#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vae n SER 2 N 0.00 -1.27 -1.43 1.61 2.88 -1.26 -5.11 113.62 109.05 1vae n SER 2 Ca 0.00 -2.55 0.17 0.00 -1.33 0.00 0.00 58.87 55.16 1vae n SER 2 Cb 0.00 0.09 -0.09 0.00 -0.75 0.00 0.00 64.21 63.46 1vae n SER 2 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1vae n SER 3 N 2.74 -7.72 -4.63 -3.46 7.64 -1.26 -4.87 113.62 102.07 1vae n SER 3 Ca 0.26 1.35 -0.28 0.00 1.01 0.00 0.00 58.87 61.21 1vae n SER 3 Cb 0.51 -4.86 0.20 0.00 -1.01 0.00 0.00 64.21 59.04 1vae n SER 3 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1vae s GLY 4 N -7.19 1.56 0.30 0.23 0.00 -1.26 -5.07 107.32 95.89 1vae s GLY 4 Ca 0.00 -0.32 0.04 0.00 0.00 0.00 0.00 44.72 44.44 1vae s GLY 4 CO 0.00 0.33 0.04 -1.35 0.00 0.00 0.00 173.10 172.11 1vae s SER 5 N -3.22 2.32 0.85 1.64 1.04 -1.26 -5.13 113.70 109.94 1vae s SER 5 Ca 0.66 -1.33 -0.13 0.00 0.48 0.00 0.00 55.95 55.63 1vae s SER 5 Cb -0.20 -0.08 0.05 0.00 0.10 0.00 0.00 66.02 65.89 1vae s SER 5 CO 0.59 -0.56 0.78 -1.54 0.98 0.00 0.00 173.24 173.49 1vae n SER 6 N -0.63 -0.60 0.00 7.02 3.41 -1.26 -5.01 113.62 116.55 1vae n SER 6 Ca -0.03 0.48 0.00 0.00 -0.26 0.00 0.00 58.87 59.06 1vae n SER 6 Cb 0.66 -1.34 0.00 0.00 -0.26 0.00 0.00 64.21 63.27 1vae n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1vae n GLY 7 N 1.08 0.02 2.96 5.00 0.00 -1.26 -5.01 105.19 107.98 1vae n GLY 7 Ca 0.10 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.00 1vae n GLY 7 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1vae n SER 8 N 0.00 -7.52 -3.44 1.61 7.64 -1.26 -4.09 113.62 106.56 1vae n SER 8 Ca 0.00 0.52 -0.35 0.00 1.01 0.00 0.00 58.87 60.05 1vae n SER 8 Cb 0.00 -4.66 0.03 0.00 -1.01 0.00 0.00 64.21 58.57 1vae n SER 8 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1vae n ALA 9 N -0.13 -2.34 -2.75 -0.43 0.00 -1.26 -4.91 120.51 108.69 1vae n ALA 9 Ca 0.07 0.39 -0.36 0.00 0.00 0.00 0.00 53.44 53.54 1vae n ALA 9 Cb 0.45 -2.27 -0.07 0.00 0.00 0.00 0.00 19.45 17.56 1vae n ALA 9 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1vae s SER 10 N -1.53 6.38 0.28 0.00 0.15 -1.26 -5.05 113.70 112.67 1vae s SER 10 Ca 0.35 0.45 -0.30 0.00 0.70 0.00 0.00 55.95 57.16 1vae s SER 10 Cb -0.04 -2.13 -0.10 0.00 -1.71 0.00 0.00 66.02 62.04 1vae s SER 10 CO 0.82 0.24 1.43 -0.54 1.20 0.00 0.00 173.24 176.39 1vae s LYS 11 N -0.15 4.26 0.05 5.44 1.02 -1.26 -4.96 119.74 124.13 1vae s LYS 11 Ca 0.14 2.33 0.07 0.00 0.02 0.00 0.00 55.97 58.53 1vae s LYS 11 Cb -0.12 -3.08 -0.03 0.00 -0.52 0.00 0.00 37.83 34.08 1vae s LYS 11 CO 0.03 -0.40 -0.21 0.50 -0.92 0.00 0.00 175.35 174.35 1vae s ARG 12 N -0.81 1.35 0.02 1.68 6.06 -1.26 -5.10 118.95 120.88 1vae s ARG 12 Ca 0.57 -0.97 0.07 0.00 -2.50 0.00 0.00 55.73 52.90 1vae s ARG 12 Cb -0.42 -1.48 -0.02 0.00 0.06 0.00 0.00 34.95 33.08 1vae s ARG 12 CO 0.47 0.37 -0.21 -1.58 -2.50 0.00 0.00 175.30 171.85 1vae s TRP 13 N -0.85 1.88 1.09 5.12 0.52 -1.26 -2.38 118.94 123.07 1vae s TRP 13 Ca 0.07 -0.37 -0.18 0.00 0.02 0.00 0.00 56.10 55.65 1vae s TRP 13 Cb -0.09 -1.16 0.25 0.00 -1.15 0.00 0.00 33.47 31.31 1vae s TRP 13 CO 0.02 0.04 1.21 -1.54 0.02 0.00 0.00 176.95 176.70 1vae s SER 14 N -0.86 1.92 0.45 2.95 1.04 -0.70 -4.94 113.70 113.57 1vae s SER 14 Ca 0.08 0.46 -0.22 0.00 0.48 0.00 0.00 55.95 56.75 1vae s SER 14 Cb -0.09 -0.60 -0.09 0.00 0.10 0.00 0.00 66.02 65.35 1vae s SER 14 CO 0.01 -3.49 1.05 -2.16 0.98 0.00 0.00 173.24 169.62 1vae s PRO 15 N -5.64 3.93 0.46 4.02 0.04 -1.26 -4.43 135.00 132.12 1vae s PRO 15 Ca 0.72 