#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 2.54 -0.10 1.61 0.04 -1.26 -4.39 135.00 133.45 2ke0 s PRO 2 Ca 0.00 -0.33 0.04 0.00 0.04 0.00 0.00 61.00 60.75 2ke0 s PRO 2 Cb 0.00 -5.07 0.12 0.00 0.04 0.00 0.00 34.50 29.59 2ke0 s PRO 2 CO 0.00 -3.42 0.78 0.41 0.04 0.00 0.00 177.00 174.81 2ke0 n GLY 3 N 6.80 0.04 3.04 0.56 0.00 -1.26 -5.05 105.19 109.33 2ke0 n GLY 3 Ca 0.40 -0.05 -0.43 0.00 0.00 0.00 0.00 46.02 45.94 2ke0 n GLY 3 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2ke0 n SER 4 N -0.45 6.12 -3.65 1.61 2.88 -1.26 -4.87 113.62 114.00 2ke0 n SER 4 Ca -0.07 -3.32 -0.41 0.00 -1.33 0.00 0.00 58.87 53.74 2ke0 n SER 4 Cb 0.59 -1.32 0.02 0.00 -0.75 0.00 0.00 64.21 62.75 2ke0 n SER 4 CO 0.00 0.00 0.00 0.23 -1.23 0.00 0.00 175.04 174.04 2ke0 n MET 5 N 1.92 5.35 -1.61 -1.46 2.81 -1.26 -5.01 117.12 117.86 2ke0 n MET 5 Ca 0.28 -4.58 -0.50 0.00 -1.81 0.00 0.00 57.70 51.09 2ke0 n MET 5 Cb 0.35 -2.48 -0.06 0.00 -0.71 0.00 0.00 33.22 30.31 2ke0 n MET 5 CO 0.00 0.00 0.00 2.41 1.51 0.00 0.00 175.97 179.89 2ke0 n THR 6 N 0.14 0.40 -2.53 2.03 -1.04 -1.26 -4.91 114.28 107.11 2ke0 n THR 6 Ca 0.47 -0.18 -0.41 0.00 -2.04 0.00 0.00 64.05 61.89 2ke0 n THR 6 Cb 0.26 -1.78 -0.04 0.00 -1.82 0.00 0.00 70.33 66.96 2ke0 n THR 6 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 2ke0 s VAL 7 N 5.42 3.85 -0.49 12.58 1.01 -1.26 -4.87 120.40 136.64 2ke0 s VAL 7 Ca 1.00 1.64 -0.15 0.00 0.00 0.00 0.00 61.98 64.46 2ke0 s VAL 7 Cb -0.77 -4.05 0.09 0.00 0.00 0.00 0.00 36.38 31.66 2ke0 s VAL 7 CO 0.52 0.30 0.43 -0.69 0.00 0.00 0.00 175.10 175.65 2ke0 s VAL 8 N -0.40 5.18 -0.08 2.92 1.01 0.28 -4.96 120.40 124.35 2ke0 s VAL 8 Ca 0.48 -1.23 -0.15 0.00 0.00 0.00 0.00 61.98 61.08 2ke0 s VAL 8 Cb -0.29 -4.18 -0.05 0.00 0.00 0.00 0.00 36.38 31.86 2ke0 s VAL 8 CO 0.35 -0.68 0.39 0.42 0.00 0.00 0.00 175.10 175.59 2ke0 s THR 9 N 1.62 5.17 0.39 3.92 -4.23 -1.26 -1.39 115.64 119.85 2ke0 s THR 9 Ca 0.04 0.78 0.04 0.00 -1.18 0.00 0.00 61.69 61.37 2ke0 s THR 9 Cb -0.26 -3.72 -0.00 0.00 1.34 0.00 0.00 72.50 69.86 2ke0 s THR 9 CO 0.05 0.45 0.56 0.42 -0.54 0.00 0.00 174.62 175.57 2ke0 s THR 10 N -0.13 3.84 0.39 3.99 -4.23 -0.77 -4.99 115.64 113.74 2ke0 s THR 10 Ca 0.22 -0.82 0.28 0.00 -1.18 0.00 0.00 61.69 60.19 2ke0 s THR 10 Cb -0.15 -3.36 0.30 0.00 1.34 0.00 0.00 72.50 70.63 2ke0 s THR 10 CO 0.10 -0.18 2.07 -0.33 -0.54 0.00 0.00 174.62 175.73 2ke0 h GLU 11 N 0.66 0.00 -0.42 3.99 4.39 -1.99 -2.73 114.58 118.48 2ke0 h GLU 11 Ca -0.45 0.00 -0.05 0.00 0.34 0.00 0.00 59.36 59.20 2ke0 h GLU 11 Cb 1.26 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.89 2ke0 h GLU 11 CO 0.53 0.11 0.08 0.77 -1.16 0.00 0.00 179.01 179.35 2ke0 