#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 -2.92 0.20 1.61 7.64 -1.26 -5.06 113.62 113.83 1vae n SER 2 Ca 0.00 0.73 0.00 0.00 1.01 0.00 0.00 58.87 60.61 1vae n SER 2 Cb 0.00 2.85 0.00 0.00 -1.01 0.00 0.00 64.21 66.05 1vae n SER 2 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1vae n SER 3 N -3.23 -3.29 -0.89 6.43 7.64 -1.26 -5.14 113.62 113.87 1vae n SER 3 Ca 0.00 0.77 0.00 0.00 1.01 0.00 0.00 58.87 60.65 1vae n SER 3 Cb 0.00 3.13 0.00 0.00 -1.01 0.00 0.00 64.21 66.33 1vae n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1vae n GLY 4 N -1.01 -1.80 3.88 0.23 0.00 -1.26 -5.07 105.19 100.17 1vae n GLY 4 Ca 0.00 -0.60 -0.33 0.00 0.00 0.00 0.00 46.02 45.09 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 0.00 6.56 0.00 1.61 0.15 -1.26 -5.08 113.70 115.68 1vae s SER 5 Ca 0.00 0.68 0.00 0.00 0.70 0.00 0.00 55.95 57.33 1vae s SER 5 Cb 0.00 -2.13 0.00 0.00 -1.71 0.00 0.00 66.02 62.18 1vae s SER 5 CO 0.00 0.13 0.00 -0.24 1.20 0.00 0.00 173.24 174.33 1vae n SER 6 N 0.59 0.00 -3.10 5.45 2.88 -1.26 -5.17 113.62 113.01 1vae n SER 6 Ca -0.06 0.00 -0.12 0.00 -1.33 0.00 0.00 58.87 57.36 1vae n SER 6 Cb 0.52 0.00 0.12 0.00 -0.75 0.00 0.00 64.21 64.10 1vae n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1vae n GLY 7 N -0.02 -3.74 2.78 0.46 0.00 -1.26 -4.99 105.19 98.42 1vae n GLY 7 Ca 0.00 -1.22 -0.29 0.00 0.00 0.00 0.00 46.02 44.51 1vae n GLY 7 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1vae s SER 8 N -2.42 3.87 -0.32 1.61 0.15 -1.26 -5.02 113.70 110.31 1vae s SER 8 Ca 0.27 -3.03 -0.01 0.00 0.70 0.00 0.00 55.95 53.88 1vae s SER 8 Cb -0.05 -1.26 0.13 0.00 -1.71 0.00 0.00 66.02 63.13 1vae s SER 8 CO 0.23 -0.21 0.24 0.00 1.20 0.00 0.00 173.24 174.70 1vae s ALA 9 N -0.23 0.24 0.00 5.45 0.00 -1.26 -5.10 121.76 120.86 1vae s ALA 9 Ca 0.20 -1.10 0.00 0.00 0.00 0.00 0.00 51.96 51.07 1vae s ALA 9 Cb -0.18 -1.67 0.00 0.00 0.00 0.00 0.00 23.12 21.27 1vae s ALA 9 CO -0.05 -1.88 0.00 0.43 0.00 0.00 0.00 175.76 174.25 1vae n SER 10 N 4.74 0.00 -4.70 0.00 7.64 -1.26 -5.11 113.62 114.93 1vae n SER 10 Ca 0.03 0.00 -0.57 0.00 1.01 0.00 0.00 58.87 59.35 1vae n SER 10 Cb 0.42 0.00 -0.07 0.00 -1.01 0.00 0.00 64.21 63.55 1vae n SER 10 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1vae n LYS 11 N -0.21 1.24 -2.70 1.43 5.02 -1.26 -4.87 118.16 116.82 1vae n LYS 11 Ca 0.00 0.45 -0.42 0.00 -2.02 0.00 0.00 58.31 56.32 1vae n LYS 11 Cb 0.00 -2.16 -0.03 0.00 -0.02 0.00 0.00 35.03 32.82 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 3.73 4.38 0.20 1.97 3.00 -1.10 -4.95 118.95 126.19 1vae s ARG 12 Ca 0.99 1.36 0.08 0.00 -1.00 0.00 0.00 55.73 57.15 1vae s ARG 12 Cb -1.03 -3.56 -0.04 0.00 0.00 0.00 0.00 34.95 30.31 1vae s ARG 12 CO 0.64 -0.38 0.01 -1.58 0.00 0.00 0.00 175.30 173.99 1vae s TRP 13 N 2.25 2.81 0.69 5.12 0.52 -1.26 0.12 118.94 129.19 1vae s TRP 13 Ca 0.47 -0.16 0.02 0.00 0.02 0.00 0.00 56.10 56.45 1vae s TRP 13 Cb -0.17 -1.33 0.13 0.00 -1.15 0.00 0.00 33.47 30.95 1vae s TRP 13 CO 0.15 0.54 0.95 0.45 0.02 0.00 0.00 176.95 179.06 1vae n SER 14 N -0.36 1.52 -4.79 2.95 2.88 0.48 -4.92 113.62 111.37 1vae n SER 14 Ca -0.09 -2.22 -0.35 0.00 -1.33 0.00 0.00 58.87 54.88 1vae n SER 14 Cb 0.56 -0.59 -0.04 0.00 -0.75 0.00 0.00 64.21 63.39 1vae n SER 14 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 1vae s PRO 15 N -4.98 3.87 0.51 -1.46 0.04 -1.26 -4.30 135.00 127.42 1vae s PRO 15 Ca 0.65 1.39 -0.19 0.00 0.04 0.00 0.00 61.00 62.89 