#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 0.00 -3.65 1.61 2.88 -1.26 -5.17 113.62 108.03 1vae n SER 2 Ca 0.00 0.00 -0.15 0.00 -1.33 0.00 0.00 58.87 57.39 1vae n SER 2 Cb 0.00 0.00 -0.08 0.00 -0.75 0.00 0.00 64.21 63.38 1vae n SER 2 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1vae s SER 3 N 0.00 -0.50 0.00 -3.46 0.01 -1.26 -5.16 113.70 103.34 1vae s SER 3 Ca 0.00 0.70 0.00 0.00 1.31 0.00 0.00 55.95 57.96 1vae s SER 3 Cb 0.00 0.71 0.00 0.00 0.21 0.00 0.00 66.02 66.94 1vae s SER 3 CO 0.00 -0.40 0.00 0.61 0.41 0.00 0.00 173.24 173.86 1vae n GLY 4 N 1.75 4.57 3.72 3.44 0.00 -1.26 -5.15 105.19 112.27 1vae n GLY 4 Ca -0.18 -0.89 -0.31 0.00 0.00 0.00 0.00 46.02 44.64 1vae n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1vae s SER 5 N 0.00 5.28 -0.29 1.61 0.01 -1.26 -5.10 113.70 113.94 1vae s SER 5 Ca 0.00 -0.03 -0.20 0.00 1.31 0.00 0.00 55.95 57.03 1vae s SER 5 Cb 0.00 -1.38 0.16 0.00 0.21 0.00 0.00 66.02 65.01 1vae s SER 5 CO 0.00 0.22 1.11 -0.94 0.41 0.00 0.00 173.24 174.04 1vae s SER 6 N -1.99 -0.35 -0.67 2.44 1.04 -1.26 -5.11 113.70 107.81 1vae s SER 6 Ca 0.24 0.61 0.04 0.00 0.48 0.00 0.00 55.95 57.32 1vae s SER 6 Cb -0.12 0.92 0.16 0.00 0.10 0.00 0.00 66.02 67.08 1vae s SER 6 CO 0.16 -0.10 0.45 -0.83 0.98 0.00 0.00 173.24 173.90 1vae s GLY 7 N 0.78 2.81 -0.16 7.32 0.00 -1.26 -5.03 107.32 111.78 1vae s GLY 7 Ca -0.03 -3.68 -0.03 0.00 0.00 0.00 0.00 44.72 40.99 1vae s GLY 7 CO -0.12 1.07 0.04 -0.56 0.00 0.00 0.00 173.10 173.53 1vae s SER 8 N -0.98 2.51 -1.26 1.64 0.01 -1.26 -5.05 113.70 109.31 1vae s SER 8 Ca 0.23 -0.62 -0.09 0.00 1.31 0.00 0.00 55.95 56.78 1vae s SER 8 Cb -0.11 -0.50 0.18 0.00 0.21 0.00 0.00 66.02 65.81 1vae s SER 8 CO -0.11 -0.29 1.82 0.00 0.41 0.00 0.00 173.24 175.07 1vae n ALA 9 N 5.11 5.31 -2.43 1.44 0.00 -1.26 -4.94 120.51 123.74 1vae n ALA 9 Ca -0.08 -4.37 -0.30 0.00 0.00 0.00 0.00 53.44 48.68 1vae n ALA 9 Cb 0.48 -2.91 -0.13 0.00 0.00 0.00 0.00 19.45 16.89 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 0.61 3.62 -0.03 0.00 0.01 -1.26 -5.07 113.70 111.58 1vae s SER 10 Ca 0.39 -0.50 -0.37 0.00 1.31 0.00 0.00 55.95 56.77 1vae s SER 10 Cb 0.09 -0.50 -0.16 0.00 0.21 0.00 0.00 66.02 65.66 1vae s SER 10 CO 0.02 0.25 1.52 0.29 0.41 0.00 0.00 173.24 175.72 1vae n LYS 11 N 1.50 1.32 -3.06 12.44 5.02 -1.26 -4.90 118.16 129.23 1vae n LYS 11 Ca -0.16 0.48 -0.40 0.00 -2.02 0.00 0.00 58.31 56.21 1vae n LYS 11 Cb 0.52 -2.16 -0.05 0.00 -0.02 0.00 0.00 35.03 33.32 1vae n LYS 11 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 1vae s ARG 12 N 1.68 4.41 0.14 1.97 3.52 -1.21 -4.99 118.95 124.46 1vae s ARG 12 Ca 0.89 0.84 0.09 0.00 -0.13 0.00 0.00 55.73 57.42 1vae s ARG 12 Cb -0.94 -3.46 -0.04 0.00 -1.56 0.00 0.00 34.95 28.94 1vae s ARG 12 CO 0.52 0.02 -0.16 -1.58 -0.81 0.00 0.00 175.30 173.29 1vae s TRP 13 N 0.96 2.56 0.79 5.12 0.52 -1.26 -0.46 118.94 127.17 1vae s TRP 13 Ca 0.36 -0.25 -0.08 0.00 0.02 0.00 0.00 56.10 56.15 1vae s TRP 13 Cb -0.17 -1.32 0.13 0.00 -1.15 0.00 0.00 33.47 30.95 1vae s TRP 13 CO 0.17 0.44 1.11 -1.12 0.02 0.00 0.00 176.95 177.56 1vae s SER 14 N -2.39 4.12 0.59 2.95 0.01 -0.60 -4.95 113.70 113.44 1vae s SER 14 Ca 0.20 0.17 -0.15 0.00 1.31 0.00 0.00 55.95 57.48 1vae s SER 14 Cb -0.10 -0.54 -0.04 0.00 0.21 0.00 0.00 66.02 65.55 1vae s SER 14 CO 0.12 -2.05 1.05 -2.16 0.41 0.00 0.00 173.24 170.61 1vae s PRO 15 N -5.43 3.37 0.32 12.44 0.04 -1.26 -4.42 135.00 140.06 1vae s PRO 15 Ca 0.66 1.16 -0.28 0.00 0.04 0.00 