1.43 -0.21 0.00 0.04 0.00 0.00 61.00 62.98 1vae s PRO 15 Cb -0.07 -2.26 -0.09 0.00 0.04 0.00 0.00 34.50 32.12 1vae s PRO 15 CO 0.55 -0.33 1.04 -1.25 0.04 0.00 0.00 177.00 177.05 1vae s PRO 16 N -2.95 3.92 -0.13 0.56 0.04 -1.26 -4.59 135.00 130.59 1vae s PRO 16 Ca 0.64 1.41 -0.01 0.00 0.04 0.00 0.00 61.00 63.08 1vae s PRO 16 Cb -0.19 -2.24 -0.02 0.00 0.04 0.00 0.00 34.50 32.10 1vae s PRO 16 CO 0.23 -0.34 -0.10 -0.98 0.04 0.00 0.00 177.00 175.85 1vae s ARG 17 N -2.99 3.40 -0.65 4.56 1.70 -0.73 -4.88 118.95 119.35 1vae s ARG 17 Ca 0.64 -0.64 -0.28 0.00 -0.47 0.00 0.00 55.73 54.99 1vae s ARG 17 Cb -0.18 -2.69 0.03 0.00 -0.57 0.00 0.00 34.95 31.53 1vae s ARG 17 CO 0.22 0.26 1.22 0.20 -1.08 0.00 0.00 175.30 176.13 1vae s GLY 18 N 0.25 1.03 0.22 3.88 0.00 -1.26 -3.46 107.32 107.99 1vae s GLY 18 Ca -0.07 -1.07 -0.07 0.00 0.00 0.00 0.00 44.72 43.50 1vae s GLY 18 CO 0.05 2.55 0.51 -0.42 0.00 0.00 0.00 173.10 175.79 1vae s ILE 19 N 5.26 5.01 -0.19 0.90 1.01 -0.19 -4.96 121.20 128.04 1vae s ILE 19 Ca 0.39 0.27 -0.03 0.00 0.00 0.00 0.00 60.65 61.28 1vae s ILE 19 Cb -0.08 -3.65 0.06 0.00 0.01 0.00 0.00 42.46 38.81 1vae s ILE 19 CO 0.21 -0.10 0.04 -1.38 0.00 0.00 0.00 174.94 173.70 1vae s HIS 20 N -1.84 0.95 0.35 3.97 -3.43 -1.26 -3.02 115.29 111.01 1vae s HIS 20 Ca 0.45 -0.79 -0.14 0.00 -0.80 0.00 0.00 55.06 53.78 1vae s HIS 20 Cb -0.11 -0.99 0.03 0.00 -1.43 0.00 0.00 32.58 30.08 1vae s HIS 20 CO 0.24 -0.59 0.69 -0.59 -2.00 0.00 0.00 174.74 172.49 1vae s PHE 21 N 1.88 0.26 -0.30 0.38 -0.71 -1.25 -4.69 117.98 113.56 1vae s PHE 21 Ca -0.01 -0.80 0.00 0.00 -1.04 0.00 0.00 56.93 55.09 1vae s PHE 21 Cb -0.17 0.59 0.06 0.00 -1.21 0.00 0.00 43.02 42.30 1vae s PHE 21 CO -0.08 -1.39 -0.01 0.99 -1.34 0.00 0.00 175.22 173.39 1vae s THR 22 N -2.87 2.68 0.38 -4.49 2.01 -1.26 -2.49 115.64 109.60 1vae s THR 22 Ca 0.18 -1.63 -0.23 0.00 0.31 0.00 0.00 61.69 60.32 1vae s THR 22 Cb -0.04 -2.63 -0.15 0.00 0.01 0.00 0.00 72.50 69.69 1vae s THR 22 CO 0.12 -0.19 0.31 0.52 -0.69 0.00 0.00 174.62 174.70 1vae n VAL 23 N 4.52 1.23 -3.50 3.82 0.31 -1.25 -4.73 118.33 118.72 1vae n VAL 23 Ca -0.11 -0.50 -0.42 0.00 -0.01 0.00 0.00 64.34 63.30 1vae n VAL 23 Cb 0.43 -0.19 -0.07 0.00 -0.91 0.00 0.00 33.84 33.10 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 -1.20 2.80 -0.47 5.55 2.02 -1.26 -1.54 118.70 124.61 1vae s GLU 24 Ca 0.61 -2.05 -0.06 0.00 0.02 0.00 0.00 54.97 53.50 1vae s GLU 24 Cb -0.67 -4.05 -0.15 0.00 0.10 0.00 0.00 34.13 29.36 1vae s GLU 24 CO 0.60 -1.23 2.67 -0.85 0.02 0.00 0.00 175.26 176.47 1vae n GLU 25 N 4.49 1.96 0.00 1.61 0.28 -1.26 -2.64 120.64 125.09 1vae n GLU 25 Ca -0.01 -1.13 0.00 0.00 -0.16 0.00 0.00 57.16 55.86 1vae n GLU 25 Cb 0.41 -2.15 0.00 0.00 1.43 0.00 0.00 31.44 31.14 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 3.04 0.05 2.56 -1.84 0.00 -1.26 -5.03 105.19 102.71 1vae n GLY 26 Ca 0.42 -0.03 -0.16 0.00 0.00 0.00 0.00 46.02 46.25 1vae n GLY 26 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1vae n ASP 27 N -0.55 -1.86 -0.32 1.61 8.00 -1.08 -4.98 116.55 117.37 1vae n ASP 27 Ca 0.00 -2.67 0.10 0.00 0.71 0.00 0.00 54.79 52.93 1vae n ASP 27 Cb 0.00 0.55 0.31 0.00 -0.02 0.00 0.00 41.12 41.95 1vae n ASP 27 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 1vae h LEU 28 N 5.21 0.80 0.00 0.64 3.38 -1.95 -3.43 115.31 119.95 1vae h LEU 28 Ca 0.15 0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.17 1vae h LEU 28 Cb 1.00 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.64 1vae h LEU 28 CO 0.22 