1vae s PRO 15 Cb -0.04 -2.18 -0.07 0.00 0.04 0.00 0.00 34.50 32.24 1vae s PRO 15 CO 0.42 -0.37 1.04 -1.25 0.04 0.00 0.00 177.00 176.88 1vae s PRO 16 N -3.08 3.68 0.11 0.56 0.04 -1.26 -4.43 135.00 130.63 1vae s PRO 16 Ca 0.65 1.30 0.06 0.00 0.04 0.00 0.00 61.00 63.05 1vae s PRO 16 Cb -0.17 -2.08 -0.04 0.00 0.04 0.00 0.00 34.50 32.24 1vae s PRO 16 CO 0.21 -0.52 -0.01 -0.98 0.04 0.00 0.00 177.00 175.74 1vae s ARG 17 N -3.48 2.46 -0.40 4.56 1.70 -0.38 -4.89 118.95 118.52 1vae s ARG 17 Ca 0.66 -0.92 -0.16 0.00 -0.47 0.00 0.00 55.73 54.84 1vae s ARG 17 Cb -0.16 -2.47 0.01 0.00 -0.57 0.00 0.00 34.95 31.76 1vae s ARG 17 CO 0.25 0.52 0.38 0.20 -1.08 0.00 0.00 175.30 175.56 1vae s GLY 18 N -2.44 1.93 0.10 3.88 0.00 -1.26 -3.44 107.32 106.09 1vae s GLY 18 Ca 0.26 -1.52 0.03 0.00 0.00 0.00 0.00 44.72 43.49 1vae s GLY 18 CO 0.18 1.05 0.09 -0.42 0.00 0.00 0.00 173.10 174.00 1vae s ILE 19 N 1.97 4.52 -0.16 0.90 1.01 -0.93 -4.93 121.20 123.59 1vae s ILE 19 Ca 0.10 -0.83 -0.04 0.00 0.00 0.00 0.00 60.65 59.88 1vae s ILE 19 Cb -0.18 -3.20 0.06 0.00 0.01 0.00 0.00 42.46 39.15 1vae s ILE 19 CO 0.12 0.08 0.07 -1.38 0.00 0.00 0.00 174.94 173.83 1vae s HIS 20 N -1.45 0.42 0.28 3.97 -3.43 -1.26 -3.18 115.29 110.64 1vae s HIS 20 Ca 0.30 -0.39 -0.14 0.00 -0.80 0.00 0.00 55.06 54.03 1vae s HIS 20 Cb -0.12 -0.76 0.01 0.00 -1.43 0.00 0.00 32.58 30.27 1vae s HIS 20 CO 0.22 -0.50 0.56 -0.59 -2.00 0.00 0.00 174.74 172.43 1vae s PHE 21 N 2.06 0.30 -0.35 0.38 -0.71 -1.21 -4.60 117.98 113.85 1vae s PHE 21 Ca 0.02 -0.69 -0.05 0.00 -1.04 0.00 0.00 56.93 55.16 1vae s PHE 21 Cb -0.16 0.33 0.06 0.00 -1.21 0.00 0.00 43.02 42.05 1vae s PHE 21 CO -0.08 -1.12 0.12 0.99 -1.34 0.00 0.00 175.22 173.80 1vae s THR 22 N -3.74 3.56 1.00 -4.49 2.01 -1.26 -2.23 115.64 110.49 1vae s THR 22 Ca 0.20 -1.41 -0.19 0.00 0.31 0.00 0.00 61.69 60.60 1vae s THR 22 Cb -0.02 -3.13 -0.11 0.00 0.01 0.00 0.00 72.50 69.25 1vae s THR 22 CO 0.10 -0.31 -0.71 0.52 -0.69 0.00 0.00 174.62 173.53 1vae n VAL 23 N 4.74 0.00 -3.70 3.82 0.31 -1.26 -4.67 118.33 117.57 1vae n VAL 23 Ca -0.10 -0.31 -0.27 0.00 -0.01 0.00 0.00 64.34 63.65 1vae n VAL 23 Cb 0.43 -0.16 -0.17 0.00 -0.91 0.00 0.00 33.84 33.04 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 -2.41 0.45 -0.15 5.55 0.41 -1.26 -2.04 118.70 119.25 1vae s GLU 24 Ca 0.43 -0.28 -0.05 0.00 -0.41 0.00 0.00 54.97 54.66 1vae s GLU 24 Cb -0.11 -1.96 -0.13 0.00 -1.78 0.00 0.00 34.13 30.14 1vae s GLU 24 CO 0.75 -0.63 3.21 0.39 -0.49 0.00 0.00 175.26 178.49 1vae n GLU 25 N 5.13 2.06 0.00 1.61 1.02 -1.26 -3.47 120.64 125.73 1vae n GLU 25 Ca -0.08 -1.38 0.00 0.00 -0.02 0.00 0.00 57.16 55.68 1vae n GLU 25 Cb 0.48 -1.97 0.00 0.00 -0.02 0.00 0.00 31.44 29.92 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 1.86 0.16 2.83 0.62 0.00 -1.26 -5.06 105.19 104.34 1vae n GLY 26 Ca 0.42 -0.12 -0.14 0.00 0.00 0.00 0.00 46.02 46.18 1vae n GLY 26 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1vae s ASP 27 N -1.12 0.76 0.50 1.61 2.15 -1.23 -4.98 116.67 114.38 1vae s ASP 27 Ca 0.00 -1.43 0.25 0.00 0.43 0.00 0.00 52.55 51.80 1vae s ASP 27 Cb 0.00 0.77 1.35 0.00 -0.30 0.00 0.00 42.92 44.74 1vae s ASP 27 CO 0.00 -0.25 2.04 -0.07 -0.17 0.00 0.00 175.17 176.72 1vae h LEU 28 N 7.09 0.00 0.00 -1.34 3.38 -1.98 -3.44 115.31 119.02 1vae h LEU 28 Ca 0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1vae h LEU 28 Cb 1.