0.00 61.00 62.59 1vae s PRO 15 Cb -0.07 -2.04 -0.09 0.00 0.04 0.00 0.00 34.50 32.34 1vae s PRO 15 CO 0.47 -0.76 1.07 -1.25 0.04 0.00 0.00 177.00 176.57 1vae s PRO 16 N -4.14 4.50 -0.16 0.56 0.04 -1.26 -4.53 135.00 130.01 1vae s PRO 16 Ca 0.63 1.68 -0.04 0.00 0.04 0.00 0.00 61.00 63.31 1vae s PRO 16 Cb -0.15 -2.98 -0.03 0.00 0.04 0.00 0.00 34.50 31.38 1vae s PRO 16 CO 0.37 0.12 -0.03 -0.98 0.04 0.00 0.00 177.00 176.52 1vae s ARG 17 N -1.78 3.68 -0.72 4.56 1.70 -0.64 -4.88 118.95 120.86 1vae s ARG 17 Ca 0.49 -0.51 -0.26 0.00 -0.47 0.00 0.00 55.73 54.98 1vae s ARG 17 Cb -0.28 -2.93 0.04 0.00 -0.57 0.00 0.00 34.95 31.21 1vae s ARG 17 CO 0.36 0.26 1.19 0.20 -1.08 0.00 0.00 175.30 176.23 1vae s GLY 18 N 0.33 1.03 0.24 3.88 0.00 -1.26 -3.49 107.32 108.05 1vae s GLY 18 Ca -0.03 -1.53 -0.10 0.00 0.00 0.00 0.00 44.72 43.05 1vae s GLY 18 CO 0.03 2.48 0.57 -0.42 0.00 0.00 0.00 173.10 175.76 1vae s ILE 19 N 5.23 4.90 -0.20 0.90 1.01 -0.39 -4.95 121.20 127.71 1vae s ILE 19 Ca 0.32 0.53 -0.02 0.00 0.00 0.00 0.00 60.65 61.47 1vae s ILE 19 Cb -0.10 -3.62 0.06 0.00 0.01 0.00 0.00 42.46 38.81 1vae s ILE 19 CO 0.13 -0.09 0.02 -1.38 0.00 0.00 0.00 174.94 173.62 1vae s HIS 20 N -1.84 1.28 0.28 3.97 -3.43 -1.26 -2.92 115.29 111.37 1vae s HIS 20 Ca 0.48 -0.99 -0.17 0.00 -0.80 0.00 0.00 55.06 53.57 1vae s HIS 20 Cb -0.11 -1.13 0.02 0.00 -1.43 0.00 0.00 32.58 29.93 1vae s HIS 20 CO 0.21 -0.63 0.64 -0.59 -2.00 0.00 0.00 174.74 172.37 1vae s PHE 21 N 1.77 0.04 -0.21 0.38 -0.71 -1.23 -4.72 117.98 113.30 1vae s PHE 21 Ca -0.02 -0.48 -0.03 0.00 -1.04 0.00 0.00 56.93 55.36 1vae s PHE 21 Cb -0.17 0.54 -0.00 0.00 -1.21 0.00 0.00 43.02 42.17 1vae s PHE 21 CO -0.08 -1.19 -0.07 0.99 -1.34 0.00 0.00 175.22 173.54 1vae s THR 22 N -3.79 3.16 0.51 -4.49 2.01 -1.26 -1.98 115.64 109.81 1vae s THR 22 Ca 0.15 -0.57 -0.23 0.00 0.31 0.00 0.00 61.69 61.36 1vae s THR 22 Cb -0.04 -2.43 -0.06 0.00 0.01 0.00 0.00 72.50 69.98 1vae s THR 22 CO 0.08 0.44 1.31 0.52 -0.69 0.00 0.00 174.62 176.28 1vae n VAL 23 N 4.77 3.42 -4.08 3.82 0.31 -1.25 -4.81 118.33 120.50 1vae n VAL 23 Ca -0.19 -0.50 -0.33 0.00 -0.01 0.00 0.00 64.34 63.32 1vae n VAL 23 Cb 0.51 -1.62 -0.15 0.00 -0.91 0.00 0.00 33.84 31.67 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 -2.67 2.64 -0.09 5.55 2.02 -1.26 -0.74 118.70 124.15 1vae s GLU 24 Ca 0.68 -1.07 -0.04 0.00 0.02 0.00 0.00 54.97 54.56 1vae s GLU 24 Cb -0.44 -2.75 -0.14 0.00 0.10 0.00 0.00 34.13 30.91 1vae s GLU 24 CO 0.52 -0.39 3.09 0.39 0.02 0.00 0.00 175.26 178.89 1vae n GLU 25 N 4.54 1.87 0.00 1.61 1.02 -1.26 -3.38 120.64 125.04 1vae n GLU 25 Ca -0.18 -1.07 0.00 0.00 -0.02 0.00 0.00 57.16 55.89 1vae n GLU 25 Cb 0.46 -1.81 0.00 0.00 -0.02 0.00 0.00 31.44 30.07 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 1.91 0.05 2.88 0.62 0.00 -1.26 -5.07 105.19 104.32 1vae n GLY 26 Ca 0.35 -0.10 -0.11 0.00 0.00 0.00 0.00 46.02 46.16 1vae n GLY 26 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1vae s ASP 27 N -1.47 0.61 0.39 1.61 1.01 -1.22 -4.99 116.67 112.62 1vae s ASP 27 Ca 0.00 -0.69 0.21 0.00 0.71 0.00 0.00 52.55 52.78 1vae s ASP 27 Cb 0.00 0.97 0.67 0.00 1.01 0.00 0.00 42.92 45.56 1vae s ASP 27 CO 0.00 -0.33 1.72 -0.07 0.21 0.00 0.00 175.17 176.70 1vae h LEU 28 N 7.90 0.00 0.00 1.23 3.38 -1.98 -3.43 115.31 122.40 1vae h LEU 28 Ca -0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.91 1vae h LEU 28 Cb 1.