0.40 0.00 0.61 0.09 0.00 0.00 178.44 179.76 1vae n GLY 29 N -1.38 0.78 3.47 0.83 0.00 -1.26 -4.73 105.19 102.90 1vae n GLY 29 Ca 0.19 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.10 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 -2.94 -0.45 0.45 1.61 -0.12 -1.26 0.12 117.98 115.38 1vae s PHE 30 Ca 0.00 0.25 0.03 0.00 -0.05 0.00 0.00 56.93 57.16 1vae s PHE 30 Cb 0.00 0.56 -0.03 0.00 -0.63 0.00 0.00 43.02 42.92 1vae s PHE 30 CO 0.00 -0.77 0.05 -0.08 -0.05 0.00 0.00 175.22 174.37 1vae s THR 31 N -3.55 1.03 -0.05 -4.49 -1.32 -1.23 -4.94 115.64 101.09 1vae s THR 31 Ca 0.03 -2.00 0.06 0.00 -1.21 0.00 0.00 61.69 58.57 1vae s THR 31 Cb -0.01 -2.36 -0.02 0.00 -1.51 0.00 0.00 72.50 68.60 1vae s THR 31 CO -0.10 0.00 -0.23 -0.76 -2.21 0.00 0.00 174.62 171.32 1vae s LEU 32 N -3.73 2.20 0.35 9.08 1.43 -1.26 -2.01 118.68 124.74 1vae s LEU 32 Ca 0.18 -0.44 -0.12 0.00 -1.03 0.00 0.00 54.13 52.72 1vae s LEU 32 Cb 0.03 -1.41 -0.07 0.00 0.03 0.00 0.00 46.19 44.77 1vae s LEU 32 CO 0.10 0.27 0.72 -0.13 0.23 0.00 0.00 176.35 177.55 1vae s ARG 33 N -0.33 3.85 -0.32 1.70 0.52 -1.21 -4.92 118.95 118.25 1vae s ARG 33 Ca 0.02 0.49 -0.29 0.00 -0.52 0.00 0.00 55.73 55.43 1vae s ARG 33 Cb -0.12 -2.44 -0.00 0.00 0.52 0.00 0.00 34.95 32.90 1vae s ARG 33 CO 0.02 0.08 1.46 0.20 0.02 0.00 0.00 175.30 177.08 1vae s GLY 34 N -2.78 1.19 0.00 -3.53 0.00 -1.26 -4.37 107.32 96.57 1vae s GLY 34 Ca 0.51 0.12 0.00 0.00 0.00 0.00 0.00 44.72 45.36 1vae s GLY 34 CO 0.25 2.81 0.00 0.70 0.00 0.00 0.00 173.10 176.87 1vae n ASN 35 N 8.48 0.00 -3.69 1.64 5.03 -1.26 -5.04 115.26 120.42 1vae n ASN 35 Ca 0.17 0.00 -0.11 0.00 0.87 0.00 0.00 54.58 55.51 1vae n ASN 35 Cb 0.47 0.00 -0.10 0.00 -1.02 0.00 0.00 39.78 39.13 1vae n ASN 35 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.26 175.85 1vae s THR 36 N -2.04 -0.01 0.07 3.41 -4.23 -1.26 -2.61 115.64 108.96 1vae s THR 36 Ca 0.00 0.05 -0.30 0.00 -1.18 0.00 0.00 61.69 60.26 1vae s THR 36 Cb 0.00 -0.70 -0.06 0.00 1.34 0.00 0.00 72.50 73.09 1vae s THR 36 CO 0.00 0.02 1.16 -2.16 -0.54 0.00 0.00 174.62 173.10 1vae s PRO 37 N 1.12 4.46 0.97 3.99 0.04 -1.23 -4.99 135.00 139.36 1vae s PRO 37 Ca -0.07 1.72 -0.15 0.00 0.04 0.00 0.00 61.00 62.55 1vae s PRO 37 Cb -0.06 -3.35 -0.04 0.00 0.04 0.00 0.00 34.50 31.08 1vae s PRO 37 CO -0.10 -0.20 -0.11 1.33 0.04 0.00 0.00 177.00 177.96 1vae n VAL 38 N 3.75 0.00 -4.39 -0.36 0.24 -1.07 -4.78 118.33 111.71 1vae n VAL 38 Ca 0.08 -0.32 -0.25 0.00 -2.04 0.00 0.00 64.34 61.81 1vae n VAL 38 Cb 0.47 -0.36 -0.09 0.00 -1.47 0.00 0.00 33.84 32.39 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 -2.94 2.00 -0.30 7.34 -0.21 -1.26 -3.20 119.66 121.09 1vae s GLN 39 Ca 0.50 -1.77 -0.11 0.00 0.02 0.00 0.00 55.36 53.99 1vae s GLN 39 Cb -0.20 -1.88 -0.03 0.00 1.00 0.00 0.00 33.01 31.90 1vae s GLN 39 CO 0.74 0.17 0.19 0.08 -2.12 0.00 0.00 175.29 174.35 1vae s VAL 40 N -2.53 5.12 -0.97 1.09 1.01 0.67 -3.31 120.40 121.48 1vae s VAL 40 Ca 0.34 -0.07 -0.01 0.00 0.00 0.00 0.00 61.98 62.24 1vae s VAL 40 Cb -0.00 -3.52 0.31 0.00 0.00 0.00 0.00 36.38 33.17 1vae s VAL 40 CO 0.18 0.15 1.55 1.57 0.00 0.00 0.00 175.10 178.55 1vae n HIS 41 N 5.05 2.81 -1.44 5.22 -0.00 -0.85 -0.28 115.22 125.73 1vae n HIS 41 Ca -0.14 -2.84 -0.54 0.00 0.46 0.00 0.00 57.72 54.66 1vae n HIS 41 Cb 0.51 -1.09 -0.06 0.00 -0.12 0.00 0.00 29.99 29.23 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 0.41 0.28 -0.05 1.57 3.72 -1.26 -3.52 117.46 118.61 1vae n PHE 42 Ca 0.37 1.01 -0.06 0.00 -0.05 0.00 0.00 57.45 