#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ke0 s PRO 2 N 0.00 4.37 0.00 1.61 0.04 -1.26 -4.91 135.00 134.85 2ke0 s PRO 2 Ca 0.00 2.04 0.00 0.00 0.04 0.00 0.00 61.00 63.08 2ke0 s PRO 2 Cb 0.00 -3.22 0.00 0.00 0.04 0.00 0.00 34.50 31.32 2ke0 s PRO 2 CO 0.00 -0.31 0.00 0.41 0.04 0.00 0.00 177.00 177.14 2ke0 n GLY 3 N 2.80 4.14 2.40 0.56 0.00 -1.26 -5.04 105.19 108.79 2ke0 n GLY 3 Ca 0.08 -1.49 -0.26 0.00 0.00 0.00 0.00 46.02 44.35 2ke0 n GLY 3 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2ke0 n SER 4 N 0.00 1.51 -4.10 1.61 3.41 -1.26 -5.07 113.62 109.73 2ke0 n SER 4 Ca 0.00 -2.93 -0.32 0.00 -0.26 0.00 0.00 58.87 55.36 2ke0 n SER 4 Cb 0.00 -0.65 -0.16 0.00 -0.26 0.00 0.00 64.21 63.14 2ke0 n SER 4 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 2ke0 s MET 5 N -1.37 2.67 0.02 4.33 -1.94 -1.26 -4.91 119.30 116.84 2ke0 s MET 5 Ca 0.35 -1.02 0.01 0.00 -1.71 0.00 0.00 55.69 53.32 2ke0 s MET 5 Cb 0.11 -2.67 -0.01 0.00 2.01 0.00 0.00 34.83 34.26 2ke0 s MET 5 CO -0.11 -0.35 -0.05 -0.08 -0.01 0.00 0.00 175.02 174.42 2ke0 s THR 6 N 1.23 0.38 -0.11 2.05 -1.32 -1.26 -5.10 115.64 111.51 2ke0 s THR 6 Ca -0.00 -0.59 -0.24 0.00 -1.21 0.00 0.00 61.69 59.64 2ke0 s THR 6 Cb -0.16 -0.40 -0.03 0.00 -1.51 0.00 0.00 72.50 70.41 2ke0 s THR 6 CO -0.10 -0.15 0.76 -0.69 -2.21 0.00 0.00 174.62 172.23 2ke0 s VAL 7 N -0.72 4.97 -0.21 5.08 1.01 -1.26 -4.33 120.40 124.94 2ke0 s VAL 7 Ca -0.05 1.53 -0.07 0.00 0.00 0.00 0.00 61.98 63.40 2ke0 s VAL 7 Cb -0.06 -4.09 -0.04 0.00 0.00 0.00 0.00 36.38 32.20 2ke0 s VAL 7 CO -0.00 0.15 0.06 -0.69 0.00 0.00 0.00 175.10 174.62 2ke0 s VAL 8 N 1.39 4.53 -0.15 2.92 1.01 0.01 -4.98 120.40 125.14 2ke0 s VAL 8 Ca 0.38 -0.11 -0.07 0.00 0.00 0.00 0.00 61.98 62.17 2ke0 s VAL 8 Cb -0.17 -3.07 -0.04 0.00 0.00 0.00 0.00 36.38 33.10 2ke0 s VAL 8 CO 0.16 0.41 0.11 0.42 0.00 0.00 0.00 175.10 176.21 2ke0 s THR 9 N 0.85 5.25 0.29 3.92 -4.23 -1.26 -2.19 115.64 118.26 2ke0 s THR 9 Ca 0.03 0.12 0.06 0.00 -1.18 0.00 0.00 61.69 60.72 2ke0 s THR 9 Cb -0.14 -3.32 -0.02 0.00 1.34 0.00 0.00 72.50 70.36 2ke0 s THR 9 CO 0.02 0.55 0.35 0.42 -0.54 0.00 0.00 174.62 175.42 2ke0 s THR 10 N -0.42 4.48 0.48 3.99 -4.23 -0.96 -5.00 115.64 113.98 2ke0 s THR 10 Ca 0.11 -1.13 0.27 0.00 -1.18 0.00 0.00 61.69 59.76 2ke0 s THR 10 Cb -0.12 -3.53 0.30 0.00 1.34 0.00 0.00 72.50 70.49 2ke0 s THR 10 CO 0.02 -0.26 2.13 -0.33 -0.54 0.00 0.00 174.62 175.64 2ke0 h GLU 11 N 1.16 0.00 -0.04 3.99 5.08 -1.99 -2.58 114.58 120.19 2ke0 h GLU 11 Ca -0.48 0.00 -0.15 0.00 -1.00 0.00 0.00 59.36 57.72 2ke0 h GLU 11 Cb 1.24 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.50 2ke0 h GLU 11 CO 0.58 0.08 -0.57 0.66 -1.00 0.00 0.00 179.01 178.77 2ke0 h SER 12 N 0.00 0.57 0.00 1.42 4.64 -2.03 -3.48 113.55 114.67 2ke0 h SER 12 Ca -0.00 -0.71 0.00 0.00 -0.47 0.00 0.00 61.79 60.61 2ke0 h SER 12 Cb 0.22 -0.17 0.00 0.00 -0.31 0.00 0.00 62.40 62.14 2ke0 h SER 12 CO 0.01 1.20 0.00 0.61 -0.87 0.00 0.00 176.83 177.78 2ke0 n GLY 13 N 0.92 2.34 3.53 -0.77 0.00 -0.97 -5.08 105.19 105.15 2ke0 n GLY 13 Ca -0.09 -0.21 -0.32 0.00 0.00 0.00 0.00 46.02 45.40 2ke0 n GLY 13 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 2ke0 n LEU 14 N 0.00 1.15 -3.86 0.99 -0.00 -1.26 -4.63 117.00 109.39 2ke0 n LEU 14 Ca 0.00 0.29 -0.12 0.00 -0.00 0.00 0.00 56.01 56.18 2ke0 n LEU 14 Cb 0.00 -1.32 -0.14 0.00 -0.00 0.00 0.00 43.42 41.96 2ke0 n LEU 14 CO 0.00 -2.88 -0.32 -0.54 -0.00 0.00 0.00 177.39 173.65 2ke0 s LYS 15 N -4.16 0.04 0.16 1.47 1.02 -0.60 -2.27 119.74 115.39 2ke0 s LYS 15 Ca 0.63 0.06 -0.00 0.00 0.02 0.00 0.00 55.97 56.67 2ke0 s LYS 15 Cb -0.22 0.01 -0.04 0.00 -0.52 0.00 0.00 37.83 37.06 2ke0 s LYS 15 CO 0.63 -0.01 0.05 1.52 -0.92 0.00 0.00 175.35 176.62 2ke0 s TYR 16 N 0.05 1.03 -0.04 3.18 -0.85 -0.93 0.35 117.35 120.13 