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.85 1vae h LEU 28 CO 0.25 0.31 0.00 0.61 0.09 0.00 0.00 178.44 179.71 1vae n GLY 29 N 0.42 1.20 3.58 0.83 0.00 -1.26 -4.61 105.19 105.34 1vae n GLY 29 Ca 0.01 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 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 -3.44 0.71 0.32 1.61 -0.12 -1.26 0.22 117.98 116.02 1vae s PHE 30 Ca 0.00 -1.07 -0.00 0.00 -0.05 0.00 0.00 56.93 55.81 1vae s PHE 30 Cb 0.00 0.18 -0.01 0.00 -0.63 0.00 0.00 43.02 42.56 1vae s PHE 30 CO 0.00 -1.21 0.38 -0.08 -0.05 0.00 0.00 175.22 174.26 1vae s THR 31 N -3.08 0.00 -0.05 -4.49 -1.32 -1.23 -4.86 115.64 100.61 1vae s THR 31 Ca 0.25 -1.75 0.01 0.00 -1.21 0.00 0.00 61.69 59.00 1vae s THR 31 Cb -0.02 -2.56 0.02 0.00 -1.51 0.00 0.00 72.50 68.44 1vae s THR 31 CO 0.16 0.00 -0.06 -0.76 -2.21 0.00 0.00 174.62 171.75 1vae s LEU 32 N -3.26 1.34 0.50 9.08 1.43 -1.26 -2.12 118.68 124.39 1vae s LEU 32 Ca 0.34 -0.16 -0.05 0.00 -1.03 0.00 0.00 54.13 53.22 1vae s LEU 32 Cb 0.01 -0.53 -0.03 0.00 0.03 0.00 0.00 46.19 45.67 1vae s LEU 32 CO 0.21 -0.05 0.81 -0.13 0.23 0.00 0.00 176.35 177.42 1vae s ARG 33 N 0.97 3.44 -0.41 1.70 1.81 -1.24 -4.86 118.95 120.36 1vae s ARG 33 Ca -0.10 0.17 -0.29 0.00 -1.72 0.00 0.00 55.73 53.79 1vae s ARG 33 Cb -0.14 -2.36 0.01 0.00 -0.45 0.00 0.00 34.95 32.01 1vae s ARG 33 CO 0.00 -0.29 1.44 0.20 -0.68 0.00 0.00 175.30 175.97 1vae s GLY 34 N -4.14 1.07 0.00 -3.53 0.00 -1.26 -4.53 107.32 94.93 1vae s GLY 34 Ca 0.49 -0.13 0.00 0.00 0.00 0.00 0.00 44.72 45.07 1vae s GLY 34 CO 0.45 2.80 0.00 1.16 0.00 0.00 0.00 173.10 177.51 1vae n ASN 35 N 8.93 0.00 -3.60 1.64 6.94 -1.26 -5.07 115.26 122.84 1vae n ASN 35 Ca 0.17 0.00 -0.02 0.00 -0.02 0.00 0.00 54.58 54.71 1vae n ASN 35 Cb 0.48 0.00 -0.06 0.00 -2.36 0.00 0.00 39.78 37.84 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 -3.00 -0.12 0.01 5.53 -1.32 -1.26 -3.38 115.64 112.10 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 -0.05 0.00 -1.51 0.00 0.00 72.50 69.94 1vae s THR 36 CO 0.00 0.00 1.19 -2.16 -2.21 0.00 0.00 174.62 171.44 1vae s PRO 37 N 1.61 4.41 0.13 7.08 0.04 -1.23 -5.02 135.00 142.02 1vae s PRO 37 Ca -0.08 1.71 -0.33 0.00 0.04 0.00 0.00 61.00 62.35 1vae s PRO 37 Cb -0.04 -3.44 -0.18 0.00 0.04 0.00 0.00 34.50 30.88 1vae s PRO 37 CO -0.16 -0.32 0.77 1.33 0.04 0.00 0.00 177.00 178.66 1vae n VAL 38 N 4.20 1.20 -4.17 -0.36 0.24 -1.22 -4.66 118.33 113.57 1vae n VAL 38 Ca 0.10 -0.30 -0.32 0.00 -2.04 0.00 0.00 64.34 61.77 1vae n VAL 38 Cb 0.47 -0.06 -0.08 0.00 -1.47 0.00 0.00 33.84 32.70 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 -0.61 2.87 0.13 7.34 -0.21 -1.26 -2.45 119.66 125.47 1vae s GLN 39 Ca 0.74 -0.61 -0.28 0.00 0.02 0.00 0.00 55.36 55.24 1vae s GLN 39 Cb -1.05 -2.73 -0.07 0.00 1.00 0.00 0.00 33.01 30.17 1vae s GLN 39 CO 0.56 0.61 0.86 0.08 -2.12 0.00 0.00 175.29 175.29 1vae s VAL 40 N -1.19 4.44 -0.56 1.09 1.01 0.10 -3.66 120.40 121.63 1vae s VAL 40 Ca 0.23 1.88 0.07 0.00 0.00 0.00 0.00 61.98 64.15 1vae s VAL 40 Cb -0.12 -4.23 0.25 0.00 0.00 0.00 0.00 36.38 32.28 1vae s VAL 40 CO 0.14 0.42 0.67 1.41 0.00 0.00 0.00 175.10 177.74 1vae n HIS 41 N 2.25 2.33 -1.35 5.22 -0.00 -0.90 -1.55 115.22 121.22 1vae n HIS 41 Ca -0.02 -3.96 -0.51 0.00 -0.00 0.00 0.00 57.72 53.23 1vae n HIS 41 Cb 0.49 -0.49 -0.06 0.00 -0.00 0.00 0.00 29.99 29.93 1vae n HIS 41 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 176.34 177.53 1vae n PHE 42 N 1.05 0.23 -0.04 4.41 3.72 -1.26 -3.56 117.46 122.01 1vae n PHE 42 Ca 0.27 0.95 -0.02 0.00 -0.05 0.00 0.00 57.45 58.60 