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.82 1vae h LEU 28 CO 0.19 0.14 0.00 0.61 0.09 0.00 0.00 178.44 179.47 1vae n GLY 29 N -0.68 0.50 3.58 0.83 0.00 -1.26 -4.83 105.19 103.33 1vae n GLY 29 Ca -0.02 0.00 -0.10 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 -2.30 -0.40 0.40 1.61 -0.12 -1.26 -0.87 117.98 115.03 1vae s PHE 30 Ca 0.00 0.12 0.04 0.00 -0.05 0.00 0.00 56.93 57.03 1vae s PHE 30 Cb 0.00 0.61 -0.03 0.00 -0.63 0.00 0.00 43.02 42.97 1vae s PHE 30 CO 0.00 -0.94 0.12 -0.08 -0.05 0.00 0.00 175.22 174.27 1vae s THR 31 N -3.73 0.66 0.13 -4.49 -1.32 -1.25 -4.95 115.64 100.70 1vae s THR 31 Ca 0.05 -2.00 0.10 0.00 -1.21 0.00 0.00 61.69 58.63 1vae s THR 31 Cb -0.03 -2.40 -0.04 0.00 -1.51 0.00 0.00 72.50 68.52 1vae s THR 31 CO -0.06 0.00 -0.24 -0.76 -2.21 0.00 0.00 174.62 171.35 1vae s LEU 32 N -3.59 2.45 0.30 9.08 1.43 -1.26 -2.08 118.68 125.02 1vae s LEU 32 Ca 0.26 -0.70 0.03 0.00 -1.03 0.00 0.00 54.13 52.69 1vae s LEU 32 Cb 0.03 -1.32 -0.03 0.00 0.03 0.00 0.00 46.19 44.91 1vae s LEU 32 CO 0.15 0.17 0.46 -0.13 0.23 0.00 0.00 176.35 177.23 1vae s ARG 33 N -2.14 3.40 -0.51 1.70 1.81 -1.26 -4.98 118.95 116.98 1vae s ARG 33 Ca 0.16 -0.60 -0.28 0.00 -1.72 0.00 0.00 55.73 53.28 1vae s ARG 33 Cb -0.10 -2.77 0.03 0.00 -0.45 0.00 0.00 34.95 31.66 1vae s ARG 33 CO 0.08 0.24 1.12 0.20 -0.68 0.00 0.00 175.30 176.26 1vae s GLY 34 N -4.04 1.27 0.00 -3.53 0.00 -1.26 -4.56 107.32 95.21 1vae s GLY 34 Ca 0.38 -0.63 0.00 0.00 0.00 0.00 0.00 44.72 44.47 1vae s GLY 34 CO 0.32 2.39 0.00 0.70 0.00 0.00 0.00 173.10 176.51 1vae n ASN 35 N 7.93 0.00 -3.66 1.64 5.03 -1.26 -5.06 115.26 119.88 1vae n ASN 35 Ca 0.10 0.00 -0.11 0.00 0.87 0.00 0.00 54.58 55.44 1vae n ASN 35 Cb 0.49 0.00 -0.08 0.00 -1.02 0.00 0.00 39.78 39.17 1vae n ASN 35 CO 0.00 0.00 0.00 0.28 -1.83 0.00 0.00 177.26 175.71 1vae s THR 36 N -2.68 -0.00 0.06 3.41 -1.32 -1.26 -3.00 115.64 110.85 1vae s THR 36 Ca 0.00 0.01 -0.30 0.00 -1.21 0.00 0.00 61.69 60.19 1vae s THR 36 Cb 0.00 -0.86 -0.05 0.00 -1.51 0.00 0.00 72.50 70.08 1vae s THR 36 CO 0.00 0.01 1.16 -2.16 -2.21 0.00 0.00 174.62 171.42 1vae s PRO 37 N 0.86 4.46 0.47 7.08 0.04 -1.25 -5.03 135.00 141.62 1vae s PRO 37 Ca -0.04 1.72 -0.22 0.00 0.04 0.00 0.00 61.00 62.50 1vae s PRO 37 Cb -0.05 -3.36 -0.10 0.00 0.04 0.00 0.00 34.50 31.03 1vae s PRO 37 CO -0.07 -0.21 0.71 1.33 0.04 0.00 0.00 177.00 178.80 1vae n VAL 38 N 3.81 2.24 -3.09 -0.36 0.24 -1.16 -4.59 118.33 115.41 1vae n VAL 38 Ca 0.08 -0.50 -0.01 0.00 -2.04 0.00 0.00 64.34 61.87 1vae n VAL 38 Cb 0.47 -0.80 0.00 0.00 -1.47 0.00 0.00 33.84 32.04 1vae n VAL 38 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1vae n GLN 39 N 0.18 1.07 -3.98 7.34 6.02 -1.26 -0.30 117.38 126.45 1vae n GLN 39 Ca 0.11 -0.14 -0.29 0.00 -0.01 0.00 0.00 57.00 56.67 1vae n GLN 39 Cb 0.42 -0.01 -0.17 0.00 1.02 0.00 0.00 30.24 31.51 1vae n GLN 39 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1vae s VAL 40 N 0.67 1.38 -1.01 5.09 1.01 -0.19 -4.00 120.40 123.35 1vae s VAL 40 Ca 0.02 -0.52 -0.02 0.00 0.00 0.00 0.00 61.98 61.46 1vae s VAL 40 Cb -0.00 -1.33 0.31 0.00 0.00 0.00 0.00 36.38 35.36 1vae s VAL 40 CO 0.02 0.42 1.54 1.57 0.00 0.00 0.00 175.10 178.64 1vae n HIS 41 N 4.83 2.60 -1.47 5.22 -0.00 -0.89 -3.35 115.22 122.17 1vae n HIS 41 Ca -0.15 -2.73 -0.57 0.00 0.46 0.00 0.00 57.72 54.72 1vae n HIS 41 Cb 0.50 -1.15 -0.08 0.00 -0.12 0.00 0.00 29.99 29.14 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 0.70 0.97 -0.05 1.57 3.72 -1.26 -3.78 117.46 119.34 1vae n PHE 42 Ca 0.34 1.01 -0.04 0.00 -0.05 0.00 0.00 57.45 58.70 1vae n PHE 42 Cb 0.31 -1.97 -0.08 0.00 -0.94 0.00 0.00 39.48 36.80 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 2.24 0.00 -3.88 4.37 4.77 -0.05 -4.94 117.00 119.51 1vae n LEU 43 Ca 0.22 0.00 -0.27 0.00 -0.03 0.00 0.00 56.01 55.94 1vae n LEU 43 Cb 0.03 0.24 -0.17 0.00 -2.33 0.00 0.00 43.42 41.19 1vae n LEU 43 CO 0.66 0.24 -0.43 -1.81 -1.33 0.00 0.00 177.39 174.72 1vae s ASP 44 N -4.23 2.21 0.00 -1.43 1.11 -0.18 -4.99 116.67 109.17 1vae s ASP 44 Ca -0.05 -0.34 0.20 0.00 0.18 0.00 0.00 52.55 52.55 1vae s ASP 44 Cb 0.04 -0.80 1.22 0.00 1.07 0.00 0.00 42.92 44.45 1vae s ASP 44 CO 0.44 -0.14 1.65 -0.81 1.18 0.00 0.00 175.17 177.48 1vae n PRO 45 N 4.96 0.75 -2.71 8.23 -0.04 -1.26 -3.13 135.00 141.81 1vae n PRO 45 Ca -0.12 0.00 -0.15 0.00 -0.04 0.00 0.00 63.50 63.19 1vae n PRO 45 Cb 0.50 -1.43 0.01 0.00 -0.04 0.00 0.00 33.50 32.54 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 -0.93 1.66 -0.11 0.54 8.25 -1.26 -4.49 115.22 118.88 1vae n HIS 46 Ca 0.15 -3.06 -0.23 0.00 -0.26 0.00 0.00 57.72 54.32 1vae n HIS 46 Cb 0.07 -0.33 -0.08 0.00 1.12 0.00 0.00 29.99 30.78 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 -3.93 0.00 -0.28 0.00 7.64 -1.26 -4.97 113.62 110.83 1vae n SER 48 Ca -0.43 0.00 0.02 0.00 1.01 0.00 0.00 58.87 59.47 1vae n SER 48 Cb 0.81 0.00 0.10 0.00 -1.01 0.00 0.00 64.21 64.11 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 0.52 -0.30 -0.43 0.00 -1.93 1.67 119.26 118.80 1vae h ALA 49 Ca 0.00 0.31 0.02 0.00 0.00 0.00 0.00 54.91 55.24 1vae h ALA 49 Cb 0.00 0.60 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 1vae h ALA 49 CO 0.00 -0.40 0.16 1.03 0.00 0.00 0.00 179.25 180.04 1vae h SER 50 N -0.00 0.25 0.41 0.00 0.87 -1.86 -0.24 113.55 112.98 1vae h SER 50 Ca 0.38 0.01 -0.03 0.00 -1.23 0.00 0.00 61.79 60.92 1vae h SER 50 Cb 0.58 -0.04 -0.00 0.00 -0.44 0.00 0.00 62.40 62.49 1vae h SER 50 CO -0.82 0.19 -0.14 -0.07 -0.53 0.00 0.00 176.83 175.46 1vae h LEU 51 N 0.33 0.00 0.55 2.23 3.38 -0.30 -3.05 115.31 118.46 1vae h LEU 51 Ca 0.12 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.06 1vae h LEU 51 Cb 0.02 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.77 1vae h LEU 51 CO -0.07 0.14 -0.26 0.00 0.09 0.00 0.00 178.44 178.33 1vae h ALA 52 N 1.86 -1.08 0.00 1.53 0.00 0.40 -3.47 119.26 118.51 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 0.38 0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.45 1vae h ALA 52 CO 0.02 -1.02 0.00 0.41 0.00 0.00 0.00 179.25 178.66 1vae n GLY 53 N -1.01 0.00 3.54 0.00 0.00 -0.83 -4.72 105.19 102.17 1vae n GLY 53 Ca -0.09 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.69 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 2.94 0.03 4.61 0.00 -1.17 -4.89 121.76 123.28 1vae s ALA 54 Ca 0.00 -1.89 -0.05 0.00 0.00 0.00 0.00 51.96 50.02 1vae s ALA 54 Cb 0.00 -0.34 -0.01 0.00 0.00 0.00 0.00 23.12 22.77 1vae s ALA 54 CO 0.00 0.21 0.08 0.15 0.00 0.00 0.00 175.76 176.19 1vae s LYS 55 N -3.59 0.53 -0.31 0.00 1.02 -1.26 -4.65 119.74 111.48 1vae s LYS 55 Ca 0.32 -0.71 -0.38 0.00 0.02 0.00 0.00 55.97 55.22 1vae s LYS 55 Cb -0.03 0.21 -0.14 0.00 -0.52 0.00 0.00 37.83 37.35 1vae s LYS 55 CO 0.17 -0.13 1.96 -1.91 -0.92 0.00 0.00 175.35 174.52 1vae n GLU 56 N 0.95 1.10 0.00 1.68 2.13 -1.26 -2.26 120.64 122.98 1vae n GLU 56 Ca -0.20 0.37 0.00 0.00 0.66 0.00 0.00 57.16 57.99 1vae n GLU 56 Cb 0.58 -2.23 0.00 0.00 0.27 0.00 0.00 31.44 30.06 