2ke0 s TYR 16 Ca -0.00 -1.19 -0.02 0.00 -0.52 0.00 0.00 57.07 55.33 2ke0 s TYR 16 Cb -0.01 -0.57 0.03 0.00 0.38 0.00 0.00 41.96 41.79 2ke0 s TYR 16 CO -0.00 -0.44 0.10 -2.00 -1.52 0.00 0.00 175.55 171.68 2ke0 s GLU 17 N -4.03 0.06 0.22 -3.49 2.12 0.91 -0.81 118.70 113.68 2ke0 s GLU 17 Ca 0.27 0.26 -0.32 0.00 0.36 0.00 0.00 54.97 55.54 2ke0 s GLU 17 Cb 0.07 -0.14 -0.11 0.00 0.26 0.00 0.00 34.13 34.20 2ke0 s GLU 17 CO 0.04 -0.13 1.67 0.16 -0.54 0.00 0.00 175.26 176.46 2ke0 s ASP 18 N 0.87 6.41 -0.09 -1.70 -4.77 -1.26 -1.15 116.67 114.98 2ke0 s ASP 18 Ca -0.07 2.84 -0.08 0.00 -3.30 0.00 0.00 52.55 51.94 2ke0 s ASP 18 Cb -0.09 -2.61 -0.03 0.00 -1.09 0.00 0.00 42.92 39.11 2ke0 s ASP 18 CO -0.04 -0.93 -0.15 0.18 0.70 0.00 0.00 175.17 174.93 2ke0 n LEU 19 N 3.62 1.04 -3.66 2.11 7.99 0.54 -4.84 117.00 123.80 2ke0 n LEU 19 Ca 0.14 0.31 -0.25 0.00 -0.01 0.00 0.00 56.01 56.19 2ke0 n LEU 19 Cb 0.36 -0.67 -0.17 0.00 -0.11 0.00 0.00 43.42 42.84 2ke0 n LEU 19 CO 0.63 -0.42 -0.34 -0.89 -1.51 0.00 0.00 177.39 174.86 2ke0 s THR 20 N -1.90 0.09 -0.07 -5.08 2.01 0.48 -4.94 115.64 106.23 2ke0 s THR 20 Ca -0.13 -0.17 -0.29 0.00 0.31 0.00 0.00 61.69 61.42 2ke0 s THR 20 Cb 0.02 -0.63 -0.07 0.00 0.01 0.00 0.00 72.50 71.82 2ke0 s THR 20 CO 0.19 -0.17 2.08 1.21 -0.69 0.00 0.00 174.62 177.24 2ke0 n GLU 21 N 5.22 2.50 -0.59 4.92 2.13 -1.26 -1.17 120.64 132.39 2ke0 n GLU 21 Ca -0.07 0.84 -0.28 0.00 0.66 0.00 0.00 57.16 58.30 2ke0 n GLU 21 Cb 0.49 -3.11 0.25 0.00 0.27 0.00 0.00 31.44 29.34 2ke0 n GLU 21 CO 0.00 0.00 0.00 0.20 -0.41 0.00 0.00 177.13 176.92 2ke0 s GLY 22 N 6.10 1.52 0.00 8.31 0.00 -1.26 -4.86 107.32 117.14 2ke0 s GLY 22 Ca 0.94 -0.29 0.18 0.00 0.00 0.00 0.00 44.72 45.55 2ke0 s GLY 22 CO 0.39 0.47 1.11 -1.14 0.00 0.00 0.00 173.10 173.94 2ke0 n SER 23 N -4.99 0.68 0.00 1.64 3.41 -1.24 -4.90 113.62 108.22 2ke0 n SER 23 Ca 0.04 -1.99 0.00 0.00 -0.26 0.00 0.00 58.87 56.66 2ke0 n SER 23 Cb 0.56 -0.26 0.00 0.00 -0.26 0.00 0.00 64.21 64.24 2ke0 n SER 23 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2ke0 n GLY 24 N 0.35 0.55 2.99 5.00 0.00 -1.19 -5.00 105.19 107.88 2ke0 n GLY 24 Ca 0.04 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.86 2ke0 n GLY 24 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ke0 s ALA 25 N -2.88 0.76 0.10 4.61 0.00 -1.26 -4.79 121.76 118.30 2ke0 s ALA 25 Ca 0.00 -0.29 -0.30 0.00 0.00 0.00 0.00 51.96 51.37 2ke0 s ALA 25 Cb 0.00 -0.28 -0.06 0.00 0.00 0.00 0.00 23.12 22.79 2ke0 s ALA 25 CO 0.00 0.13 0.99 -2.00 0.00 0.00 0.00 175.76 174.88 2ke0 s GLU 26 N 0.16 4.66 0.49 0.00 2.12 -1.26 -0.50 118.70 124.36 2ke0 s GLU 26 Ca -0.02 1.50 -0.24 0.00 0.36 0.00 0.00 54.97 56.57 2ke0 s GLU 26 Cb -0.07 -3.37 -0.07 0.00 0.26 0.00 0.00 34.13 30.87 2ke0 s GLU 26 CO 0.00 0.14 1.36 0.00 -0.54 0.00 0.00 175.26 176.22 2ke0 n ALA 27 N 2.92 1.67 -2.40 6.30 0.00 -0.55 -4.98 120.51 123.47 2ke0 n ALA 27 Ca 0.03 0.20 -0.30 0.00 0.00 0.00 0.00 53.44 53.37 2ke0 n ALA 27 Cb 0.49 -2.35 -0.13 0.00 0.00 0.00 0.00 19.45 17.46 2ke0 n ALA 27 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2ke0 s ARG 28 N -2.57 1.81 0.14 0.00 0.52 -1.26 -4.42 118.95 113.16 2ke0 s ARG 28 Ca 0.65 -1.12 -0.32 0.00 -0.52 0.00 0.00 55.73 54.43 2ke0 s ARG 28 Cb -0.45 -2.04 -0.11 0.00 0.52 0.00 0.00 34.95 32.87 2ke0 s ARG 28 CO 0.54 0.51 1.81 0.00 0.02 0.00 0.00 175.30 178.18 2ke0 n ALA 29 N 1.47 2.27 0.00 2.13 0.00 -1.26 -1.25 120.51 123.87 2ke0 n ALA 29 Ca -0.17 0.34 0.00 0.00 0.00 0.00 0.00 53.44 53.61 2ke0 n ALA 29 Cb 0.52 -2.57 0.00 0.00 0.00 0.00 0.00 19.45 17.40 2ke0 n ALA 29 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ke0 n GLY 30 N 4.16 1.91 3.78 0.00 0.00 0.99 -4.94 105.19 111.08 2ke0 n GLY 30 Ca 0.18 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.81 2ke0 n GLY 30 