1vae n PHE 42 Cb 0.45 -1.88 -0.10 0.00 -0.94 0.00 0.00 39.48 37.01 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 1.54 0.00 -4.12 4.37 4.77 0.13 -4.92 117.00 118.78 1vae n LEU 43 Ca 0.18 0.00 -0.28 0.00 -0.03 0.00 0.00 56.01 55.88 1vae n LEU 43 Cb 0.13 0.20 -0.17 0.00 -2.33 0.00 0.00 43.42 41.25 1vae n LEU 43 CO 0.55 0.20 -0.51 -1.81 -1.33 0.00 0.00 177.39 174.48 1vae s ASP 44 N -4.16 2.34 0.00 -1.43 1.01 0.42 -4.99 116.67 109.85 1vae s ASP 44 Ca -0.06 -0.41 0.22 0.00 0.71 0.00 0.00 52.55 53.02 1vae s ASP 44 Cb 0.05 -1.02 1.06 0.00 1.01 0.00 0.00 42.92 44.02 1vae s ASP 44 CO 0.52 0.10 1.72 -0.81 0.21 0.00 0.00 175.17 176.91 1vae n PRO 45 N 3.61 0.19 -2.95 8.23 -0.04 -1.26 -3.43 135.00 139.35 1vae n PRO 45 Ca -0.21 0.09 -0.24 0.00 -0.04 0.00 0.00 63.50 63.10 1vae n PRO 45 Cb 0.52 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.45 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 -1.38 2.97 -4.27 0.54 8.25 -1.26 -4.85 115.22 115.23 1vae n HIS 46 Ca 0.08 -3.83 -0.27 0.00 -0.26 0.00 0.00 57.72 53.44 1vae n HIS 46 Cb 0.21 -0.43 -0.09 0.00 1.12 0.00 0.00 29.99 30.80 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 3.07 -1.55 -0.72 0.00 0.02 -1.90 0.73 113.55 113.19 1vae h SER 48 Ca -0.47 0.19 0.07 0.00 -0.84 0.00 0.00 61.79 60.73 1vae h SER 48 Cb 1.19 0.61 -0.09 0.00 0.14 0.00 0.00 62.40 64.26 1vae h SER 48 CO 0.54 -0.41 -0.45 0.00 -1.14 0.00 0.00 176.83 175.37 1vae h ALA 49 N -0.39 -0.44 -0.52 3.77 0.00 -1.91 1.58 119.26 121.36 1vae h ALA 49 Ca 0.04 0.08 0.09 0.00 0.00 0.00 0.00 54.91 55.12 1vae h ALA 49 Cb 0.59 1.27 -0.08 0.00 0.00 0.00 0.00 17.79 19.57 1vae h ALA 49 CO -0.42 -0.75 0.08 1.03 0.00 0.00 0.00 179.25 179.20 1vae h SER 50 N -0.02 -0.05 0.26 0.00 0.87 -1.67 0.84 113.55 113.77 1vae h SER 50 Ca 0.12 0.10 0.00 0.00 -1.23 0.00 0.00 61.79 60.78 1vae h SER 50 Cb 0.32 0.15 0.00 0.00 -0.44 0.00 0.00 62.40 62.43 1vae h SER 50 CO -0.69 0.00 0.00 -0.07 -0.53 0.00 0.00 176.83 175.54 1vae h LEU 51 N 0.21 0.00 0.32 2.23 3.38 0.51 -2.54 115.31 119.42 1vae h LEU 51 Ca 0.27 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.22 1vae h LEU 51 Cb 0.38 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.13 1vae h LEU 51 CO -0.36 0.00 -0.15 0.00 0.09 0.00 0.00 178.44 178.01 1vae h ALA 52 N 2.03 -0.43 0.00 1.53 0.00 0.92 -3.48 119.26 119.83 1vae h ALA 52 Ca 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1vae h ALA 52 Cb 0.13 0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.08 1vae h ALA 52 CO 0.00 -0.44 0.00 0.41 0.00 0.00 0.00 179.25 179.22 1vae n GLY 53 N 0.42 0.00 3.66 0.00 0.00 -0.85 -4.71 105.19 103.71 1vae n GLY 53 Ca -0.07 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.70 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 3.31 0.08 4.61 0.00 -1.24 -4.93 121.76 123.59 1vae s ALA 54 Ca 0.00 -2.02 0.01 0.00 0.00 0.00 0.00 51.96 49.95 1vae s ALA 54 Cb 0.00 -0.35 -0.00 0.00 0.00 0.00 0.00 23.12 22.77 1vae s ALA 54 CO 0.00 -0.01 0.02 1.63 0.00 0.00 0.00 175.76 177.40 1vae n LYS 55 N -1.04 0.98 -3.26 0.00 5.02 -1.26 -4.75 118.16 113.85 1vae n LYS 55 Ca -0.03 -0.64 -0.39 0.00 -2.02 0.00 0.00 58.31 55.24 1vae n LYS 55 Cb 0.63 0.32 -0.06 0.00 -0.02 0.00 0.00 35.03 35.91 1vae n LYS 55 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1vae s GLU 56 N -2.29 4.26 0.00 1.97 2.02 -1.26 -3.80 118.70 119.60 1vae s GLU 56 Ca 0.03 0.66 0.00 0.00 0.02 0.00 0.00 54.97 55.69 1vae s GLU 56 Cb 0.00 -3.32 0.00 0.00 0.10 0.00 0.00 34.13 30.91 1vae s GLU 56 