58.72 1vae n PHE 42 Cb 0.31 -2.00 -0.06 0.00 -0.94 0.00 0.00 39.48 36.78 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 1.62 1.60 -4.01 4.37 4.77 0.33 -4.94 117.00 120.74 1vae n LEU 43 Ca 0.19 -0.03 -0.28 0.00 -0.03 0.00 0.00 56.01 55.85 1vae n LEU 43 Cb 0.13 -0.11 -0.17 0.00 -2.33 0.00 0.00 43.42 40.94 1vae n LEU 43 CO 0.58 0.47 -0.48 -1.81 -1.33 0.00 0.00 177.39 174.82 1vae s ASP 44 N -4.63 2.40 0.00 -1.43 1.11 -0.11 -4.99 116.67 109.03 1vae s ASP 44 Ca -0.10 -0.41 0.21 0.00 0.18 0.00 0.00 52.55 52.43 1vae s ASP 44 Cb 0.03 -1.04 1.28 0.00 1.07 0.00 0.00 42.92 44.26 1vae s ASP 44 CO 0.31 -0.03 1.69 -0.81 1.18 0.00 0.00 175.17 177.50 1vae n PRO 45 N 4.49 0.75 -2.53 8.23 -0.04 -1.26 -2.73 135.00 141.92 1vae n PRO 45 Ca -0.17 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.19 1vae n PRO 45 Cb 0.51 -1.45 0.04 0.00 -0.04 0.00 0.00 33.50 32.56 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 -0.95 1.83 -0.09 0.54 8.25 -1.26 -4.50 115.22 119.04 1vae n HIS 46 Ca 0.16 -2.18 -0.22 0.00 -0.26 0.00 0.00 57.72 55.22 1vae n HIS 46 Cb 0.07 -0.27 -0.12 0.00 1.12 0.00 0.00 29.99 30.79 1vae n HIS 46 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1vae n SER 48 N -4.29 0.00 -0.34 0.00 7.64 -1.26 -4.96 113.62 110.41 1vae n SER 48 Ca -0.33 0.00 0.17 0.00 1.01 0.00 0.00 58.87 59.73 1vae n SER 48 Cb 0.74 0.00 0.33 0.00 -1.01 0.00 0.00 64.21 64.27 1vae n SER 48 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1vae h ALA 49 N 0.00 1.32 -0.36 -0.43 0.00 -1.93 1.78 119.26 119.64 1vae h ALA 49 Ca 0.00 0.33 -0.02 0.00 0.00 0.00 0.00 54.91 55.22 1vae h ALA 49 Cb 0.00 0.55 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 1vae h ALA 49 CO 0.00 -0.63 0.16 1.03 0.00 0.00 0.00 179.25 179.82 1vae h SER 50 N 0.01 0.49 0.35 0.00 0.87 -1.87 -1.44 113.55 111.96 1vae h SER 50 Ca 0.64 -0.15 -0.06 0.00 -1.23 0.00 0.00 61.79 60.99 1vae h SER 50 Cb 1.38 -0.13 -0.01 0.00 -0.44 0.00 0.00 62.40 63.20 1vae h SER 50 CO -0.90 0.50 -0.28 -0.07 -0.53 0.00 0.00 176.83 175.55 1vae h LEU 51 N 0.45 0.00 0.80 2.23 3.38 0.18 -3.06 115.31 119.29 1vae h LEU 51 Ca 0.12 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.05 1vae h LEU 51 Cb 0.15 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.91 1vae h LEU 51 CO -0.01 0.28 -0.39 0.00 0.09 0.00 0.00 178.44 178.41 1vae h ALA 52 N 1.72 -1.14 0.00 1.53 0.00 0.25 -3.47 119.26 118.15 1vae h ALA 52 Ca -0.00 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1vae h ALA 52 Cb 0.53 0.42 0.00 0.00 0.00 0.00 0.00 17.79 18.74 1vae h ALA 52 CO 0.04 -1.06 0.00 0.41 0.00 0.00 0.00 179.25 178.64 1vae n GLY 53 N -1.11 0.00 3.66 0.00 0.00 -0.62 -4.75 105.19 102.37 1vae n GLY 53 Ca -0.13 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.60 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 3.39 0.28 4.61 0.00 -0.94 -4.90 121.76 124.20 1vae s ALA 54 Ca 0.00 -1.90 0.06 0.00 0.00 0.00 0.00 51.96 50.12 1vae s ALA 54 Cb 0.00 0.11 -0.02 0.00 0.00 0.00 0.00 23.12 23.21 1vae s ALA 54 CO 0.00 -0.10 0.22 1.63 0.00 0.00 0.00 175.76 177.51 1vae n LYS 55 N -1.05 0.36 -3.00 0.00 5.02 -1.26 -4.60 118.16 113.64 1vae n LYS 55 Ca -0.08 -2.76 -0.34 0.00 -2.02 0.00 0.00 58.31 53.11 1vae n LYS 55 Cb 0.67 2.21 -0.06 0.00 -0.02 0.00 0.00 35.03 37.82 1vae n LYS 55 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 1vae s GLU 56 N -3.13 4.20 0.00 1.97 -6.30 -1.26 -3.52 118.70 110.66 1vae s GLU 56 Ca 0.32 0.92 0.00 0.00 -2.50 0.00 0.00 54.97 53.71 1vae s GLU 56 Cb 0.02 -2.51 0.00 0.00 0.00 0.00 0.00 34.13 