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2ke0 s GLN 31 N -0.75 4.38 -0.24 1.61 0.74 -0.38 -4.72 119.66 120.29 2ke0 s GLN 31 Ca 0.00 0.92 -0.20 0.00 0.05 0.00 0.00 55.36 56.12 2ke0 s GLN 31 Cb 0.00 -3.29 -0.02 0.00 1.10 0.00 0.00 33.01 30.80 2ke0 s GLN 31 CO 0.00 0.51 0.62 0.99 -0.55 0.00 0.00 175.29 176.86 2ke0 s THR 32 N -0.78 5.00 0.19 -0.34 2.01 -1.26 -1.34 115.64 119.12 2ke0 s THR 32 Ca 0.33 1.12 0.05 0.00 0.31 0.00 0.00 61.69 63.50 2ke0 s THR 32 Cb -0.21 -3.93 -0.05 0.00 0.01 0.00 0.00 72.50 68.33 2ke0 s THR 32 CO 0.21 0.05 -0.08 0.68 -0.69 0.00 0.00 174.62 174.80 2ke0 s VAL 33 N 2.36 1.24 -0.17 3.82 -7.23 0.21 -4.79 120.40 115.86 2ke0 s VAL 33 Ca 0.26 -2.08 -0.03 0.00 -1.81 0.00 0.00 61.98 58.33 2ke0 s VAL 33 Cb -0.16 -2.05 -0.02 0.00 0.56 0.00 0.00 36.38 34.72 2ke0 s VAL 33 CO 0.09 -0.58 -0.07 -0.44 -0.31 0.00 0.00 175.10 173.79 2ke0 s SER 34 N -3.24 4.42 0.09 4.85 0.01 -0.52 -1.25 113.70 118.05 2ke0 s SER 34 Ca 0.21 -0.26 0.02 0.00 1.31 0.00 0.00 55.95 57.23 2ke0 s SER 34 Cb 0.03 -1.72 -0.04 0.00 0.21 0.00 0.00 66.02 64.51 2ke0 s SER 34 CO 0.04 0.12 -0.07 0.68 0.41 0.00 0.00 173.24 174.42 2ke0 s VAL 35 N 0.66 0.69 -0.11 3.43 -7.23 -0.47 -1.33 120.40 116.04 2ke0 s VAL 35 Ca -0.04 -1.71 -0.00 0.00 -1.81 0.00 0.00 61.98 58.42 2ke0 s VAL 35 Cb -0.15 -1.40 -0.02 0.00 0.56 0.00 0.00 36.38 35.37 2ke0 s VAL 35 CO 0.02 -0.73 -0.10 -1.00 -0.31 0.00 0.00 175.10 172.99 2ke0 s HIS 36 N -2.98 2.86 -0.15 2.82 3.76 -0.57 -0.10 115.29 120.94 2ke0 s HIS 36 Ca 0.06 -0.36 -0.03 0.00 -0.15 0.00 0.00 55.06 54.58 2ke0 s HIS 36 Cb 0.01 -1.81 -0.03 0.00 1.11 0.00 0.00 32.58 31.86 2ke0 s HIS 36 CO -0.03 0.00 -0.04 1.52 -0.85 0.00 0.00 174.74 175.34 2ke0 s TYR 37 N -0.05 3.02 -0.37 1.40 1.13 -1.24 -1.06 117.35 120.17 2ke0 s TYR 37 Ca -0.01 -0.29 -0.02 0.00 -1.41 0.00 0.00 57.07 55.34 2ke0 s TYR 37 Cb -0.14 -1.94 0.09 0.00 -1.10 0.00 0.00 41.96 38.87 2ke0 s TYR 37 CO 0.03 -0.02 0.13 0.99 -2.51 0.00 0.00 175.55 174.17 2ke0 s THR 38 N 0.29 3.13 0.51 -3.49 2.01 -0.04 -3.30 115.64 114.76 2ke0 s THR 38 Ca -0.04 -1.84 -0.21 0.00 0.31 0.00 0.00 61.69 59.91 2ke0 s THR 38 Cb -0.14 -3.04 -0.06 0.00 0.01 0.00 0.00 72.50 69.26 2ke0 s THR 38 CO 0.03 -0.49 1.17 -0.83 -0.69 0.00 0.00 174.62 173.81 2ke0 s GLY 39 N 1.56 2.73 -0.15 4.40 0.00 0.72 -0.67 107.32 115.91 2ke0 s GLY 39 Ca 0.04 0.92 -0.12 0.00 0.00 0.00 0.00 44.72 45.56 2ke0 s GLY 39 CO -0.03 1.34 0.39 -0.98 0.00 0.00 0.00 173.10 173.81 2ke0 s TRP 40 N -1.62 -0.47 1.04 1.90 0.51 0.86 -3.72 118.94 117.44 2ke0 s TRP 40 Ca 0.69 1.09 -0.17 0.00 -2.12 0.00 0.00 56.10 55.58 2ke0 s TRP 40 Cb -0.28 0.17 0.24 0.00 -0.81 0.00 0.00 33.47 32.79 2ke0 s TRP 40 CO 0.32 -0.24 1.29 -0.51 -0.51 0.00 0.00 176.95 177.30 2ke0 s LEU 41 N 0.57 2.21 0.43 2.99 1.43 0.88 -1.44 118.68 125.75 2ke0 s LEU 41 Ca -0.03 0.29 0.09 0.00 -1.03 0.00 0.00 54.13 53.44 2ke0 s LEU 41 Cb -0.05 -2.19 0.94 0.00 0.03 0.00 0.00 46.19 44.92 2ke0 s LEU 41 CO -0.03 -3.19 2.07 0.71 0.23 0.00 0.00 176.35 176.14 2ke0 h THR 42 N -1.96 1.08 0.00 5.49 1.35 -1.90 -0.87 112.91 116.11 2ke0 h THR 42 Ca -0.44 -0.16 -0.01 0.00 -0.55 0.00 0.00 66.41 65.25 2ke0 h THR 42 Cb 1.24 0.59 -0.00 0.00 -1.73 0.00 0.00 68.15 68.24 2ke0 h THR 42 CO 0.33 0.08 -0.29 0.44 -0.25 0.00 0.00 175.52 175.84 2ke0 h ASP 43 N 0.46 0.00 0.00 5.36 3.32 -1.94 -3.47 116.42 120.15 2ke0 h ASP 43 Ca 0.13 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.18 2ke0 h ASP 43 Cb -0.04 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.51 2ke0 h ASP 43 CO -0.03 0.05 0.00 0.61 -1.72 0.00 0.00 179.24 178.15 2ke0 n GLY 44 N 1.13 1.10 3.71 2.75 0.00 -0.33 -5.09 105.19 108.47 2ke0 n GLY 44 Ca 0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 2ke0 n GLY 44 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2ke0 s GLN 45 N -0.42 4.45 -0.49 1.61 -0.44 -1.26 -4.58 119.66 118.53 2ke0 s GLN 45 Ca 0.00 1.73 -0.29 0.00 -2.50 0.00 0.00 55.36 54.30 2ke0 s GLN 45 Cb 0.00 -3.36 0.02 0.00 -1.64 0.00 0.00 33.01 28.04 2ke0 s GLN 45 CO 0.00 -0.22 1.27 0.21 0.50 0.00 0.00 175.29 177.05 2ke0 s LYS 46 N 1.00 3.58 0.10 1.67 2.20 -1.26 -0.08 119.74 126.94 2ke0 s LYS 46 Ca 0.58 0.59 0.22 0.00 -0.36 0.00 0.00 55.97 57.00 2ke0 s LYS 46 Cb -0.29 -3.99 -0.14 0.00 -1.51 0.00 0.00 37.83 31.90 2ke0 s LYS 46 CO 0.29 -1.58 0.79 1.97 -0.36 0.00 0.00 175.35 176.47 2ke0 n PHE 47 N 8.50 0.58 -3.71 4.03 1.16 -1.24 -4.93 117.46 121.85 2ke0 n PHE 47 Ca 0.13 0.17 -0.12 0.00 -1.87 0.00 0.00 57.45 55.76 2ke0 n PHE 47 Cb 0.49 -0.79 -0.10 0.00 -1.61 0.00 0.00 39.48 37.46 2ke0 n PHE 47 CO 0.00 0.00 0.00 -0.51 -1.87 0.00 0.00 176.76 174.38 2ke0 s ASP 48 N -5.06 -0.49 -0.30 5.98 1.01 -1.26 -5.04 116.67 111.50 2ke0 s ASP 48 Ca -0.04 0.91 0.02 0.00 0.71 0.00 0.00 52.55 54.15 2ke0 s ASP 48 Cb 0.11 0.87 0.15 0.00 1.01 0.00 0.00 42.92 45.07 2ke0 s ASP 48 CO 0.84 -0.17 0.38 -0.55 0.21 0.00 0.00 175.17 175.88 2ke0 s SER 49 N 0.66 0.82 0.28 0.27 0.15 -1.26 -0.20 113.70 114.42 2ke0 s SER 49 Ca -0.03 -0.64 0.01 0.00 0.70 0.00 0.00 55.95 55.98 2ke0 s SER 49 Cb -0.05 0.89 0.56 0.00 -1.71 0.00 0.00 66.02 65.70 2ke0 s SER 49 CO -0.04 -0.35 1.82 0.77 1.20 0.00 0.00 173.24 176.64 2ke0 h SER 50 N 8.04 0.88 -0.18 5.45 4.64 -1.84 0.17 113.55 130.71 2ke0 h SER 50 Ca -0.08 0.05 0.05 0.00 -0.47 0.00 0.00 61.79 61.35 2ke0 h SER 50 Cb 1.10 -0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 63.06 2ke0 h SER 50 CO 0.27 0.45 0.23 0.07 -0.87 0.00 0.00 176.83 176.98 2ke0 h LYS 51 N 0.94 0.00 0.00 4.77 5.09 -1.82 0.28 116.57 125.83 2ke0 h LYS 51 Ca 0.50 0.00 -0.07 0.00 0.09 0.00 0.00 60.65 61.16 2ke0 h LYS 51 Cb 0.52 0.00 -0.01 0.00 0.10 0.00 0.00 32.23 32.84 2ke0 h LYS 51 CO -0.28 0.00 -0.34 0.22 -2.09 0.00 0.00 179.45 176.96 2ke0 h ASP 52 N 0.00 0.00 -0.10 7.07 3.58 -1.06 -3.04 116.42 122.87 2ke0 h ASP 52 Ca 0.09 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.54 2ke0 h ASP 52 Cb 0.53 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.58 2ke0 h ASP 52 CO -0.00 0.34 0.00 -1.14 -2.88 0.00 0.00 179.24 175.56 2ke0 n ARG 53 N -3.53 2.20 -3.93 0.28 3.00 0.79 -4.98 116.66 110.50 2ke0 n ARG 53 Ca -0.00 -2.36 -0.29 0.00 -0.00 0.00 0.00 57.85 55.20 2ke0 n ARG 53 Cb 0.48 -1.45 0.01 0.00 0.00 0.00 0.00 32.46 31.50 2ke0 n ARG 53 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.63 177.72 2ke0 n ASN 54 N -0.81 -3.23 -3.77 6.15 3.02 -0.02 -4.91 115.26 111.68 2ke0 n ASN 54 Ca 0.13 -0.86 -0.32 0.00 -0.03 0.00 0.00 54.58 53.50 2ke0 n ASN 54 Cb 0.60 -3.62 -0.06 0.00 -0.61 0.00 0.00 39.78 36.08 2ke0 n ASN 54 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 2ke0 n ASP 55 N -2.87 4.29 -4.68 6.41 -0.08 -0.37 -5.00 116.55 114.25 2ke0 n ASP 55 Ca -0.07 -3.33 -0.42 0.00 -1.51 0.00 0.00 54.79 49.45 2ke0 n ASP 55 Cb 0.57 -0.89 -0.03 0.00 2.34 0.00 0.00 41.12 43.12 2ke0 n ASP 55 CO 0.00 0.00 0.00 -2.16 0.12 0.00 0.00 177.20 175.16 2ke0 s PRO 56 N -2.14 4.24 -0.55 -0.67 0.04 -1.26 -4.65 135.00 130.01 2ke0 s PRO 56 Ca 0.33 2.02 -0.28 0.00 0.04 0.00 0.00 61.00 63.12 2ke0 s PRO 56 Cb 0.05 -3.72 0.01 0.00 0.04 0.00 0.00 34.50 30.88 2ke0 s PRO 56 CO -0.04 -0.68 1.52 0.12 0.04 0.00 0.00 177.00 177.96 2ke0 s PHE 57 N 3.03 2.14 -0.15 0.56 2.19 0.86 -4.77 117.98 121.83 2ke0 s PHE 57 Ca 0.66 0.53 -0.05 0.00 0.33 0.00 0.00 56.93 58.39 2ke0 s PHE 57 Cb -0.31 -4.32 -0.04 0.00 -1.31 0.00 0.00 43.02 37.04 2ke0 s PHE 57 CO 0.26 -2.13 0.03 0.00 1.83 0.00 0.00 175.22 175.21 2ke0 s ALA 58 N 6.60 3.32 0.31 11.12 0.00 -1.26 -1.36 121.76 140.48 2ke0 s ALA 58 Ca 0.57 -0.77 -0.18 0.00 0.00 0.00 0.00 51.96 51.58 2ke0 s ALA 58 Cb -0.12 -1.75 0.06 0.00 0.00 0.00 0.00 23.12 21.30 2ke0 s ALA 58 CO 