CO 0.02 0.42 0.00 0.41 0.02 0.00 0.00 175.26 176.14 1vae n GLY 57 N 2.36 0.68 3.69 -1.39 0.00 -0.59 -5.00 105.19 104.94 1vae n GLY 57 Ca -0.08 -0.26 -0.42 0.00 0.00 0.00 0.00 46.02 45.26 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 -2.23 6.44 -0.60 1.61 1.11 -1.25 -4.55 116.67 117.20 1vae s ASP 58 Ca 0.00 2.74 -0.16 0.00 0.18 0.00 0.00 52.55 55.30 1vae s ASP 58 Cb 0.00 -2.57 0.14 0.00 1.07 0.00 0.00 42.92 41.56 1vae s ASP 58 CO 0.00 -0.99 0.58 -0.31 1.18 0.00 0.00 175.17 175.63 1vae s TYR 59 N 2.70 3.28 0.24 4.23 1.51 -1.13 0.03 117.35 128.21 1vae s TYR 59 Ca 0.80 -1.34 -0.31 0.00 -1.01 0.00 0.00 57.07 55.21 1vae s TYR 59 Cb -0.45 -3.85 -0.13 0.00 -0.11 0.00 0.00 41.96 37.42 1vae s TYR 59 CO 0.36 -1.07 1.49 -0.89 -1.11 0.00 0.00 175.55 174.33 1vae n ILE 60 N 5.11 0.75 -0.02 2.71 5.41 -1.03 -2.87 119.36 129.43 1vae n ILE 60 Ca -0.08 -0.19 -0.03 0.00 1.00 0.00 0.00 62.75 63.45 1vae n ILE 60 Cb 0.42 -1.61 -0.02 0.00 -0.71 0.00 0.00 39.64 37.71 1vae n ILE 60 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 176.55 177.88 1vae n VAL 61 N 2.32 0.26 -3.46 1.39 0.24 -0.68 -4.25 118.33 114.15 1vae n VAL 61 Ca 0.12 -0.11 -0.13 0.00 -2.04 0.00 0.00 64.34 62.18 1vae n VAL 61 Cb 0.32 -0.72 -0.03 0.00 -1.47 0.00 0.00 33.84 31.94 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 -4.22 -0.57 -0.18 -1.34 0.01 -1.25 0.19 113.70 106.35 1vae s SER 62 Ca -0.05 0.21 -0.02 0.00 1.31 0.00 0.00 55.95 57.40 1vae s SER 62 Cb 0.01 0.55 0.05 0.00 0.21 0.00 0.00 66.02 66.85 1vae s SER 62 CO 0.12 -0.81 0.00 -0.63 0.41 0.00 0.00 173.24 172.33 1vae s ILE 63 N -2.90 0.74 0.00 1.44 1.01 -1.01 -1.91 121.20 118.57 1vae s ILE 63 Ca -0.02 -0.57 0.00 0.00 0.00 0.00 0.00 60.65 60.06 1vae s ILE 63 Cb -0.01 -1.11 0.00 0.00 0.01 0.00 0.00 42.46 41.35 1vae s ILE 63 CO -0.06 -0.07 0.00 0.00 0.00 0.00 0.00 174.94 174.81 1vae n GLN 64 N 4.98 0.00 0.00 2.79 1.13 0.37 -2.53 117.38 124.13 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 0.47 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.82 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 3.31 1.08 0.00 -1.26 -4.90 105.19 103.42 1vae n GLY 65 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 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 1.73 -0.14 1.61 1.01 -1.05 -5.11 120.40 118.45 1vae s VAL 66 Ca 0.00 -1.79 -0.28 0.00 0.00 0.00 0.00 61.98 59.91 1vae s VAL 66 Cb 0.00 -1.73 -0.01 0.00 0.00 0.00 0.00 36.38 34.65 1vae s VAL 66 CO 0.00 -0.25 0.97 -0.62 0.00 0.00 0.00 175.10 175.20 1vae s ASP 67 N -2.43 7.15 -0.37 3.32 2.15 -1.26 -2.42 116.67 122.82 1vae s ASP 67 Ca 0.12 1.42 0.14 0.00 0.43 0.00 0.00 52.55 54.67 1vae s ASP 67 Cb -0.07 -2.53 0.42 0.00 -0.30 0.00 0.00 42.92 40.44 1vae s ASP 67 CO 0.06 -0.48 0.91 0.00 -0.17 0.00 0.00 175.17 175.49 1vae n LYS 69 N -0.03 0.92 -0.09 0.00 4.81 -1.19 -3.16 118.16 119.42 1vae n LYS 69 Ca 0.19 0.06 -0.10 0.00 -0.87 0.00 0.00 58.31 57.58 1vae n LYS 69 Cb 0.73 -1.34 -0.12 0.00 0.02 0.00 0.00 35.03 34.32 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 -2.82 0.00 -1.22 5.64 7.02 -1.26 -3.48 117.44 121.32 1vae n TRP 70 Ca -0.27 0.00 -0.38 0.00 -1.02 0.00 0.00 57.50 55.83 1vae n TRP 70 Cb 0.86 -0.81 0.01 0.00 -2.42 0.00 0.00 31.31 28.95 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 -2.79 -3.55 0.00 -0.99 4.77 -1.26 -4.81 117.00 108.37 1vae n LEU 71 Ca -0.30 0.64 0.00 0.00 -0.03 0.00 0.00 56.01 56.32 1vae n LEU 71 Cb 0.98 -0.83 0.00 0.00 -2.33 0.00 0.00 43.42 41.24 1vae n LEU 71 CO 