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 5.39 1.89 3.61 8.31 0.00 -1.21 -5.05 105.19 118.12 1vae n GLY 57 Ca 0.34 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.94 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 6.69 -0.58 1.61 1.01 -0.96 -4.81 116.67 117.63 1vae s ASP 58 Ca 0.00 0.64 -0.19 0.00 0.71 0.00 0.00 52.55 53.71 1vae s ASP 58 Cb 0.00 -2.45 0.09 0.00 1.01 0.00 0.00 42.92 41.57 1vae s ASP 58 CO 0.00 -0.77 0.72 -0.31 0.21 0.00 0.00 175.17 175.03 1vae s TYR 59 N 3.28 2.97 -0.31 4.23 1.51 -1.20 -1.02 117.35 126.80 1vae s TYR 59 Ca 0.36 -0.83 -0.39 0.00 -1.01 0.00 0.00 57.07 55.20 1vae s TYR 59 Cb -0.13 -3.96 -0.14 0.00 -0.11 0.00 0.00 41.96 37.61 1vae s TYR 59 CO 0.16 -1.29 1.91 -0.89 -1.11 0.00 0.00 175.55 174.33 1vae n ILE 60 N 5.61 0.27 -0.06 2.71 5.41 0.59 -2.54 119.36 131.34 1vae n ILE 60 Ca -0.08 -0.11 -0.08 0.00 1.00 0.00 0.00 62.75 63.47 1vae n ILE 60 Cb 0.43 -1.33 -0.06 0.00 -0.71 0.00 0.00 39.64 37.98 1vae n ILE 60 CO 0.00 0.00 0.00 0.55 0.00 0.00 0.00 176.55 177.10 1vae n VAL 61 N 5.52 0.72 -4.10 1.39 3.14 0.16 -4.36 118.33 120.79 1vae n VAL 61 Ca 0.33 -0.29 -0.11 0.00 -2.96 0.00 0.00 64.34 61.31 1vae n VAL 61 Cb 0.15 -0.93 -0.08 0.00 -1.06 0.00 0.00 33.84 31.92 1vae n VAL 61 CO 0.00 0.00 0.00 -0.94 -6.46 0.00 0.00 176.83 169.43 1vae s SER 62 N -5.15 0.05 -0.29 6.55 1.04 -1.10 -0.55 113.70 114.25 1vae s SER 62 Ca -0.16 -1.18 0.03 0.00 0.48 0.00 0.00 55.95 55.13 1vae s SER 62 Cb 0.04 0.48 0.18 0.00 0.10 0.00 0.00 66.02 66.82 1vae s SER 62 CO 0.30 -0.99 0.51 -0.63 0.98 0.00 0.00 173.24 173.42 1vae s ILE 63 N -4.08 -0.84 -0.66 -1.02 1.01 -1.13 -1.83 121.20 112.64 1vae s ILE 63 Ca 0.31 -0.11 0.00 0.00 0.00 0.00 0.00 60.65 60.85 1vae s ILE 63 Cb 0.03 -0.99 0.00 0.00 0.01 0.00 0.00 42.46 41.52 1vae s ILE 63 CO 0.11 -0.11 0.00 0.00 0.00 0.00 0.00 174.94 174.93 1vae n GLN 64 N 5.39 -0.67 -0.16 2.79 1.13 -0.17 -2.04 117.38 123.65 1vae n GLN 64 Ca 0.02 0.64 0.00 0.00 -1.94 0.00 0.00 57.00 55.72 1vae n GLN 64 Cb 0.52 -4.43 0.00 0.00 0.11 0.00 0.00 30.24 26.43 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 -1.75 0.92 3.94 1.08 0.00 -1.26 -4.97 105.19 103.14 1vae n GLY 65 Ca -0.06 -0.02 -0.25 0.00 0.00 0.00 0.00 46.02 45.70 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 4.08 -0.37 1.61 1.01 -0.87 -5.04 120.40 118.82 1vae s VAL 66 Ca 0.00 -0.27 -0.22 0.00 0.00 0.00 0.00 61.98 61.49 1vae s VAL 66 Cb 0.00 -3.54 0.01 0.00 0.00 0.00 0.00 36.38 32.85 1vae s VAL 66 CO 0.00 -0.45 0.73 -0.62 0.00 0.00 0.00 175.10 174.76 1vae s ASP 67 N -4.22 6.48 -0.35 3.32 2.15 -1.26 -2.85 116.67 119.95 1vae s ASP 67 Ca 0.49 0.20 0.15 0.00 0.43 0.00 0.00 52.55 53.82 1vae s ASP 67 Cb -0.10 -2.37 0.45 0.00 -0.30 0.00 0.00 42.92 40.60 1vae s ASP 67 CO 0.41 -0.71 1.00 0.00 -0.17 0.00 0.00 175.17 175.70 1vae n LYS 69 N -0.19 1.03 -0.06 0.00 4.81 -1.09 -3.28 118.16 119.37 1vae n LYS 69 Ca 0.17 -0.05 -0.08 0.00 -0.87 0.00 0.00 58.31 57.48 1vae n LYS 69 Cb 0.78 -1.44 -0.07 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 -2.50 0.00 -1.30 5.64 7.02 -1.26 -3.94 117.44 121.09 1vae n TRP 70 Ca -0.21 0.00 -0.41 0.00 -1.02 0.00 0.00 57.50 55.86 1vae n TRP 70 Cb 0.90 -0.53 0.00 0.00 -2.42 0.00 0.00 31.31 29.26 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 -2.68 -2.73 0.00 -0.99 4.77 -1.26 -4.82 117.00 109.29 1vae n LEU 71 Ca -0.21 0.78 0.00 0.00 -0.03 0.00 0.00 56.01 56.55 1vae n LEU 71 Cb 0.80 -0.90 0.00 0.00 -2.33 0.00 0.00 43.42 