0.25 0.30 0.87 -0.59 0.00 0.00 0.00 175.76 176.59 2ke0 s PHE 59 N 0.03 0.08 -0.12 0.00 -0.71 -0.38 -4.96 117.98 111.93 2ke0 s PHE 59 Ca 0.04 -0.65 -0.14 0.00 -1.04 0.00 0.00 56.93 55.15 2ke0 s PHE 59 Cb -0.13 0.78 -0.05 0.00 -1.21 0.00 0.00 43.02 42.42 2ke0 s PHE 59 CO 0.01 -1.32 0.32 0.14 -1.34 0.00 0.00 175.22 173.03 2ke0 s VAL 60 N -2.37 5.26 -0.40 -2.49 -7.23 -1.26 -0.61 120.40 111.29 2ke0 s VAL 60 Ca 0.17 0.61 -0.27 0.00 -1.81 0.00 0.00 61.98 60.68 2ke0 s VAL 60 Cb -0.04 -3.64 -0.04 0.00 0.56 0.00 0.00 36.38 33.22 2ke0 s VAL 60 CO 0.09 0.45 2.07 -0.22 -0.31 0.00 0.00 175.10 177.17 2ke0 s LEU 61 N 0.00 3.42 0.00 1.32 2.96 -0.45 -3.39 118.68 122.55 2ke0 s LEU 61 Ca 0.19 1.19 0.00 0.00 -0.22 0.00 0.00 54.13 55.29 2ke0 s LEU 61 Cb -0.14 -3.06 0.00 0.00 0.50 0.00 0.00 46.19 43.49 2ke0 s LEU 61 CO 0.06 -2.21 0.00 0.61 -1.32 0.00 0.00 176.35 173.50 2ke0 n GLY 62 N 5.71 1.63 0.00 7.98 0.00 -1.26 -0.01 105.19 119.24 2ke0 n GLY 62 Ca 0.28 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 46.21 2ke0 n GLY 62 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ke0 n GLY 63 N 0.00 3.80 0.00 -0.02 0.00 -1.22 -5.05 105.19 102.71 2ke0 n GLY 63 Ca 0.00 -0.40 0.00 0.00 0.00 0.00 0.00 46.02 45.62 2ke0 n GLY 63 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ke0 n GLY 64 N -1.03 -1.63 2.75 -0.02 0.00 -1.26 -4.84 105.19 99.16 2ke0 n GLY 64 Ca 0.00 0.58 -0.03 0.00 0.00 0.00 0.00 46.02 46.57 2ke0 n GLY 64 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2ke0 n MET 65 N 0.00 1.47 -2.69 1.61 2.81 -1.26 -5.12 117.12 113.94 2ke0 n MET 65 Ca 0.00 -2.72 -0.07 0.00 -1.81 0.00 0.00 57.70 53.10 2ke0 n MET 65 Cb 0.00 -0.88 -0.02 0.00 -0.71 0.00 0.00 33.22 31.61 2ke0 n MET 65 CO 0.00 0.00 0.00 1.33 1.51 0.00 0.00 175.97 178.81 2ke0 n VAL 66 N -0.73 0.00 -4.40 2.03 0.24 -1.26 -5.18 118.33 109.04 2ke0 n VAL 66 Ca 0.00 -0.72 -0.25 0.00 -2.04 0.00 0.00 64.34 61.33 2ke0 n VAL 66 Cb 0.83 0.31 -0.09 0.00 -1.47 0.00 0.00 33.84 33.41 2ke0 n VAL 66 CO 0.00 0.00 0.00 0.27 -2.14 0.00 0.00 176.83 174.96 2ke0 s ILE 67 N -2.19 2.48 0.20 1.34 -0.00 -1.26 -5.00 121.20 116.78 2ke0 s ILE 67 Ca 0.09 -2.02 -0.17 0.00 -0.00 0.00 0.00 60.65 58.55 2ke0 s ILE 67 Cb 0.00 -2.78 0.20 0.00 -0.00 0.00 0.00 42.46 39.89 2ke0 s ILE 67 CO 0.06 -0.18 1.60 0.11 -0.00 0.00 0.00 174.94 176.53 2ke0 h LYS 68 N 1.85 -0.08 -0.82 0.37 1.79 -1.99 0.11 116.57 117.80 2ke0 h LYS 68 Ca -0.43 0.01 0.16 0.00 -2.18 0.00 0.00 60.65 58.21 2ke0 h LYS 68 Cb 1.25 0.02 -0.10 0.00 -1.58 0.00 0.00 32.23 31.82 2ke0 h LYS 68 CO 0.69 -0.05 0.37 0.78 -1.08 0.00 0.00 179.45 180.16 2ke0 h GLY 69 N -0.08 1.31 0.81 3.86 0.00 -1.98 0.22 103.07 107.21 2ke0 h GLY 69 Ca 0.28 -0.19 -0.01 0.00 0.00 0.00 0.00 47.33 47.41 2ke0 h GLY 69 CO -0.69 -0.10 -0.12 1.49 0.00 0.00 0.00 176.54 177.12 2ke0 h TRP 70 N 0.51 -0.31 -0.56 5.60 4.06 -1.22 -1.75 115.95 122.28 2ke0 h TRP 70 Ca 0.46 -0.01 0.04 0.00 2.06 0.00 0.00 58.89 61.45 2ke0 h TRP 70 Cb 0.71 0.10 -0.04 0.00 -1.00 0.00 0.00 29.16 28.93 2ke0 h TRP 70 CO -0.13 -0.06 0.31 0.22 -3.56 0.00 0.00 178.44 175.22 2ke0 h ASP 71 N -0.52 0.47 -0.85 -3.49 3.58 -0.60 0.15 116.42 115.15 2ke0 h ASP 71 Ca -0.03 0.02 0.05 0.00 0.42 0.00 0.00 57.03 57.48 2ke0 h ASP 71 Cb 0.39 -0.07 -0.06 0.00 1.72 0.00 0.00 39.33 41.31 2ke0 h ASP 71 CO 0.06 0.32 0.54 -0.08 -2.88 0.00 0.00 179.24 177.19 2ke0 h GLU 72 N 0.60 0.98 -0.06 0.28 4.22 -0.52 -0.65 114.58 119.43 2ke0 h GLU 72 Ca 0.24 -0.06 -0.19 0.00 0.08 0.00 0.00 59.36 59.43 2ke0 h GLU 72 Cb 0.11 -0.22 -0.00 0.00 0.50 0.00 0.00 28.75 29.14 2ke0 h GLU 72 CO -0.15 0.65 -0.77 0.78 -2.18 0.00 0.00 179.01 177.34 2ke0 h GLY 73 N 1.01 0.43 1.84 1.92 0.00 -0.62 -3.18 103.07 104.48 2ke0 h GLY 73 Ca 0.35 -0.64 -0.09 0.00 0.00 0.00 0.00 47.33 46.95 2ke0 h GLY 73 CO -0.14 0.57 -0.36 -2.08 0.00 