31.63 1vae s GLU 56 CO 0.22 0.18 0.00 0.41 0.02 0.00 0.00 175.26 176.09 1vae n GLY 57 N -0.07 1.20 3.63 -1.50 0.00 0.62 -4.93 105.19 104.13 1vae n GLY 57 Ca 0.03 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.58 1vae n GLY 57 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1vae n ASP 58 N 0.00 2.16 -4.23 1.61 9.92 -1.23 -4.33 116.55 120.44 1vae n ASP 58 Ca 0.00 1.14 -0.42 0.00 -0.53 0.00 0.00 54.79 54.98 1vae n ASP 58 Cb 0.00 -1.33 -0.08 0.00 -0.64 0.00 0.00 41.12 39.07 1vae n ASP 58 CO 0.00 0.00 0.00 -0.31 0.13 0.00 0.00 177.20 177.02 1vae s TYR 59 N -0.03 3.40 0.23 1.24 1.51 -1.17 -0.24 117.35 122.29 1vae s TYR 59 Ca 0.72 -1.77 -0.31 0.00 -1.01 0.00 0.00 57.07 54.69 1vae s TYR 59 Cb -0.75 -3.57 -0.12 0.00 -0.11 0.00 0.00 41.96 37.42 1vae s TYR 59 CO 0.50 -1.00 1.67 0.42 -1.11 0.00 0.00 175.55 176.03 1vae s ILE 60 N 1.36 2.10 -0.10 2.71 1.01 -1.19 -2.09 121.20 125.00 1vae s ILE 60 Ca 0.06 0.08 0.02 0.00 0.00 0.00 0.00 60.65 60.80 1vae s ILE 60 Cb -0.27 -3.05 -0.08 0.00 0.01 0.00 0.00 42.46 39.08 1vae s ILE 60 CO -0.00 0.01 -0.06 1.33 0.00 0.00 0.00 174.94 176.21 1vae n VAL 61 N 3.44 0.58 -3.75 2.92 0.24 0.40 -4.31 118.33 117.85 1vae n VAL 61 Ca 0.13 -0.25 -0.11 0.00 -2.04 0.00 0.00 64.34 62.07 1vae n VAL 61 Cb 0.36 -0.85 -0.07 0.00 -1.47 0.00 0.00 33.84 31.82 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 -4.75 -0.12 -0.31 -1.34 0.01 -1.24 0.20 113.70 106.15 1vae s SER 62 Ca -0.11 -0.22 -0.01 0.00 1.31 0.00 0.00 55.95 56.91 1vae s SER 62 Cb 0.03 0.36 0.10 0.00 0.21 0.00 0.00 66.02 66.73 1vae s SER 62 CO 0.26 -0.63 0.11 -0.63 0.41 0.00 0.00 173.24 172.75 1vae s ILE 63 N -2.70 0.75 0.00 1.44 1.01 -1.23 -1.55 121.20 118.93 1vae s ILE 63 Ca -0.04 -1.35 0.00 0.00 0.00 0.00 0.00 60.65 59.26 1vae s ILE 63 Cb -0.00 -1.58 0.00 0.00 0.01 0.00 0.00 42.46 40.89 1vae s ILE 63 CO -0.04 -0.70 0.00 0.00 0.00 0.00 0.00 174.94 174.20 1vae n GLN 64 N 4.85 0.00 0.00 2.79 1.13 0.14 -2.78 117.38 123.51 1vae n GLN 64 Ca -0.02 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.04 1vae n GLN 64 Cb 0.42 -2.60 0.00 0.00 0.11 0.00 0.00 30.24 28.16 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 -2.00 1.17 3.06 1.08 0.00 -1.26 -4.90 105.19 102.34 1vae n GLY 65 Ca 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.81 1vae n GLY 65 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1vae n VAL 66 N 0.00 0.00 -3.80 1.61 3.14 -1.12 -4.94 118.33 113.23 1vae n VAL 66 Ca 0.00 -0.07 -0.36 0.00 -2.96 0.00 0.00 64.34 60.95 1vae n VAL 66 Cb 0.00 -0.52 -0.12 0.00 -1.06 0.00 0.00 33.84 32.14 1vae n VAL 66 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 1vae s ASP 67 N -1.99 5.20 -0.64 6.55 2.15 -1.26 -3.51 116.67 123.17 1vae s ASP 67 Ca 0.40 -1.96 0.03 0.00 0.43 0.00 0.00 52.55 51.45 1vae s ASP 67 Cb -0.07 -1.81 0.37 0.00 -0.30 0.00 0.00 42.92 41.11 1vae s ASP 67 CO 0.40 -0.51 1.34 0.00 -0.17 0.00 0.00 175.17 176.23 1vae n LYS 69 N -0.37 1.78 -0.04 0.00 4.81 -1.05 -3.31 118.16 119.98 1vae n LYS 69 Ca 0.41 -0.03 -0.06 0.00 -0.87 0.00 0.00 58.31 57.76 1vae n LYS 69 Cb 0.44 -1.29 -0.05 0.00 0.02 0.00 0.00 35.03 34.16 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 -2.30 0.00 -1.18 5.64 7.02 -1.26 -3.58 117.44 121.78 1vae n TRP 70 Ca -0.15 0.00 -0.38 0.00 -1.02 0.00 0.00 57.50 55.96 1vae n TRP 70 Cb 0.74 -0.37 0.02 0.00 -2.42 0.00 0.00 31.31 29.28 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 -2.60 -4.14 0.00 -0.99 4.77 -1.26 -4.75 117.00 108.02 1vae n LEU 71 Ca -0.15 0.55 0.00 0.00 -0.03 0.00 0.00 