0.00 -0.14 0.00 0.08 0.00 0.00 32.23 33.67 1vae h LYS 81 CO -0.04 -0.01 -0.00 1.03 -0.57 0.00 0.00 179.45 179.86 1vae h SER 82 N -0.01 -0.40 -0.43 0.86 0.87 -0.67 0.75 113.55 114.52 1vae h SER 82 Ca 0.15 0.22 -0.30 0.00 -1.23 0.00 0.00 61.79 60.63 1vae h SER 82 Cb 0.23 0.38 -0.13 0.00 -0.44 0.00 0.00 62.40 62.45 1vae h SER 82 CO -0.32 -0.22 0.38 0.49 -0.53 0.00 0.00 176.83 176.64 1vae n PHE 83 N -5.38 1.41 -2.30 2.24 3.72 -0.38 -4.93 117.46 111.83 1vae n PHE 83 Ca 0.15 -1.89 -0.42 0.00 -0.05 0.00 0.00 57.45 55.24 1vae n PHE 83 Cb 0.53 -0.92 -0.03 0.00 -0.94 0.00 0.00 39.48 38.12 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 0.34 1.87 -0.91 1.37 0.00 0.26 -2.79 107.32 107.45 1vae s GLY 84 Ca 0.28 0.75 -0.03 0.00 0.00 0.00 0.00 44.72 45.72 1vae s GLY 84 CO -0.00 2.46 0.41 0.61 0.00 0.00 0.00 173.10 176.58 1vae n GLY 85 N 3.60 -0.02 2.74 0.20 0.00 0.15 -4.95 105.19 106.90 1vae n GLY 85 Ca 0.13 -0.22 -0.18 0.00 0.00 0.00 0.00 46.02 45.75 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 -5.30 -0.04 -0.23 1.61 2.02 -1.12 -4.90 118.70 110.74 1vae s GLU 86 Ca 0.21 0.39 -0.35 0.00 0.02 0.00 0.00 54.97 55.24 1vae s GLU 86 Cb -0.09 -0.40 -0.11 0.00 0.10 0.00 0.00 34.13 33.63 1vae s GLU 86 CO 0.25 -0.29 2.01 -1.91 0.02 0.00 0.00 175.26 175.35 1vae n GLU 87 N 5.08 1.59 -4.45 1.61 2.13 -1.26 -3.93 120.64 121.41 1vae n GLU 87 Ca -0.08 0.53 -0.22 0.00 0.66 0.00 0.00 57.16 58.04 1vae n GLU 87 Cb 0.50 -2.56 -0.10 0.00 0.27 0.00 0.00 31.44 29.55 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 5.65 1.74 -0.39 6.31 -7.23 -0.52 -4.98 120.40 120.98 1vae s VAL 88 Ca 1.01 -2.14 -0.05 0.00 -1.81 0.00 0.00 61.98 58.99 1vae s VAL 88 Cb -0.77 -2.49 0.08 0.00 0.56 0.00 0.00 36.38 33.76 1vae s VAL 88 CO 0.51 -0.28 0.18 -0.70 -0.31 0.00 0.00 175.10 174.50 1vae s GLU 89 N -3.71 2.32 -0.01 4.82 2.12 -1.26 -3.20 118.70 119.78 1vae s GLU 89 Ca 0.30 -1.56 -0.17 0.00 0.36 0.00 0.00 54.97 53.90 1vae s GLU 89 Cb 0.04 -3.56 -0.06 0.00 0.26 0.00 0.00 34.13 30.81 1vae s GLU 89 CO 0.13 -0.92 0.48 1.41 -0.54 0.00 0.00 175.26 175.81 1vae s MET 90 N 1.27 4.13 -0.06 4.30 -2.45 -1.00 0.95 119.30 126.43 1vae s MET 90 Ca 0.03 0.53 0.04 0.00 -1.25 0.00 0.00 55.69 55.05 1vae s MET 90 Cb -0.22 -3.29 -0.00 0.00 1.25 0.00 0.00 34.83 32.57 1vae s MET 90 CO -0.01 0.52 -0.20 0.15 1.05 0.00 0.00 175.02 176.53 1vae s LYS 91 N -0.61 2.29 0.02 4.11 3.01 -0.17 -1.32 119.74 127.08 1vae s LYS 91 Ca 0.26 -0.73 0.02 0.00 -1.01 0.00 0.00 55.97 54.51 1vae s LYS 91 Cb -0.17 -1.88 -0.02 0.00 -1.01 0.00 0.00 37.83 34.75 1vae s LYS 91 CO 0.14 0.24 -0.06 