0.00 0.00 176.54 174.53 2ke0 h VAL 74 N 0.26 1.28 -0.28 4.60 2.07 -0.19 -0.76 116.25 123.22 2ke0 h VAL 74 Ca -0.04 -1.35 -0.26 0.00 0.82 0.00 0.00 66.70 65.87 2ke0 h VAL 74 Cb 1.36 1.61 -0.09 0.00 -1.52 0.00 0.00 31.29 32.65 2ke0 h VAL 74 CO 0.13 0.40 -0.14 0.00 0.02 0.00 0.00 177.57 177.98 2ke0 n GLN 75 N -4.08 2.03 0.00 1.57 10.64 -0.30 -3.67 117.38 123.57 2ke0 n GLN 75 Ca -0.01 -1.29 0.00 0.00 -1.83 0.00 0.00 57.00 53.86 2ke0 n GLN 75 Cb 0.43 -1.96 0.00 0.00 -0.86 0.00 0.00 30.24 27.85 2ke0 n GLN 75 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2ke0 n GLY 76 N 1.96 0.16 3.75 2.61 0.00 -1.20 -5.01 105.19 107.45 2ke0 n GLY 76 Ca 0.41 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 46.08 2ke0 n GLY 76 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2ke0 s MET 77 N 0.00 2.76 0.31 1.61 -1.94 -0.29 -4.75 119.30 117.00 2ke0 s MET 77 Ca 0.00 1.70 0.09 0.00 -1.71 0.00 0.00 55.69 55.78 2ke0 s MET 77 Cb 0.00 -1.92 -0.05 0.00 2.01 0.00 0.00 34.83 34.88 2ke0 s MET 77 CO 0.00 -1.34 0.01 0.15 -0.01 0.00 0.00 175.02 173.83 2ke0 s LYS 78 N -3.63 2.16 -0.06 2.03 3.01 -1.26 -1.49 119.74 120.50 2ke0 s LYS 78 Ca 0.74 -1.61 -0.33 0.00 -1.01 0.00 0.00 55.97 53.75 2ke0 s LYS 78 Cb -0.27 -2.03 -0.11 0.00 -1.01 0.00 0.00 37.83 34.40 2ke0 s LYS 78 CO 0.37 0.22 1.89 0.28 0.51 0.00 0.00 175.35 178.63 2ke0 n VAL 79 N -0.94 0.60 -0.39 3.17 0.31 0.35 -0.37 118.33 121.06 2ke0 n VAL 79 Ca -0.05 -0.11 0.00 0.00 -0.01 0.00 0.00 64.34 64.17 2ke0 n VAL 79 Cb 0.61 -1.95 0.00 0.00 -0.91 0.00 0.00 33.84 31.58 2ke0 n VAL 79 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2ke0 n GLY 80 N 4.42 0.70 3.86 2.92 0.00 0.64 -3.19 105.19 114.54 2ke0 n GLY 80 Ca 0.22 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.93 2ke0 n GLY 80 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2ke0 s GLY 81 N -1.40 2.10 -0.01 -0.02 0.00 0.50 -4.64 107.32 103.85 2ke0 s GLY 81 Ca 0.00 -0.04 0.05 0.00 0.00 0.00 0.00 44.72 44.73 2ke0 s GLY 81 CO 0.00 0.17 -0.15 0.14 0.00 0.00 0.00 173.10 173.26 2ke0 s VAL 82 N -2.29 1.19 -0.14 1.40 1.01 -0.32 -1.12 120.40 120.15 2ke0 s VAL 82 Ca 0.54 -0.65 -0.08 0.00 0.00 0.00 0.00 61.98 61.79 2ke0 s VAL 82 Cb -0.10 -1.00 0.05 0.00 0.00 0.00 0.00 36.38 35.33 2ke0 s VAL 82 CO 0.26 0.34 0.33 -0.60 0.00 0.00 0.00 175.10 175.43 2ke0 s ARG 83 N -0.35 0.32 -0.15 2.72 3.52 -0.42 -0.34 118.95 124.25 2ke0 s ARG 83 Ca 0.06 0.64 -0.21 0.00 -0.13 0.00 0.00 55.73 56.09 2ke0 s ARG 83 Cb -0.06 -0.03 -0.03 0.00 -1.56 0.00 0.00 34.95 33.26 2ke0 s ARG 83 CO -0.01 -0.14 0.60 1.03 -0.81 0.00 0.00 175.30 175.97 2ke0 s ARG 84 N 1.17 4.29 -0.20 5.12 0.52 -0.30 -1.37 118.95 128.18 2ke0 s ARG 84 Ca -0.08 0.62 -0.01 0.00 -0.52 0.00 0.00 55.73 55.74 2ke0 s ARG 84 Cb -0.08 -3.52 0.01 0.00 0.52 0.00 0.00 34.95 31.88 2ke0 s ARG 84 CO -0.09 -0.07 -0.14 -0.51 0.02 0.00 0.00 175.30 174.51 2ke0 s LEU 85 N 1.35 2.49 -0.23 2.53 1.43 0.66 -0.06 118.68 126.85 2ke0 s LEU 85 Ca 0.30 -0.61 -0.08 0.00 -1.03 0.00 0.00 54.13 52.71 2ke0 s LEU 85 Cb -0.16 -1.58 -0.03 0.00 0.03 0.00 0.00 46.19 44.45 2ke0 s LEU 85 CO 0.12 -0.02 0.08 -0.89 0.23 0.00 0.00 176.35 175.86 2ke0 s THR 86 N 1.35 4.54 -0.08 5.49 2.01 0.15 -0.05 115.64 129.06 2ke0 s THR 86 Ca 0.04 -0.10 0.05 0.00 0.31 0.00 0.00 61.69 61.99 2ke0 s THR 86 Cb -0.14 -3.10 -0.00 0.00 0.01 0.00 0.00 72.50 69.27 2ke0 s THR 86 CO -0.09 0.37 -0.23 -0.63 -0.69 0.00 0.00 174.62 173.35 2ke0 s ILE 87 N 1.23 1.95 0.98 1.82 1.01 -0.34 -1.56 121.20 126.29 2ke0 s ILE 87 Ca 0.05 -0.98 -0.12 0.00 0.00 0.00 0.00 60.65 59.60 2ke0 s ILE 87 Cb -0.14 -1.67 0.18 0.00 0.01 0.00 0.00 42.46 40.84 2ke0 s ILE 87 CO 0.04 0.54 1.09 -2.16 0.00 0.00 0.00 174.94 174.45 2ke0 s PRO 88 N 0.14 0.54 0.54 2.79 0.04 -1.26 -2.01 135.00 135.78 2ke0 s PRO 88 Ca -0.12 0.56 0.33 0.00 0.04 0.00 0.00 