0.30 -4.66 0.00 0.35 -1.33 0.00 0.00 177.39 172.05 1vae n THR 72 N -1.46 0.00 -0.02 -5.08 -2.24 -1.26 -4.45 114.28 99.78 1vae n THR 72 Ca 0.08 0.00 -0.12 0.00 -2.27 0.00 0.00 64.05 61.74 1vae n THR 72 Cb 0.46 -1.24 -0.10 0.00 -2.10 0.00 0.00 70.33 67.34 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 1.34 0.45 2.28 2.07 -1.84 -2.91 116.25 117.64 1vae h VAL 73 Ca 0.00 -1.57 -0.01 0.00 0.82 0.00 0.00 66.70 65.94 1vae h VAL 73 Cb 0.00 2.33 -0.02 0.00 -1.52 0.00 0.00 31.29 32.08 1vae h VAL 73 CO 0.00 0.38 -0.43 -1.28 0.02 0.00 0.00 177.57 176.26 1vae h SER 74 N -0.79 -1.16 -0.81 0.57 0.87 -1.95 1.02 113.55 111.29 1vae h SER 74 Ca -0.01 0.09 0.12 0.00 -1.23 0.00 0.00 61.79 60.77 1vae h SER 74 Cb 0.66 0.38 -0.13 0.00 -0.44 0.00 0.00 62.40 62.87 1vae h SER 74 CO 0.01 -0.59 -0.41 -0.33 -0.53 0.00 0.00 176.83 174.98 1vae h GLU 75 N -0.89 -0.09 0.72 2.24 5.08 -1.95 0.85 114.58 120.55 1vae h GLU 75 Ca -0.05 0.01 -0.04 0.00 -1.00 0.00 0.00 59.36 58.28 1vae h GLU 75 Cb 0.78 0.02 0.01 0.00 0.50 0.00 0.00 28.75 30.06 1vae h GLU 75 CO -0.05 -0.06 -0.35 0.28 -1.00 0.00 0.00 179.01 177.83 1vae h VAL 76 N -0.09 0.00 -0.98 3.13 2.07 -1.27 -0.71 116.25 118.40 1vae h VAL 76 Ca 0.26 -0.16 0.29 0.00 0.82 0.00 0.00 66.70 67.90 1vae h VAL 76 Cb 0.56 0.00 -0.18 0.00 -1.52 0.00 0.00 31.29 30.15 1vae h VAL 76 CO -0.85 0.00 0.07 0.23 0.02 0.00 0.00 177.57 177.04 1vae n MET 77 N -5.07 -0.08 -0.14 1.57 2.81 0.35 0.19 117.12 116.75 1vae n MET 77 Ca -0.12 1.46 -0.10 0.00 -1.81 0.00 0.00 57.70 57.13 1vae n MET 77 Cb 0.38 -2.35 -0.01 0.00 -0.71 0.00 0.00 33.22 30.53 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 0.66 0.00 0.03 1.57 0.81 0.83 116.57 120.47 1vae h LYS 78 Ca 0.62 -0.19 -0.01 0.00 -1.87 0.00 0.00 60.65 59.20 1vae h LYS 78 Cb 1.33 -0.07 -0.00 0.00 0.08 0.00 0.00 32.23 33.57 1vae h LYS 78 CO -0.91 0.72 -0.06 1.25 -0.57 0.00 0.00 179.45 179.89 1vae h LEU 79 N 0.50 0.00 0.04 2.94 5.85 0.36 0.23 115.31 125.23 1vae h LEU 79 Ca 0.12 0.00 -0.20 0.00 0.84 0.00 0.00 57.88 58.63 1vae h LEU 79 Cb 0.39 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.41 1vae h LEU 79 CO 0.01 0.06 -1.08 -0.07 -0.34 0.00 0.00 178.44 177.02 1vae h LEU 80 N 0.00 0.14 -0.21 2.25 3.38 0.12 -3.34 115.31 117.65 1vae h LEU 80 Ca -0.00 -0.74 0.03 0.00 0.09 0.00 0.00 57.88 57.26 1vae h LEU 80 Cb 0.20 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 40.87 1vae h LEU 80 CO 0.01 1.45 0.01 0.11 0.09 0.00 0.00 178.44 180.10 1vae h LYS 81 N -0.73 0.08 -1.13 1.13 1.57 0.11 -0.85 116.57 116.75 1vae h LYS 81 Ca -0.27 -0.00 0.36 0.00 -1.87 0.00 0.00 60.65 58.87 1vae h LYS 81 Cb 1.42 -0.02 -0.13 0.00 0.08 0.00 0.00 32.23 33.58 1vae h LYS 81 CO -0.07 0.05 0.69 1.03 -0.57 0.00 0.00 179.45 180.59 1vae h SER 82 N 0.08 0.38 -0.85 0.86 0.87 -0.73 1.16 113.55 115.32 1vae h SER 82 Ca 0.10 0.16 -0.54 0.00 -1.23 0.00 0.00 61.79 60.28 1vae h SER 82 Cb 0.12 0.12 -0.22 0.00 -0.44 0.00 0.00 62.40 61.98 1vae h SER 82 CO -0.16 -0.14 0.69 0.49 -0.53 0.00 0.00 176.83 177.18 1vae n PHE 83 N -4.86 2.49 -2.27 2.24 3.72 -0.33 -4.96 117.46 113.50 1vae n PHE 83 Ca 0.33 -2.54 -0.42 0.00 -0.05 0.00 0.00 57.45 54.77 1vae n PHE 83 Cb 1.16 -1.25 -0.03 0.00 -0.94 0.00 0.00 39.48 38.43 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 -0.91 1.99 -1.03 1.37 0.00 0.40 -2.36 107.32 106.78 1vae s GLY 84 Ca 0.51 0.89 0.00 0.00 0.00 0.00 0.00 44.72 46.12 1vae s GLY 84 CO -0.04 2.38 0.00 0.61 0.00 0.00 0.00 173.10 176.05 1vae n GLY 85 N 3.52 0.97 2.89 0.20 