40.99 1vae n LEU 71 CO 0.18 -4.20 0.00 0.35 -1.33 0.00 0.00 177.39 172.39 1vae n THR 72 N -1.13 0.00 -0.01 -5.08 -2.24 -1.26 -4.48 114.28 100.08 1vae n THR 72 Ca 0.11 0.00 -0.12 0.00 -2.27 0.00 0.00 64.05 61.76 1vae n THR 72 Cb 0.42 -0.59 -0.10 0.00 -2.10 0.00 0.00 70.33 67.95 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 1.31 -0.00 2.28 2.07 -1.82 -2.75 116.25 117.34 1vae h VAL 73 Ca 0.00 -1.54 0.02 0.00 0.82 0.00 0.00 66.70 66.00 1vae h VAL 73 Cb 0.00 2.26 -0.05 0.00 -1.52 0.00 0.00 31.29 31.98 1vae h VAL 73 CO 0.00 0.37 -0.50 -1.28 0.02 0.00 0.00 177.57 176.18 1vae h SER 74 N -0.79 -1.53 0.00 0.57 0.87 -1.96 0.66 113.55 111.38 1vae h SER 74 Ca -0.01 0.17 0.00 0.00 -1.23 0.00 0.00 61.79 60.72 1vae h SER 74 Cb 0.65 0.58 0.00 0.00 -0.44 0.00 0.00 62.40 63.19 1vae h SER 74 CO 0.01 -0.48 0.00 -0.62 -0.53 0.00 0.00 176.83 175.21 1vae n GLU 75 N -5.21 0.00 -0.32 2.24 4.71 -1.25 -1.04 120.64 119.76 1vae n GLU 75 Ca -0.07 0.75 -0.11 0.00 -0.01 0.00 0.00 57.16 57.72 1vae n GLU 75 Cb 0.36 -1.43 -0.08 0.00 -1.01 0.00 0.00 31.44 29.28 1vae n GLU 75 CO 0.00 0.00 0.00 0.28 0.09 0.00 0.00 177.13 177.50 1vae h VAL 76 N 0.00 0.01 -0.86 2.62 2.07 -1.37 0.50 116.25 119.22 1vae h VAL 76 Ca 0.00 0.00 0.12 0.00 0.82 0.00 0.00 66.70 67.64 1vae h VAL 76 Cb 0.00 0.01 -0.13 0.00 -1.52 0.00 0.00 31.29 29.65 1vae h VAL 76 CO 0.00 0.00 -0.39 0.23 0.02 0.00 0.00 177.57 177.43 1vae n MET 77 N -5.32 -0.26 -0.18 1.57 2.81 0.23 0.16 117.12 116.14 1vae n MET 77 Ca 0.01 1.32 -0.09 0.00 -1.81 0.00 0.00 57.70 57.13 1vae n MET 77 Cb 0.30 -1.95 0.01 0.00 -0.71 0.00 0.00 33.22 30.87 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 0.81 -0.03 0.03 1.57 0.95 0.85 116.57 120.75 1vae h LYS 78 Ca 0.25 -0.19 0.01 0.00 -1.87 0.00 0.00 60.65 58.84 1vae h LYS 78 Cb 0.47 -0.11 -0.00 0.00 0.08 0.00 0.00 32.23 32.67 1vae h LYS 78 CO -0.84 0.78 0.04 1.25 -0.57 0.00 0.00 179.45 180.11 1vae h LEU 79 N 0.70 0.00 0.00 2.94 6.46 0.59 0.82 115.31 126.81 1vae h LEU 79 Ca 0.16 0.00 -0.20 0.00 -0.12 0.00 0.00 57.88 57.72 1vae h LEU 79 Cb 0.33 0.00 -0.03 0.00 -0.73 0.00 0.00 40.66 40.23 1vae h LEU 79 CO 0.00 0.00 -1.19 0.18 -0.62 0.00 0.00 178.44 176.81 1vae n LEU 80 N -3.68 1.85 -0.11 2.25 4.77 0.42 -4.01 117.00 118.50 1vae n LEU 80 Ca -0.02 0.46 -0.05 0.00 -0.03 0.00 0.00 56.01 56.36 1vae n LEU 80 Cb 0.13 -0.94 0.02 0.00 -2.33 0.00 0.00 43.42 40.30 1vae n LEU 80 CO 0.26 0.15 0.89 0.11 -1.33 0.00 0.00 177.39 177.48 1vae h LYS 81 N -1.00 0.18 -1.15 3.23 1.57 0.11 0.09 116.57 119.60 1vae h LYS 81 Ca -0.30 -0.01 0.35 0.00 -1.87 0.00 0.00 60.65 58.82 1vae h LYS 81 Cb 1.18 -0.04 -0.12 0.00 0.08 0.00 0.00 32.23 33.33 1vae h LYS 81 CO -0.18 0.12 0.73 1.03 -0.57 0.00 0.00 179.45 180.57 1vae h SER 82 N 0.18 0.37 -0.88 0.86 0.87 0.46 1.07 113.55 116.49 1vae h SER 82 Ca 0.18 0.13 -0.58 0.00 -1.23 0.00 0.00 61.79 60.28 1vae h SER 82 Cb 0.21 0.09 -0.25 0.00 -0.44 0.00 0.00 62.40 62.01 1vae h SER 82 CO -0.24 -0.08 0.75 0.49 -0.53 0.00 0.00 176.83 177.23 1vae n PHE 83 N -4.74 2.75 -1.69 2.24 3.72 0.01 -4.98 117.46 114.77 1vae n PHE 83 Ca 0.32 -2.72 -0.42 0.00 -0.05 0.00 0.00 57.45 54.58 1vae n PHE 83 Cb 1.14 -1.32 -0.03 0.00 -0.94 0.00 0.00 39.48 38.33 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 -1.24 1.34 -1.67 1.37 0.00 0.37 -2.11 107.32 105.39 1vae s GLY 84 Ca 0.55 1.44 -0.14 0.00 0.00 0.00 0.00 44.72 46.58 1vae s GLY 84 CO -0.02 3.23 0.59 0.61 0.00 0.00 0.00 173.10 177.51 1vae n GLY 85 N 4.32 -0.36 0.09 0.20 0.00 -0.86 -4.79 105.19 103.78 1vae n GLY 85 Ca 0.18 0.13 0.02 0.00 0.00 0.00 0.00 46.02 46.35 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 -4.35 1.86 -2.29 1.61 -0.58 -0.89 -4.92 120.64 111.08 1vae n GLU 86 Ca -0.03 -0.45 0.00 0.00 -0.42 0.00 0.00 57.16 56.26 1vae n GLU 86 Cb 0.54 -0.91 0.00 0.00 -0.57 0.00 0.00 31.44 30.50 1vae n GLU 86 CO 0.00 0.00 0.00 -1.91 -0.48 0.00 0.00 177.13 174.74 1vae n GLU 87 N -0.27 -5.21 -4.34 3.49 2.13 -1.26 -5.01 120.64 110.18 1vae n GLU 87 Ca 0.01 3.77 -0.18 0.00 0.66 0.00 0.00 57.16 61.42 1vae n GLU 87 Cb 0.07 -4.61 -0.10 0.00 0.27 0.00 0.00 31.44 27.07 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 -0.58 0.47 -0.32 6.31 -7.23 -0.95 -5.00 120.40 113.10 1vae s VAL 88 Ca 0.00 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.17 1vae s VAL 88 Cb 0.00 -2.57 0.08 0.00 0.56 0.00 0.00 36.38 34.44 1vae s VAL 88 CO 0.00 0.00 0.03 -1.61 -0.31 0.00 0.00 175.10 173.21 1vae s GLU 89 N -3.92 2.06 -0.06 4.82 2.02 -1.26 -3.28 118.70 119.08 1vae s GLU 89 Ca 0.36 -1.55 -0.18 0.00 0.02 0.00 0.00 54.97 53.62 1vae s GLU 89 Cb 0.06 -3.21 -0.05 0.00 0.10 0.00 0.00 34.13 31.04 1vae s GLU 89 CO 0.15 -0.78 0.48 1.41 0.02 0.00 0.00 175.26 176.54 1vae s MET 90 N 1.11 4.21 -0.11 1.61 -2.45 -1.19 -1.00 119.30 121.48 1vae s MET 90 Ca 0.01 0.50 -0.01 0.00 -1.25 0.00 0.00 55.69 54.93 1vae s MET 90 Cb -0.20 -3.35 -0.03 0.00 1.25 0.00 0.00 34.83 32.50 1vae s MET 90 CO -0.04 0.37 -0.06 0.15 1.05 0.00 0.00 175.02 176.49 1vae s LYS 91 N -0.09 3.25 0.01 4.11 1.02 -0.76 -2.18 119.74 125.10 1vae s LYS 91 Ca 0.26 -0.54 0.02 0.00 0.02 0.00 0.00 55.97 55.73 1vae s LYS 91 Cb -0.16 -2.75 -0.01 0.00 -0.52 0.00 0.00 37.83 34.38 1vae s LYS 91 CO 0.13 0.43 -0.08 0.14 -0.92 0.00 0.00 175.35 175.05 1vae s VAL 92 N -0.16 0.57 0.32 3.17 -7.23 -1.22 0.38 120.40 116.23 1vae s VAL 92 Ca 0.02 -0.60 0.10 0.00 -1.81 0.00 0.00 61.98 59.70 1vae s VAL 92 Cb -0.13 -0.54 -0.06 0.00 0.56 0.00 0.00 36.38 36.22 1vae s VAL 92 CO 0.03 -0.04 -0.09 0.68 -0.31 0.00 0.00 175.10 175.37 1vae s VAL 93 N -0.60 2.53 -0.01 1.32 -7.23 -1.05 -1.25 120.40 114.10 1vae s VAL 93 Ca -0.02 -2.17 -0.03 0.00 -1.81 0.00 0.00 61.98 57.96 1vae s VAL 93 Cb -0.05 -2.61 -0.04 0.00 0.56 0.00 0.00 36.38 34.24 1vae s VAL 93 CO 0.00 -0.27 0.18 -0.44 -0.31 0.00 0.00 175.10 174.25 1vae s SER 94 N -3.62 6.32 -0.27 4.85 0.01 -1.26 -3.28 113.70 116.46 1vae s SER 94 Ca 0.32 0.33 -0.12 0.00 1.31 0.00 0.00 55.95 57.79 1vae s SER 94 Cb -0.01 -1.98 -0.05 0.00 0.21 0.00 0.00 66.02 64.20 1vae s SER 94 CO 0.17 0.26 0.24 -0.22 0.41 0.00 0.00 173.24 174.10 1vae s LEU 95 N -1.92 4.05 -0.17 2.44 2.96 -1.26 -0.39 118.68 124.39 1vae s LEU 95 Ca 0.27 0.11 -0.02 0.00 -0.22 0.00 0.00 54.13 54.27 1vae s LEU 95 Cb -0.13 -2.21 -0.01 0.00 0.50 0.00 0.00 46.19 44.34 1vae s LEU 95 CO 0.18 -0.06 -0.08 -0.76 -1.32 0.00 0.00 176.35 174.31 1vae s LEU 96 N 1.69 2.89 -0.14 -0.68 2.01 0.12 -4.98 118.68 119.59 1vae s LEU 96 Ca 0.10 -0.31 -0.32 0.00 0.01 0.00 0.00 54.13 53.61 1vae s LEU 96 Cb -0.15 -1.69 0.13 0.00 0.01 0.00 0.00 46.19 44.48 1vae s LEU 96 CO 0.09 0.10 1.10 -0.62 1.01 0.00 0.00 176.35 178.03 1vae s ASP 97 N 0.75 -0.23 -0.05 2.29 2.15 -1.26 -2.71 116.67 117.61 1vae s ASP 97 Ca -0.03 0.06 -0.10 0.00 0.43 0.00 0.00 52.55 52.90 1vae s ASP 97 Cb -0.15 0.23 -0.06 0.00 -0.30 0.00 0.00 42.92 42.64 1vae s ASP 97 CO 0.02 -0.35 0.43 -1.28 -0.17 0.00 0.00 175.17 173.82 1vae h SER 98 N 2.08 -0.31 -3.89 -0.34 