56.01 56.37 1vae n LEU 71 Cb 0.70 -0.82 0.00 0.00 -2.33 0.00 0.00 43.42 40.97 1vae n LEU 71 CO 0.12 -5.01 0.00 0.35 -1.33 0.00 0.00 177.39 171.52 1vae n THR 72 N -1.71 0.00 -0.03 -5.08 -2.24 -1.26 -4.56 114.28 99.40 1vae n THR 72 Ca 0.06 0.00 -0.14 0.00 -2.27 0.00 0.00 64.05 61.69 1vae n THR 72 Cb 0.48 -1.40 -0.11 0.00 -2.10 0.00 0.00 70.33 67.21 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 1.52 0.34 2.28 2.07 -1.82 -2.78 116.25 117.86 1vae h VAL 73 Ca 0.00 -1.76 -0.01 0.00 0.82 0.00 0.00 66.70 65.75 1vae h VAL 73 Cb 0.00 2.61 -0.01 0.00 -1.52 0.00 0.00 31.29 32.37 1vae h VAL 73 CO 0.00 0.48 -0.30 -1.28 0.02 0.00 0.00 177.57 176.48 1vae h SER 74 N -0.50 -0.82 -0.80 0.57 0.87 -1.95 1.17 113.55 112.09 1vae h SER 74 Ca -0.01 0.06 0.09 0.00 -1.23 0.00 0.00 61.79 60.69 1vae h SER 74 Cb 0.86 0.27 -0.11 0.00 -0.44 0.00 0.00 62.40 62.98 1vae h SER 74 CO 0.03 -0.41 -0.54 -0.33 -0.53 0.00 0.00 176.83 175.05 1vae h GLU 75 N -0.63 -0.12 -0.06 2.24 5.08 -1.95 0.84 114.58 119.97 1vae h GLU 75 Ca -0.04 0.01 0.03 0.00 -1.00 0.00 0.00 59.36 58.35 1vae h GLU 75 Cb 0.54 0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.79 1vae h GLU 75 CO -0.02 -0.08 -0.10 0.28 -1.00 0.00 0.00 179.01 178.09 1vae h VAL 76 N -0.13 0.73 -0.70 3.13 2.07 -1.34 0.87 116.25 120.88 1vae h VAL 76 Ca 0.16 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.83 1vae h VAL 76 Cb 0.50 0.73 -0.11 0.00 -1.52 0.00 0.00 31.29 30.89 1vae h VAL 76 CO -0.83 0.00 0.12 0.24 0.02 0.00 0.00 177.57 177.12 1vae h MET 77 N -0.14 0.22 -0.25 1.57 2.86 0.42 1.00 114.93 120.60 1vae h MET 77 Ca 0.06 -0.01 -0.19 0.00 -2.06 0.00 0.00 59.70 57.50 1vae h MET 77 Cb 0.23 -0.05 0.00 0.00 0.06 0.00 0.00 31.60 31.84 1vae h MET 77 CO -0.15 0.14 -0.58 0.87 1.06 0.00 0.00 176.91 178.26 1vae h LYS 78 N 0.22 0.79 -0.40 1.72 1.57 0.13 0.74 116.57 121.34 1vae h LYS 78 Ca 0.38 -0.52 -0.02 0.00 -1.87 0.00 0.00 60.65 58.63 1vae h LYS 78 Cb 0.64 0.07 -0.02 0.00 0.08 0.00 0.00 32.23 33.00 1vae h LYS 78 CO -0.51 1.15 0.18 1.25 -0.57 0.00 0.00 179.45 180.95 1vae h LEU 79 N 0.60 0.50 0.07 2.94 6.46 0.33 0.27 115.31 126.48 1vae h LEU 79 Ca 0.00 -0.04 -0.17 0.00 -0.12 0.00 0.00 57.88 57.55 1vae h LEU 79 Cb 1.18 -0.13 -0.00 0.00 -0.73 0.00 0.00 40.66 40.98 1vae h LEU 79 CO 0.12 0.44 -0.84 -0.07 -0.62 0.00 0.00 178.44 177.47 1vae h LEU 80 N 0.56 0.23 -0.24 2.25 3.38 0.11 -3.30 115.31 118.30 1vae h LEU 80 Ca 0.14 -0.86 0.06 0.00 0.09 0.00 0.00 57.88 57.31 1vae h LEU 80 Cb 0.08 -0.08 -0.07 0.00 0.09 0.00 0.00 40.66 40.69 1vae h LEU 80 CO -0.02 1.37 -0.20 0.11 0.09 0.00 0.00 178.44 179.79 1vae h LYS 81 N -0.63 -0.19 -1.02 1.13 1.79 0.77 0.11 116.57 118.53 1vae h LYS 81 Ca -0.19 0.01 0.30 0.00 -2.18 0.00 0.00 60.65 58.60 1vae h LYS 81 Cb 1.44 0.04 -0.14 0.00 -1.58 0.00 0.00 32.23 32.00 1vae h LYS 81 CO 0.02 -0.13 0.59 1.03 -1.08 0.00 0.00 179.45 179.88 1vae h SER 82 N -0.20 0.55 -0.44 0.86 0.87 -0.61 1.18 113.55 115.76 1vae h SER 82 Ca 0.14 0.17 -0.26 0.00 -1.23 0.00 0.00 61.79 60.61 1vae h SER 82 Cb 0.41 0.10 -0.13 0.00 -0.44 0.00 0.00 62.40 62.34 1vae h SER 82 CO -0.36 -0.06 0.33 0.49 -0.53 0.00 0.00 176.83 176.70 1vae n PHE 83 N -4.98 1.38 -2.08 2.24 3.72 0.35 -4.93 117.46 113.17 1vae n PHE 83 Ca 0.30 -1.46 -0.42 0.00 -0.05 0.00 0.00 57.45 55.83 1vae n PHE 83 Cb 0.93 -0.72 -0.03 0.00 -0.94 0.00 0.00 39.48 38.72 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 0.15 1.71 -1.12 1.37 0.00 0.40 -2.03 107.32 107.80 1vae s GLY 84 Ca 0.27 1.04 0.00 0.00 0.00 0.00 0.00 44.72 46.03 1vae