0.00 0.09 -4.95 105.19 107.90 1vae n GLY 85 Ca 0.12 -0.56 -0.24 0.00 0.00 0.00 0.00 46.02 45.34 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 -3.10 1.20 0.09 1.61 2.02 -0.99 -4.92 118.70 114.62 1vae s GLU 86 Ca 0.00 -0.16 -0.31 0.00 0.02 0.00 0.00 54.97 54.52 1vae s GLU 86 Cb 0.00 -1.28 -0.10 0.00 0.10 0.00 0.00 34.13 32.85 1vae s GLU 86 CO 0.00 -0.20 1.87 -2.00 0.02 0.00 0.00 175.26 174.95 1vae s GLU 87 N 1.49 4.14 0.38 1.61 2.12 -1.26 -3.93 118.70 123.25 1vae s GLU 87 Ca -0.01 2.60 0.05 0.00 0.36 0.00 0.00 54.97 57.97 1vae s GLU 87 Cb -0.13 -3.78 -0.06 0.00 0.26 0.00 0.00 34.13 30.42 1vae s GLU 87 CO -0.04 -0.88 0.04 0.14 -0.54 0.00 0.00 175.26 173.98 1vae s VAL 88 N 3.31 1.39 -0.38 3.70 -7.23 -0.84 -4.98 120.40 115.38 1vae s VAL 88 Ca 0.83 -2.00 -0.00 0.00 -1.81 0.00 0.00 61.98 59.00 1vae s VAL 88 Cb -0.45 -2.74 0.10 0.00 0.56 0.00 0.00 36.38 33.85 1vae s VAL 88 CO 0.38 0.00 0.13 -0.70 -0.31 0.00 0.00 175.10 174.60 1vae s GLU 89 N -3.81 1.86 -0.02 4.82 2.12 -1.26 -3.58 118.70 118.82 1vae s GLU 89 Ca 0.31 -1.79 -0.17 0.00 0.36 0.00 0.00 54.97 53.68 1vae s GLU 89 Cb 0.08 -3.42 -0.05 0.00 0.26 0.00 0.00 34.13 30.99 1vae s GLU 89 CO 0.15 -0.99 0.46 1.41 -0.54 0.00 0.00 175.26 175.75 1vae s MET 90 N 1.07 4.10 -0.13 4.30 -2.45 -1.15 -0.48 119.30 124.56 1vae s MET 90 Ca 0.08 0.48 0.00 0.00 -1.25 0.00 0.00 55.69 55.00 1vae s MET 90 Cb -0.21 -3.29 -0.01 0.00 1.25 0.00 0.00 34.83 32.57 1vae s MET 90 CO -0.05 0.52 -0.15 0.15 1.05 0.00 0.00 175.02 176.54 1vae s LYS 91 N -0.56 3.30 0.08 4.11 3.01 -0.80 -1.26 119.74 127.63 1vae s LYS 91 Ca 0.25 -0.72 0.03 0.00 -1.01 0.00 0.00 55.97 54.52 1vae s LYS 91 Cb -0.17 -2.60 -0.03 0.00 -1.01 0.00 0.00 37.83 34.02 1vae s LYS 91 CO 0.13 0.15 -0.09 0.14 0.51 0.00 0.00 175.35 176.19 1vae s VAL 92 N 0.50 0.85 0.17 3.17 -7.23 -1.23 -1.68 120.40 114.94 1vae s VAL 92 Ca -0.10 -1.55 0.02 0.00 -1.81 0.00 0.00 61.98 58.55 1vae s VAL 92 Cb -0.16 -1.24 -0.05 0.00 0.56 0.00 0.00 36.38 35.50 1vae s VAL 92 CO 0.04 -0.54 -0.02 0.68 -0.31 0.00 0.00 175.10 174.95 1vae s VAL 93 N -2.31 0.81 0.35 1.32 -7.23 -1.14 -1.63 120.40 110.58 1vae s VAL 93 Ca 0.03 -2.00 0.07 0.00 -1.81 0.00 0.00 61.98 58.27 1vae s VAL 93 Cb -0.04 -2.08 -0.02 0.00 0.56 0.00 0.00 36.38 34.80 1vae s VAL 93 CO -0.00 -0.53 0.34 -0.55 -0.31 0.00 0.00 175.10 174.05 1vae s SER 94 N -3.18 5.41 -0.16 4.85 0.15 -1.26 -2.82 113.70 116.69 1vae s SER 94 Ca 0.23 -0.46 -0.01 0.00 0.70 0.00 0.00 55.95 56.41 1vae s SER 94 Cb 0.05 -0.98 -0.01 0.00 -1.71 0.00 0.00 66.02 63.38 1vae s SER 94 CO 0.03 -0.41 -0.12 -0.22 1.20 0.00 0.00 173.24 173.73 1vae s LEU 95 N -4.05 2.70 -0.17 3.45 2.96 -1.26 -1.56 118.68 120.75 1vae s LEU 95 Ca 0.43 -0.37 -0.02 0.00 -0.22 0.00 0.00 54.13 53.94 1vae s LEU 95 Cb -0.06 -1.63 -0.02 0.00 0.50 0.00 0.00 46.19 44.98 1vae s LEU 95 CO 0.28 0.11 -0.08 -0.76 -1.32 0.00 0.00 176.35 174.58 1vae s LEU 96 N 0.70 2.91 0.17 -0.68 2.01 0.39 -5.00 118.68 119.19 1vae s LEU 96 Ca -0.06 -0.30 0.11 0.00 0.01 0.00 0.00 54.13 53.89 1vae s LEU 96 Cb -0.15 -1.70 -0.04 0.00 0.01 0.00 0.00 46.19 44.31 1vae s LEU 96 CO 0.02 0.10 -0.24 -1.81 1.01 0.00 0.00 176.35 175.43 1vae s ASP 97 N 0.76 3.46 1.05 2.29 1.11 -1.26 -3.35 116.67 120.73 1vae s ASP 97 Ca -0.03 -0.81 -0.13 0.00 0.18 0.00 0.00 52.55 51.76 1vae s ASP 97 Cb -0.15 -0.28 0.18 0.00 1.07 0.00 0.00 42.92 43.74 1vae s ASP 97 CO 0.02 0.14 0.82 -1.20 1.18 0.00 0.00 175.17 176.12 1vae n SER 98 N 0.46 -1.21 -4.33 0.27 7.64 -1.26 -5.00 113.62 