0.87 -2.00 -3.50 113.55 106.46 1vae h SER 98 Ca -0.14 0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.43 1vae h SER 98 Cb 1.19 0.08 0.00 0.00 -0.44 0.00 0.00 62.40 63.23 1vae h SER 98 CO 0.26 0.12 -0.99 0.41 -0.53 0.00 0.00 176.83 176.10 1vae n THR 99 N -4.86 -3.44 -0.93 2.23 -1.04 -1.26 -5.01 114.28 99.96 1vae n THR 99 Ca -0.05 1.68 0.00 0.00 -2.04 0.00 0.00 64.05 63.65 1vae n THR 99 Cb 0.14 -2.67 0.00 0.00 -1.82 0.00 0.00 70.33 65.98 1vae n THR 99 CO 0.00 0.00 0.00 -0.24 -0.64 0.00 0.00 175.07 174.19 1vae n SER 100 N -2.34 -5.36 -3.15 8.00 2.88 -1.26 -5.07 113.62 107.33 1vae n SER 100 Ca 0.00 0.80 0.06 0.00 -1.33 0.00 0.00 58.87 58.39 1vae n SER 100 Cb 0.41 -2.43 -0.00 0.00 -0.75 0.00 0.00 64.21 61.44 1vae n SER 100 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1vae s SER 101 N -3.13 -0.36 0.11 -3.46 0.15 -1.26 -5.18 113.70 100.58 1vae s SER 101 Ca 0.00 0.08 -0.12 0.00 0.70 0.00 0.00 55.95 56.61 1vae s SER 101 Cb 0.00 1.24 0.01 0.00 -1.71 0.00 0.00 66.02 65.56 1vae s SER 101 CO 0.00 -0.07 0.28 -0.32 1.20 0.00 0.00 173.24 174.34 1vae s MET 102 N 2.96 0.95 -0.27 5.44 1.75 -1.26 -5.17 119.30 123.70 1vae s MET 102 Ca 0.22 -0.85 -0.23 0.00 -1.25 0.00 0.00 55.69 53.58 1vae s MET 102 Cb -0.03 0.40 0.08 0.00 2.84 0.00 0.00 34.83 38.12 1vae s MET 102 CO -0.20 -0.34 0.75 -1.58 -0.65 0.00 0.00 175.02 173.00 1vae s HIS 103 N -3.84 -0.82 -0.27 4.11 5.04 -1.26 -5.17 115.29 113.08 1vae s HIS 103 Ca 0.04 1.89 -0.26 0.00 -1.54 0.00 0.00 55.06 55.20 1vae s HIS 103 Cb 0.03 0.36 0.14 0.00 0.04 0.00 0.00 32.58 33.15 1vae s HIS 103 CO -0.11 -0.40 1.11 1.21 -2.34 0.00 0.00 174.74 174.20 1vae s ASN 104 N 0.68 -0.36 -0.02 9.88 2.47 -1.26 -5.09 114.94 121.23 1vae s ASN 104 Ca -0.02 0.67 -0.04 0.00 0.42 0.00 0.00 52.86 53.88 1vae s ASN 104 Cb -0.05 0.66 -0.01 0.00 -1.45 0.00 0.00 41.25 40.40 1vae s ASN 104 CO -0.05 -0.15 -0.08 1.17 -3.72 0.00 0.00 177.10 174.28 1vae n LYS 105 N 1.91 0.12 -1.23 0.43 0.00 -1.26 -5.13 118.16 112.99 1vae n LYS 105 Ca -0.12 0.05 0.16 0.00 0.00 0.00 0.00 58.31 58.40 1vae n LYS 105 Cb 0.56 -0.57 -0.06 0.00 0.00 0.00 0.00 35.03 34.96 1vae n LYS 105 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 1vae n SER 106 N -3.14 -7.38 0.00 3.14 2.88 -1.26 -5.05 113.62 102.81 1vae n SER 106 Ca -0.03 0.91 0.00 0.00 -1.33 0.00 0.00 58.87 58.42 1vae n SER 106 Cb 0.12 -4.01 0.00 0.00 -0.75 0.00 0.00 64.21 59.57 1vae n SER 106 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1vae n GLY 107 N -4.05 -0.29 3.80 0.46 0.00 -1.26 -5.17 105.19 98.68 1vae n GLY 107 Ca -0.04 0.38 -0.29 0.00 0.00 0.00 0.00 46.02 46.06 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 0.00 1.74 0.55 1.61 0.04 -1.26 -5.07 135.00 132.61 1vae s PRO 108 Ca 0.00 0.51 0.01 0.00 0.04 0.00 0.00 61.00 61.55 1vae s PRO 108 Cb 0.00 -1.89 0.03 0.00 0.04 0.00 0.00 34.50 32.68 1vae s PRO 108 CO 0.00 -1.83 0.78 -1.54 0.04 0.00 0.00 177.00 174.45 1vae s SER 109 N -3.96 5.29 -0.10 6.66 1.04 -1.26 -5.12 113.70 116.26 1vae s SER 109 Ca 0.62 0.03 -0.06 0.00 0.48 0.00 0.00 55.95 57.01 1vae s SER 109 Cb -0.14 -0.92 0.04 0.00 0.10 0.00 0.00 66.02 65.09 1vae s SER 109 CO 0.54 -1.14 0.23 -0.55 0.98 0.00 0.00 173.24 173.31 1vae s SER 110 N -4.42 -0.25 0.00 7.02 0.15 -1.26 -5.36 113.70 109.58 1vae s SER 110 Ca 0.57 0.49 0.00 0.00 0.70 0.00 0.00 55.95 57.71 1vae s SER 110 Cb -0.10 0.42 0.00 0.00 -1.71 0.00 0.00 66.02 64.63 1vae s SER 110 CO 0.39 -0.13 0.00 0.61 1.20 0.00 0.00 173.24 175.31