s GLY 84 CO 0.02 2.68 0.00 0.61 0.00 0.00 0.00 173.10 176.42 1vae n GLY 85 N 3.80 0.54 2.92 0.20 0.00 -0.59 -4.87 105.19 107.19 1vae n GLY 85 Ca 0.14 -0.43 -0.25 0.00 0.00 0.00 0.00 46.02 45.48 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 -3.85 1.39 0.11 1.61 2.02 -0.86 -4.92 118.70 114.20 1vae s GLU 86 Ca 0.00 -0.24 -0.31 0.00 0.02 0.00 0.00 54.97 54.44 1vae s GLU 86 Cb 0.00 -1.39 -0.10 0.00 0.10 0.00 0.00 34.13 32.74 1vae s GLU 86 CO 0.00 -0.18 1.82 -2.00 0.02 0.00 0.00 175.26 174.92 1vae s GLU 87 N 1.38 4.14 0.43 1.61 2.12 -1.26 -3.90 118.70 123.22 1vae s GLU 87 Ca -0.02 2.56 0.04 0.00 0.36 0.00 0.00 54.97 57.92 1vae s GLU 87 Cb -0.14 -3.65 -0.02 0.00 0.26 0.00 0.00 34.13 30.59 1vae s GLU 87 CO -0.04 -0.84 0.16 0.14 -0.54 0.00 0.00 175.26 174.14 1vae s VAL 88 N 2.90 0.46 -0.32 3.70 -7.23 -1.04 -5.02 120.40 113.85 1vae s VAL 88 Ca 0.81 -2.00 0.03 0.00 -1.81 0.00 0.00 61.98 59.00 1vae s VAL 88 Cb -0.45 -2.28 0.10 0.00 0.56 0.00 0.00 36.38 34.31 1vae s VAL 88 CO 0.36 0.00 0.05 -0.70 -0.31 0.00 0.00 175.10 174.50 1vae s GLU 89 N -3.63 1.34 0.00 4.82 2.12 -1.26 -3.78 118.70 118.31 1vae s GLU 89 Ca 0.22 -1.59 -0.16 0.00 0.36 0.00 0.00 54.97 53.80 1vae s GLU 89 Cb 0.01 -2.85 -0.06 0.00 0.26 0.00 0.00 34.13 31.50 1vae s GLU 89 CO 0.16 -0.91 0.46 1.41 -0.54 0.00 0.00 175.26 175.84 1vae s MET 90 N 1.12 4.06 -0.13 4.30 -2.45 -1.17 0.25 119.30 125.28 1vae s MET 90 Ca 0.09 0.51 0.02 0.00 -1.25 0.00 0.00 55.69 55.05 1vae s MET 90 Cb -0.19 -3.26 -0.00 0.00 1.25 0.00 0.00 34.83 32.64 1vae s MET 90 CO -0.12 0.60 -0.18 0.15 1.05 0.00 0.00 175.02 176.52 1vae s LYS 91 N -0.85 3.19 0.07 4.11 3.01 -0.59 -1.02 119.74 127.65 1vae s LYS 91 Ca 0.25 -0.79 0.06 0.00 -1.01 0.00 0.00 55.97 54.49 1vae s LYS 91 Cb -0.17 -2.50 -0.03 0.00 -1.01 0.00 0.00 37.83 34.12 1vae s LYS 91 CO 0.15 0.13 -0.17 0.14 0.51 0.00 0.00 175.35 176.11 1vae s VAL 92 N 0.51 1.33 0.21 3.17 -7.23 -1.23 -0.45 120.40 116.71 1vae s VAL 92 Ca -0.12 -1.32 0.07 0.00 -1.81 0.00 0.00 61.98 58.81 1vae s VAL 92 Cb -0.16 -1.23 -0.05 0.00 0.56 0.00 0.00 36.38 35.50 1vae s VAL 92 CO 0.05 -0.11 -0.13 0.68 -0.31 0.00 0.00 175.10 175.28 1vae s VAL 93 N -1.13 1.68 0.04 1.32 -7.23 -0.89 -1.78 120.40 112.41 1vae s VAL 93 Ca 0.02 -2.19 -0.01 0.00 -1.81 0.00 0.00 61.98 57.98 1vae s VAL 93 Cb -0.10 -2.06 -0.04 0.00 0.56 0.00 0.00 36.38 34.74 1vae s VAL 93 CO 0.03 -0.58 0.20 -0.44 -0.31 0.00 0.00 175.10 173.99 1vae s SER 94 N -3.31 6.35 -0.38 4.85 0.01 -1.26 -3.05 113.70 116.91 1vae s SER 94 Ca 0.23 0.29 -0.16 0.00 1.31 0.00 0.00 55.95 57.62 1vae s SER 94 Cb -0.00 -1.97 0.00 0.00 0.21 0.00 0.00 66.02 64.26 1vae s SER 94 CO 0.07 0.20 0.36 -0.22 0.41 0.00 0.00 173.24 174.07 1vae s LEU 95 N -2.30 4.69 0.00 2.44 0.20 -1.26 -1.71 118.68 120.73 1vae s LEU 95 Ca 0.32 -0.50 0.00 0.00 0.69 0.00 0.00 54.13 54.65 1vae s LEU 95 Cb -0.13 -2.31 0.00 0.00 -0.43 0.00 0.00 46.19 43.32 1vae s LEU 95 CO 0.25 -0.42 0.00 0.18 -0.29 0.00 0.00 176.35 176.06 1vae n LEU 96 N 5.39 0.00 0.00 -0.68 7.99 -1.00 -5.02 117.00 123.68 1vae n LEU 96 Ca -0.09 0.00 0.00 0.00 -0.01 0.00 0.00 56.01 55.91 1vae n LEU 96 Cb 0.48 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 43.79 1vae n LEU 96 CO 0.42 -0.36 0.00 -0.67 -1.51 0.00 0.00 177.39 175.27 1vae n ASP 97 N -2.18 0.00 -4.28 -1.43 2.03 -1.26 -4.74 116.55 104.69 1vae n ASP 97 Ca 0.00 0.00 -0.34 0.00 0.52 0.00 0.00 54.79 54.97 1vae n ASP 97 Cb 0.00 0.00 0.11 0.00 -0.72 0.00 0.00 41.12 40.51 1vae n ASP 97 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 