61.00 61.81 2ke0 s PRO 88 Cb -0.16 -1.75 1.35 0.00 0.04 0.00 0.00 34.50 33.99 2ke0 s PRO 88 CO 0.06 -2.66 1.98 -1.00 0.04 0.00 0.00 177.00 175.42 2ke0 h PRO 89 N -1.85 0.00 0.00 0.56 0.13 -1.90 0.21 132.00 129.15 2ke0 h PRO 89 Ca -0.54 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.48 2ke0 h PRO 89 Cb 1.32 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.43 2ke0 h PRO 89 CO 0.57 0.04 -0.91 0.37 -0.23 0.00 0.00 178.00 177.83 2ke0 h GLN 90 N 0.00 0.00 -0.16 0.86 5.75 -1.92 -0.76 115.11 118.88 2ke0 h GLN 90 Ca -0.00 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 2ke0 h GLN 90 Cb 0.52 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.07 2ke0 h GLN 90 CO 0.00 0.33 0.00 -0.11 -2.65 0.00 0.00 178.83 176.40 2ke0 n LEU 91 N -3.02 2.38 0.00 -2.39 0.00 -1.04 -4.80 117.00 108.14 2ke0 n LEU 91 Ca -0.03 -1.45 0.00 0.00 0.00 0.00 0.00 56.01 54.53 2ke0 n LEU 91 Cb 0.75 -0.10 0.00 0.00 0.00 0.00 0.00 43.42 44.06 2ke0 n LEU 91 CO 0.41 0.53 0.00 0.61 0.00 0.00 0.00 177.39 178.94 2ke0 n GLY 92 N 0.57 1.66 0.28 -3.96 0.00 0.69 -4.82 105.19 99.61 2ke0 n GLY 92 Ca 0.09 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.16 2ke0 n GLY 92 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 2ke0 h TYR 93 N 0.00 0.58 0.00 1.61 -1.99 -1.78 -3.48 116.97 111.90 2ke0 h TYR 93 Ca 0.00 0.03 0.00 0.00 2.00 0.00 0.00 58.73 60.76 2ke0 h TYR 93 Cb 0.00 -0.14 0.00 0.00 2.00 0.00 0.00 36.73 38.59 2ke0 h TYR 93 CO 0.00 0.11 0.00 0.41 -0.00 0.00 0.00 178.16 178.68 2ke0 n GLY 94 N -1.32 -0.01 0.15 3.88 0.00 -0.29 -4.44 105.19 103.15 2ke0 n GLY 94 Ca 0.14 -2.25 0.15 0.00 0.00 0.00 0.00 46.02 44.07 2ke0 n GLY 94 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ke0 n ALA 95 N -0.81 2.65 -0.12 4.61 0.00 -1.26 -3.75 120.51 121.83 2ke0 n ALA 95 Ca 0.00 -0.27 -0.24 0.00 0.00 0.00 0.00 53.44 52.93 2ke0 n ALA 95 Cb 0.00 -1.39 -0.11 0.00 0.00 0.00 0.00 19.45 17.95 2ke0 n ALA 95 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2ke0 n ARG 96 N -0.62 0.62 -0.38 0.00 1.74 -1.26 -4.72 116.66 112.04 2ke0 n ARG 96 Ca 0.22 0.24 0.05 0.00 -0.77 0.00 0.00 57.85 57.59 2ke0 n ARG 96 Cb 0.18 -1.54 -0.01 0.00 -1.02 0.00 0.00 32.46 30.07 2ke0 n ARG 96 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2ke0 n GLY 97 N 1.73 -1.74 0.02 -0.13 0.00 -1.25 -4.26 105.19 99.55 2ke0 n GLY 97 Ca -0.48 -1.25 -0.01 0.00 0.00 0.00 0.00 46.02 44.28 2ke0 n GLY 97 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ke0 h ALA 98 N -0.64 0.00 0.00 4.61 0.00 -0.95 -3.47 119.26 118.81 2ke0 h ALA 98 Ca 0.01 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.63 2ke0 h ALA 98 Cb 0.35 0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.25 2ke0 h ALA 98 CO 0.00 0.11 0.00 0.41 0.00 0.00 0.00 179.25 179.77 2ke0 n GLY 99 N 1.74 0.84 5.00 0.00 0.00 -1.25 -4.97 105.19 106.54 2ke0 n GLY 99 Ca -0.02 0.33 0.00 0.00 0.00 0.00 0.00 46.02 46.34 2ke0 n GLY 99 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ke0 n GLY 100 N 0.00 1.35 0.18 -0.02 0.00 -1.26 -4.45 105.19 101.00 2ke0 n GLY 100 Ca 0.00 -0.03 -0.14 0.00 0.00 0.00 0.00 46.02 45.86 2ke0 n GLY 100 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2ke0 h VAL 101 N 0.00 0.77 -2.34 1.61 2.07 -2.02 -3.38 116.25 112.96 2ke0 h VAL 101 Ca 0.00 -0.44 -0.59 0.00 0.82 0.00 0.00 66.70 66.49 2ke0 h VAL 101 Cb 0.00 1.02 -0.40 0.00 -1.52 0.00 0.00 31.29 30.39 2ke0 h VAL 101 CO 0.00 0.09 -0.88 -0.38 0.02 0.00 0.00 177.57 176.43 2ke0 n ILE 102 N -5.15 0.15 -1.18 4.57 5.41 -1.26 -5.04 119.36 116.86 2ke0 n ILE 102 Ca -0.10 -4.22 -0.29 0.00 1.00 0.00 0.00 62.75 59.14 2ke0 n ILE 102 Cb 0.23 -1.93 0.16 0.00 -0.71 0.00 0.00 39.64 37.39 2ke0 n ILE 102 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 2ke0 s PRO 103 N -1.11 0.77 0.84 0.38 0.04 -1.26 -0.29 135.00 134.37 2ke0 s PRO 103 