0.14 0.51 0.00 0.00 175.35 176.32 1vae s VAL 92 N 0.13 0.46 0.02 3.17 -7.23 -1.26 -0.33 120.40 115.37 1vae s VAL 92 Ca -0.09 -0.73 0.08 0.00 -1.81 0.00 0.00 61.98 59.43 1vae s VAL 92 Cb -0.14 -0.49 -0.03 0.00 0.56 0.00 0.00 36.38 36.28 1vae s VAL 92 CO 0.04 -0.19 -0.22 0.68 -0.31 0.00 0.00 175.10 175.10 1vae s VAL 93 N -0.89 2.44 0.10 1.32 -7.23 -1.13 -1.06 120.40 113.96 1vae s VAL 93 Ca -0.06 -1.20 -0.23 0.00 -1.81 0.00 0.00 61.98 58.68 1vae s VAL 93 Cb -0.07 -1.96 -0.07 0.00 0.56 0.00 0.00 36.38 34.84 1vae s VAL 93 CO 0.00 0.42 0.69 -0.44 -0.31 0.00 0.00 175.10 175.46 1vae s SER 94 N -1.14 7.22 -0.09 4.85 0.01 -1.26 -3.68 113.70 119.61 1vae s SER 94 Ca 0.12 1.45 -0.19 0.00 1.31 0.00 0.00 55.95 58.64 1vae s SER 94 Cb -0.10 -2.44 -0.04 0.00 0.21 0.00 0.00 66.02 63.65 1vae s SER 94 CO 0.02 0.19 0.53 -0.22 0.41 0.00 0.00 173.24 174.17 1vae s LEU 95 N -0.85 4.31 -0.13 2.44 2.96 -1.26 0.14 118.68 126.28 1vae s LEU 95 Ca 0.34 0.94 0.02 0.00 -0.22 0.00 0.00 54.13 55.21 1vae s LEU 95 Cb -0.21 -2.80 0.01 0.00 0.50 0.00 0.00 46.19 43.70 1vae s LEU 95 CO 0.23 0.01 -0.19 -0.76 -1.32 0.00 0.00 176.35 174.31 1vae s LEU 96 N 0.46 1.96 0.20 -0.68 2.01 0.12 -4.95 118.68 117.80 1vae s LEU 96 Ca 0.29 -0.55 0.09 0.00 0.01 0.00 0.00 54.13 53.97 1vae s LEU 96 Cb -0.16 -1.32 -0.04 0.00 0.01 0.00 0.00 46.19 44.68 1vae s LEU 96 CO 0.13 0.04 -0.10 -1.81 1.01 0.00 0.00 176.35 175.62 1vae s ASP 97 N 0.96 4.20 0.74 2.29 1.01 -1.26 -2.74 116.67 121.88 1vae s ASP 97 Ca -0.05 -0.63 -0.04 0.00 0.71 0.00 0.00 52.55 52.54 1vae s ASP 97 Cb -0.15 -0.69 0.12 0.00 1.01 0.00 0.00 42.92 43.22 1vae s ASP 97 CO -0.04 0.09 1.03 -0.94 0.21 0.00 0.00 175.17 175.53 1vae s SER 98 N -2.96 4.28 -0.22 0.27 1.04 -1.26 -4.80 113.70 110.04 1vae s SER 98 Ca 0.26 -0.12 -0.02 0.00 0.48 0.00 0.00 55.95 56.55 1vae s SER 98 Cb -0.08 -0.28 0.01 0.00 0.10 0.00 0.00 66.02 65.77 1vae s SER 98 CO 0.15 -1.92 0.04 0.41 0.98 0.00 0.00 173.24 172.91 1vae n THR 99 N -2.96-10.00 -0.50 2.02 -1.04 -1.26 -4.94 114.28 95.60 1vae n THR 99 Ca 0.14 1.69 -0.29 0.00 -2.04 0.00 0.00 64.05 63.55 1vae n THR 99 Cb 0.60 -6.01 0.25 0.00 -1.82 0.00 0.00 70.33 63.35 1vae n THR 99 CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 1vae s SER 100 N -1.31 1.01 -0.21 8.00 1.04 -1.26 -5.00 113.70 115.97 1vae s SER 100 Ca -0.05 1.63 -0.03 0.00 0.48 0.00 0.00 55.95 57.99 1vae s SER 100 Cb 0.00 -2.37 -0.01 0.00 0.10 0.00 0.00 66.02 63.74 1vae s SER 100 CO 0.62 -4.20 -0.07 -0.55 0.98 0.00 0.00 173.24 170.02 1vae s SER 101 N -2.45 4.16 -0.26 7.02 0.15 -1.26 -5.08 113.70 115.99 1vae s SER 101 