1vae n SER 98 N 0.00 -2.96 -0.48 1.67 7.64 -1.26 -4.93 113.62 113.30 1vae n SER 98 Ca 0.00 0.19 0.07 0.00 1.01 0.00 0.00 58.87 60.14 1vae n SER 98 Cb 0.00 -1.02 0.17 0.00 -1.01 0.00 0.00 64.21 62.35 1vae n SER 98 CO 0.00 0.00 0.00 1.07 -3.01 0.00 0.00 175.04 173.10 1vae n THR 99 N -3.55 1.92 -2.67 0.44 5.66 -1.26 -5.05 114.28 109.76 1vae n THR 99 Ca 0.03 -2.72 -0.29 0.00 -3.05 0.00 0.00 64.05 58.02 1vae n THR 99 Cb 0.57 -0.15 -0.02 0.00 -1.55 0.00 0.00 70.33 69.19 1vae n THR 99 CO 0.00 0.00 0.00 -0.44 -3.05 0.00 0.00 175.07 171.58 1vae s SER 100 N -2.99 6.41 -0.11 1.09 0.01 -1.26 -5.09 113.70 111.76 1vae s SER 100 Ca 0.35 1.10 -0.30 0.00 1.31 0.00 0.00 55.95 58.41 1vae s SER 100 Cb 0.33 -2.32 0.11 0.00 0.21 0.00 0.00 66.02 64.36 1vae s SER 100 CO -0.04 -0.51 0.91 -0.55 0.41 0.00 0.00 173.24 173.46 1vae s SER 101 N -3.58 -0.44 0.57 2.44 0.15 -1.26 -5.15 113.70 106.44 1vae s SER 101 Ca 0.50 0.43 0.00 0.00 0.70 0.00 0.00 55.95 57.58 1vae s SER 101 Cb -0.10 0.37 0.00 0.00 -1.71 0.00 0.00 66.02 64.58 1vae s SER 101 CO 0.38 -0.44 0.00 0.23 1.20 0.00 0.00 173.24 174.61 1vae n MET 102 N 0.65 -3.09 -1.68 5.44 2.81 -1.26 -5.01 117.12 114.98 1vae n MET 102 Ca -0.12 2.51 0.00 0.00 -1.81 0.00 0.00 57.70 58.28 1vae n MET 102 Cb 0.58 -3.67 0.00 0.00 -0.71 0.00 0.00 33.22 29.42 1vae n MET 102 CO 0.00 0.00 0.00 0.72 1.51 0.00 0.00 175.97 178.20 1vae n HIS 103 N -4.26 -3.05 0.07 2.03 -0.00 -1.26 -5.06 115.22 103.69 1vae n HIS 103 Ca -0.08 1.83 0.00 0.00 -0.00 0.00 0.00 57.72 59.46 1vae n HIS 103 Cb 0.64 -3.11 0.00 0.00 -0.00 0.00 0.00 29.99 27.52 1vae n HIS 103 CO 0.00 0.00 0.00 0.09 -0.00 0.00 0.00 176.34 176.43 1vae n ASN 104 N 1.16 0.40 -1.56 0.41 4.13 -1.26 -5.15 115.26 113.40 1vae n ASN 104 Ca 0.00 0.21 0.08 0.00 1.68 0.00 0.00 54.58 56.55 1vae n ASN 104 Cb 0.00 -0.01 -0.04 0.00 -1.54 0.00 0.00 39.78 38.18 1vae n ASN 104 CO 0.00 0.00 0.00 1.17 0.28 0.00 0.00 177.26 178.71 1vae n LYS 105 N -3.30 -3.88 -4.40 3.52 0.00 -1.26 -5.02 118.16 103.81 1vae n LYS 105 Ca 0.00 3.08 -0.20 0.00 0.00 0.00 0.00 58.31 61.19 1vae n LYS 105 Cb 0.08 -4.07 -0.10 0.00 0.00 0.00 0.00 35.03 30.93 1vae n LYS 105 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.40 175.86 1vae s SER 106 N -6.31 1.96 0.57 3.14 1.04 -1.26 -5.15 113.70 107.68 1vae s SER 106 Ca 0.00 -1.40 -0.13 0.00 0.48 0.00 0.00 55.95 54.90 1vae s SER 106 Cb 0.00 0.05 -0.06 0.00 0.10 0.00 0.00 66.02 66.11 1vae s SER 106 CO 0.00 -0.68 1.00 -0.83 0.98 0.00 0.00 173.24 173.72 1vae s GLY 107 N -3.43 1.84 0.64 7.32 0.00 -1.26 -5.05 107.32 107.37 1vae s GLY 107 Ca 0.36 0.02 -0.13 0.00 0.00 0.00 0.00 44.72 44.97 1vae s GLY 107 CO 0.15 0.29 1.05 2.56 0.00 0.00 0.00 173.10 177.15 1vae s PRO 108 N -4.67 3.18 -0.09 2.90 0.04 -1.26 -5.06 135.00 130.05 1vae s PRO 108 Ca 0.56 1.07 0.03 0.00 0.04 0.00 0.00 61.00 62.71 1vae s PRO 108 Cb -0.10 -2.02 -0.01 0.00 0.04 0.00 0.00 34.50 32.40 1vae s PRO 108 CO 0.44 -0.91 -0.18 0.45 0.04 0.00 0.00 177.00 176.84 1vae s SER 109 N -3.28 3.64 0.09 6.66 0.15 -1.26 -4.88 113.70 114.83 1vae s SER 109 Ca 0.61 -0.38 0.00 0.00 0.70 0.00 0.00 55.95 56.88 1vae s SER 109 Cb -0.15 -1.20 0.00 0.00 -1.71 0.00 0.00 66.02 62.96 1vae s SER 109 CO 0.45 0.23 0.00 -1.20 1.20 0.00 0.00 173.24 173.92 1vae n SER 110 N 3.09 -0.79 0.00 5.45 7.64 -1.26 -5.35 113.62 122.40 1vae n SER 110 Ca -0.18 0.48 0.00 0.00 1.01 0.00 0.00 58.87 60.19 1vae n SER 110 Cb 0.52 1.07 0.00 0.00 -1.01 0.00 0.00 64.21 64.79 1vae n SER 110 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64