Ca 0.34 0.65 -0.11 0.00 0.04 0.00 0.00 61.00 61.92 2ke0 s PRO 103 Cb 0.09 -1.77 0.10 0.00 0.04 0.00 0.00 34.50 32.96 2ke0 s PRO 103 CO -0.13 -2.53 1.09 -1.25 0.04 0.00 0.00 177.00 174.22 2ke0 s PRO 104 N -4.95 1.67 -1.59 0.56 0.04 -1.26 -3.48 135.00 126.00 2ke0 s PRO 104 Ca 0.65 0.97 0.00 0.00 0.04 0.00 0.00 61.00 62.65 2ke0 s PRO 104 Cb -0.18 -1.84 0.00 0.00 0.04 0.00 0.00 34.50 32.51 2ke0 s PRO 104 CO 0.57 -2.00 0.00 0.09 0.04 0.00 0.00 177.00 175.71 2ke0 n ASN 105 N -3.74 -5.15 -4.00 6.66 3.02 -1.26 -4.96 115.26 105.84 2ke0 n ASN 105 Ca 0.08 0.37 -0.31 0.00 -0.03 0.00 0.00 54.58 54.69 2ke0 n ASN 105 Cb 0.54 -3.97 -0.16 0.00 -0.61 0.00 0.00 39.78 35.58 2ke0 n ASN 105 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2ke0 s ALA 106 N -2.44 2.14 0.38 5.41 0.00 -1.23 -4.88 121.76 121.15 2ke0 s ALA 106 Ca 0.00 -1.41 -0.26 0.00 0.00 0.00 0.00 51.96 50.29 2ke0 s ALA 106 Cb 0.00 -1.42 -0.09 0.00 0.00 0.00 0.00 23.12 21.62 2ke0 s ALA 106 CO 0.00 -1.04 1.20 0.99 0.00 0.00 0.00 175.76 176.91 2ke0 s THR 107 N 1.31 3.04 0.27 0.00 2.01 -1.26 -4.27 115.64 116.74 2ke0 s THR 107 Ca -0.05 0.92 0.05 0.00 0.31 0.00 0.00 61.69 62.91 2ke0 s THR 107 Cb -0.18 -3.53 -0.06 0.00 0.01 0.00 0.00 72.50 68.74 2ke0 s THR 107 CO -0.07 0.12 -0.01 -1.48 -0.69 0.00 0.00 174.62 172.50 2ke0 s LEU 108 N -2.31 2.28 0.06 4.42 -0.00 -0.85 -4.02 118.68 118.26 2ke0 s LEU 108 Ca 0.55 -1.25 0.06 0.00 -0.00 0.00 0.00 54.13 53.49 2ke0 s LEU 108 Cb -0.33 -0.41 -0.03 0.00 -0.00 0.00 0.00 46.19 45.42 2ke0 s LEU 108 CO 0.42 -0.48 -0.16 -0.69 -0.00 0.00 0.00 176.35 175.44 2ke0 s VAL 109 N -3.27 1.29 -0.04 1.48 1.01 -0.52 -1.20 120.40 119.15 2ke0 s VAL 109 Ca 0.31 -1.24 0.02 0.00 0.00 0.00 0.00 61.98 61.07 2ke0 s VAL 109 Cb 0.06 -1.19 0.01 0.00 0.00 0.00 0.00 36.38 35.26 2ke0 s VAL 109 CO 0.11 -0.07 -0.08 -0.36 0.00 0.00 0.00 175.10 174.70 2ke0 s PHE 110 N -1.05 1.03 -0.45 5.22 0.08 0.93 -0.10 117.98 123.64 2ke0 s PHE 110 Ca 0.02 -0.32 -0.17 0.00 0.12 0.00 0.00 56.93 56.58 2ke0 s PHE 110 Cb -0.09 -0.79 0.04 0.00 -0.57 0.00 0.00 43.02 41.61 2ke0 s PHE 110 CO 0.02 -0.19 0.45 -2.00 -0.10 0.00 0.00 175.22 173.41 2ke0 s GLU 111 N 0.61 3.06 -0.24 0.44 2.12 0.16 -0.24 118.70 124.60 2ke0 s GLU 111 Ca -0.10 -0.97 -0.17 0.00 0.36 0.00 0.00 54.97 54.09 2ke0 s GLU 111 Cb -0.13 -4.04 -0.03 0.00 0.26 0.00 0.00 34.13 30.19 2ke0 s GLU 111 CO 0.01 -0.97 0.46 0.08 -0.54 0.00 0.00 175.26 174.30 2ke0 s VAL 112 N 2.07 5.13 -0.17 3.70 1.01 -0.47 -0.86 120.40 130.81 2ke0 s VAL 112 Ca 0.10 0.78 0.00 0.00 0.00 0.00 0.00 61.98 62.87 2ke0 s VAL 112 Cb -0.20 -3.78 0.03 0.00 0.00 0.00 0.00 36.38 32.44 2ke0 s VAL 112 CO 0.11 0.16 -0.11 -1.83 0.00 0.00 0.00 175.10 173.43 2ke0 s GLU 113 N 1.91 2.01 0.01 2.72 -1.05 -0.22 -1.30 118.70 122.77 2ke0 s GLU 113 Ca 0.20 -0.65 -0.30 0.00 -0.15 0.00 0.00 54.97 54.06 2ke0 s GLU 113 Cb -0.15 -2.19 -0.06 0.00 -0.44 0.00 0.00 34.13 31.29 2ke0 s GLU 113 CO 0.09 -0.35 1.52 -0.51 0.95 0.00 0.00 175.26 176.96 2ke0 s LEU 114 N 1.48 4.33 -0.20 1.83 2.01 -0.27 -1.51 118.68 126.35 2ke0 s LEU 114 Ca 0.02 2.23 -0.02 0.00 0.01 0.00 0.00 54.13 56.37 2ke0 s LEU 114 Cb -0.15 -3.56 -0.21 0.00 0.01 0.00 0.00 46.19 42.29 2ke0 s LEU 114 CO -0.09 -0.81 0.03 0.18 1.01 0.00 0.00 176.35 176.67 2ke0 n LEU 115 N 5.78 2.83 -3.65 1.79 4.77 -0.44 -0.26 117.00 127.81 2ke0 n LEU 115 Ca 0.15 0.01 -0.02 0.00 -0.03 0.00 0.00 56.01 56.12 2ke0 n LEU 115 Cb 0.43 -1.00 -0.03 0.00 -2.33 0.00 0.00 43.42 40.49 2ke0 n LEU 115 CO 0.60 0.90 1.19 -0.62 -1.33 0.00 0.00 177.39 178.14 2ke0 s ASP 116 N -6.75 -0.01 0.00 -1.43 2.15 -1.18 -4.65 116.67 104.81 2ke0 s ASP 116 Ca -0.30 0.00 0.12 0.00 0.43 0.00 0.00 52.55 52.81 2ke0 s ASP 116 Cb 0.08 0.01 0.10 0.00 -0.30 0.00 0.00 42.92 42.80 2ke0 s ASP 116 CO 0.67 -0.01 0.89 1.33 -0.17 0.00 0.00 175.17 177.88