Ca 0.69 -0.41 -0.10 0.00 0.70 0.00 0.00 55.95 56.83 1vae s SER 101 Cb -0.25 -1.70 0.11 0.00 -1.71 0.00 0.00 66.02 62.46 1vae s SER 101 CO 0.64 0.01 0.57 -0.32 1.20 0.00 0.00 173.24 175.34 1vae s MET 102 N 1.32 0.51 -0.28 5.44 1.75 -1.26 -5.15 119.30 121.63 1vae s MET 102 Ca 0.04 1.27 -0.20 0.00 -1.25 0.00 0.00 55.69 55.55 1vae s MET 102 Cb -0.14 0.57 0.13 0.00 2.84 0.00 0.00 34.83 38.22 1vae s MET 102 CO -0.03 -0.20 0.95 -1.58 -0.65 0.00 0.00 175.02 173.50 1vae s HIS 103 N 2.55 -0.61 0.00 4.11 5.04 -1.26 -5.18 115.29 119.94 1vae s HIS 103 Ca -0.06 1.31 0.00 0.00 -1.54 0.00 0.00 55.06 54.77 1vae s HIS 103 Cb -0.11 0.39 0.00 0.00 0.04 0.00 0.00 32.58 32.90 1vae s HIS 103 CO -0.17 -0.30 0.00 -1.71 -2.34 0.00 0.00 174.74 170.22 1vae n ASN 104 N 3.19 0.00 -4.47 9.88 2.85 -1.26 -5.18 115.26 120.27 1vae n ASN 104 Ca -0.16 0.00 -0.23 0.00 -0.11 0.00 0.00 54.58 54.08 1vae n ASN 104 Cb 0.57 0.00 -0.11 0.00 1.24 0.00 0.00 39.78 41.49 1vae n ASN 104 CO 0.00 0.00 0.00 -0.75 -2.11 0.00 0.00 177.26 174.40 1vae s LYS 105 N -2.00 1.72 -0.29 1.20 2.20 -1.26 -5.16 119.74 116.15 1vae s LYS 105 Ca 0.00 -1.96 -0.14 0.00 -0.36 0.00 0.00 55.97 53.51 1vae s LYS 105 Cb 0.00 -0.98 0.10 0.00 -1.51 0.00 0.00 37.83 35.44 1vae s LYS 105 CO 0.00 -0.18 0.69 -1.54 -0.36 0.00 0.00 175.35 173.96 1vae s SER 106 N -3.53 -0.98 -0.36 1.43 1.04 -1.26 -5.12 113.70 104.92 1vae s SER 106 Ca 0.35 1.50 0.05 0.00 0.48 0.00 0.00 55.95 58.33 1vae s SER 106 Cb 0.09 1.65 0.17 0.00 0.10 0.00 0.00 66.02 68.02 1vae s SER 106 CO 0.16 -0.23 0.48 -0.83 0.98 0.00 0.00 173.24 173.80 1vae s GLY 107 N 2.00 -0.65 1.03 7.32 0.00 -1.26 -5.16 107.32 110.60 1vae s GLY 107 Ca -0.09 -0.16 -0.17 0.00 0.00 0.00 0.00 44.72 44.29 1vae s GLY 107 CO -0.19 3.19 1.14 -1.55 0.00 0.00 0.00 173.10 175.68 1vae n PRO 108 N 4.63 -2.09 -4.06 2.90 -0.04 -1.26 -5.10 135.00 129.99 1vae n PRO 108 Ca 0.08 -1.79 -0.13 0.00 -0.04 0.00 0.00 63.50 61.63 1vae n PRO 108 Cb 0.51 -1.40 -0.13 0.00 -0.04 0.00 0.00 33.50 32.44 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 -4.93 0.60 0.08 3.54 0.15 -1.26 -5.16 113.70 106.73 1vae s SER 109 Ca 0.69 -0.35 -0.24 0.00 0.70 0.00 0.00 55.95 56.75 1vae s SER 109 Cb -0.04 0.01 0.06 0.00 -1.71 0.00 0.00 66.02 64.34 1vae s SER 109 CO 0.50 -0.12 0.59 -0.44 1.20 0.00 0.00 173.24 174.97 1vae s SER 110 N -0.95 -0.54 0.00 5.45 0.01 -1.26 -5.38 113.70 111.03 1vae s SER 110 Ca -0.06 0.19 0.00 0.00 1.31 0.00 0.00 55.95 57.39 1vae s SER 110 Cb -0.07 0.55 0.00 0.00 0.21 0.00 0.00 66.02 66.72 1vae s SER 110 CO -0.00 -0.82 0.00 0.61 0.41 0.00 0.00 173.24 173.44