110.19 1vae n SER 98 Ca -0.14 0.11 -0.34 0.00 1.01 0.00 0.00 58.87 59.51 1vae n SER 98 Cb 0.55 -1.28 -0.14 0.00 -1.01 0.00 0.00 64.21 62.33 1vae n SER 98 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1vae s THR 99 N -2.46 3.16 0.15 0.44 2.01 -1.26 -5.11 115.64 112.59 1vae s THR 99 Ca 0.64 -0.59 0.08 0.00 0.31 0.00 0.00 61.69 62.14 1vae s THR 99 Cb -0.22 -2.39 -0.04 0.00 0.01 0.00 0.00 72.50 69.86 1vae s THR 99 CO 0.63 0.48 -0.17 -0.94 -0.69 0.00 0.00 174.62 173.93 1vae s SER 100 N 0.97 2.52 0.00 3.53 1.04 -1.26 -5.13 113.70 115.37 1vae s SER 100 Ca -0.01 -0.85 0.00 0.00 0.48 0.00 0.00 55.95 55.57 1vae s SER 100 Cb -0.15 -0.14 0.00 0.00 0.10 0.00 0.00 66.02 65.84 1vae s SER 100 CO -0.01 -0.06 0.00 -1.20 0.98 0.00 0.00 173.24 172.95 1vae n SER 101 N 0.34 0.00 -3.60 7.02 7.64 -1.26 -5.18 113.62 118.58 1vae n SER 101 Ca -0.14 0.00 -0.10 0.00 1.01 0.00 0.00 58.87 59.65 1vae n SER 101 Cb 0.57 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.71 1vae n SER 101 CO 0.00 0.00 0.00 -0.04 -3.01 0.00 0.00 175.04 171.99 1vae s MET 102 N 0.00 0.54 -0.02 1.43 -1.94 -1.26 -5.18 119.30 112.87 1vae s MET 102 Ca 0.00 0.34 -0.30 0.00 -1.71 0.00 0.00 55.69 54.02 1vae s MET 102 Cb 0.00 0.26 0.11 0.00 2.01 0.00 0.00 34.83 37.21 1vae s MET 102 CO 0.00 -0.13 1.15 -1.58 -0.01 0.00 0.00 175.02 174.45 1vae s HIS 103 N -0.51 -0.12 -0.06 -0.03 2.46 -1.26 -5.19 115.29 110.58 1vae s HIS 103 Ca 0.01 -0.02 -0.31 0.00 0.47 0.00 0.00 55.06 55.21 1vae s HIS 103 Cb -0.02 0.56 0.11 0.00 -0.13 0.00 0.00 32.58 33.10 1vae s HIS 103 CO -0.02 -0.41 1.02 0.54 -2.47 0.00 0.00 174.74 173.39 1vae s ASN 104 N -2.72 -0.26 0.04 9.88 2.20 -1.26 -5.18 114.94 117.64 1vae s ASN 104 Ca 0.11 -0.03 -0.11 0.00 -0.94 0.00 0.00 52.86 51.90 1vae s ASN 104 Cb 0.01 0.30 0.01 0.00 -2.00 0.00 0.00 41.25 39.57 1vae s ASN 104 CO -0.03 -0.49 0.23 -0.75 -2.94 0.00 0.00 177.10 173.11 1vae s LYS 105 N -2.86 0.74 -0.27 3.55 2.20 -1.26 -5.17 119.74 116.67 1vae s LYS 105 Ca 0.07 -0.61 -0.31 0.00 -0.36 0.00 0.00 55.97 54.76 1vae s LYS 105 Cb -0.01 0.31 0.18 0.00 -1.51 0.00 0.00 37.83 36.80 1vae s LYS 105 CO -0.07 -0.22 1.31 -1.12 -0.36 0.00 0.00 175.35 174.90 1vae s SER 106 N -2.13 -0.07 0.00 1.43 0.01 -1.26 -5.13 113.70 106.55 1vae s SER 106 Ca -0.04 0.06 0.00 0.00 1.31 0.00 0.00 55.95 57.28 1vae s SER 106 Cb -0.01 0.06 0.00 0.00 0.21 0.00 0.00 66.02 66.29 1vae s SER 106 CO -0.04 -0.08 0.00 0.61 0.41 0.00 0.00 173.24 174.14 1vae n GLY 107 N 0.42 -0.66 0.05 3.44 0.00 -1.26 -5.10 105.19 102.08 1vae n GLY 107 Ca -0.00 0.48 -0.01 0.00 0.00 0.00 0.00 46.02 46.48 1vae n GLY 107 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1vae h PRO 108 N 0.00 -0.09 -2.06 1.61 0.13 -2.10 -3.50 132.00 125.98 1vae h PRO 108 Ca 0.00 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.14 1vae h PRO 108 Cb 0.00 0.02 0.00 0.00 0.13 0.00 0.00 31.00 31.15 1vae h PRO 108 CO 0.00 -0.06 -0.50 0.45 -0.23 0.00 0.00 178.00 177.66 1vae n SER 109 N -2.84 -5.40 -3.73 1.44 2.88 -1.26 -5.08 113.62 99.63 1vae n SER 109 Ca -0.01 0.69 -0.12 0.00 -1.33 0.00 0.00 58.87 58.10 1vae n SER 109 Cb 0.04 -2.17 -0.07 0.00 -0.75 0.00 0.00 64.21 61.25 1vae n SER 109 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1vae s SER 110 N -2.39 -0.17 0.00 -3.46 0.15 -1.26 -5.35 113.70 101.22 1vae s SER 110 Ca 0.00 -0.13 0.07 0.00 0.70 0.00 0.00 55.95 56.59 1vae s SER 110 Cb 0.00 0.37 0.05 0.00 -1.71 0.00 0.00 66.02 64.74 1vae s SER 110 CO 0.00 -0.62 0.72 0.61 1.20 0.00 0.00 173.24 175.15