h SER 12 N 0.00 0.66 0.00 1.42 0.02 -2.04 -3.47 113.55 110.14 2ke0 h SER 12 Ca -0.00 -0.25 0.00 0.00 -0.84 0.00 0.00 61.79 60.70 2ke0 h SER 12 Cb 0.35 -0.17 0.00 0.00 0.14 0.00 0.00 62.40 62.72 2ke0 h SER 12 CO 0.01 0.74 0.00 0.61 -1.14 0.00 0.00 176.83 177.05 2ke0 n GLY 13 N -0.54 1.45 3.77 -3.77 0.00 -1.03 -5.10 105.19 99.98 2ke0 n GLY 13 Ca -0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.71 2ke0 n GLY 13 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2ke0 s LEU 14 N 0.00 2.78 0.01 0.99 0.05 -1.26 -4.78 118.68 116.47 2ke0 s LEU 14 Ca 0.00 1.60 0.02 0.00 0.05 0.00 0.00 54.13 55.79 2ke0 s LEU 14 Cb 0.00 -4.25 -0.01 0.00 -2.05 0.00 0.00 46.19 39.88 2ke0 s LEU 14 CO 0.00 -2.05 -0.05 -0.54 -0.55 0.00 0.00 176.35 173.16 2ke0 s LYS 15 N -4.99 0.41 0.18 1.48 1.02 -0.49 -1.86 119.74 115.49 2ke0 s LYS 15 Ca 0.61 -0.31 -0.10 0.00 0.02 0.00 0.00 55.97 56.19 2ke0 s LYS 15 Cb -0.16 -0.33 -0.01 0.00 -0.52 0.00 0.00 37.83 36.81 2ke0 s LYS 15 CO 0.56 0.08 0.32 1.52 -0.92 0.00 0.00 175.35 176.91 2ke0 s TYR 16 N -0.43 0.40 -0.11 3.18 -0.85 -0.49 0.09 117.35 119.14 2ke0 s TYR 16 Ca -0.01 -0.75 -0.10 0.00 -0.52 0.00 0.00 57.07 55.68 2ke0 s TYR 16 Cb -0.04 -0.02 0.03 0.00 0.38 0.00 0.00 41.96 42.31 2ke0 s TYR 16 CO -0.00 -0.76 0.29 -2.00 -1.52 0.00 0.00 175.55 171.56 2ke0 s GLU 17 N -3.98 0.34 0.50 -3.49 -6.30 -0.30 -0.55 118.70 104.92 2ke0 s GLU 17 Ca 0.18 0.41 -0.23 0.00 -2.50 0.00 0.00 54.97 52.83 2ke0 s GLU 17 Cb 0.03 0.16 -0.06 0.00 0.00 0.00 0.00 34.13 34.26 2ke0 s GLU 17 CO 0.02 -0.04 1.38 -0.51 0.02 0.00 0.00 175.26 176.13 2ke0 s ASP 18 N 0.17 5.56 -0.00 -1.70 1.11 -1.26 -0.88 116.67 119.67 2ke0 s ASP 18 Ca -0.00 2.82 -0.04 0.00 0.18 0.00 0.00 52.55 55.51 2ke0 s ASP 18 Cb -0.02 -2.64 -0.01 0.00 1.07 0.00 0.00 42.92 41.31 2ke0 s ASP 18 CO 0.00 -1.38 -0.08 0.18 1.18 0.00 0.00 175.17 175.07 2ke0 n LEU 19 N -0.64 0.92 -3.89 1.23 4.77 -0.01 -4.71 117.00 114.67 2ke0 n LEU 19 Ca 0.08 0.14 -0.25 0.00 -0.03 0.00 0.00 56.01 55.94 2ke0 n LEU 19 Cb 0.44 -0.38 -0.17 0.00 -2.33 0.00 0.00 43.42 40.98 2ke0 n LEU 19 CO 0.55 -0.55 -0.43 -0.89 -1.33 0.00 0.00 177.39 174.74 2ke0 s THR 20 N -1.86 0.88 0.09 -5.08 2.01 -0.11 -4.94 115.64 106.63 2ke0 s THR 20 Ca -0.07 -0.22 -0.31 0.00 0.31 0.00 0.00 61.69 61.40 2ke0 s THR 20 Cb 0.01 -0.91 -0.11 0.00 0.01 0.00 0.00 72.50 71.50 2ke0 s THR 20 CO 0.10 0.34 1.85 1.21 -0.69 0.00 0.00 174.62 177.43 2ke0 n GLU 21 N 4.81 2.71 -0.77 4.92 2.13 -1.26 -0.42 120.64 132.76 2ke0 n GLU 21 Ca -0.13 0.99 -0.33 0.00 0.66 0.00 0.00 57.16 58.35 2ke0 n GLU 21 Cb 0.50 -2.88 0.13 0.00 0.27 0.00 0.00 31.44 29.46 2ke0 n GLU 21 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2ke0 n GLY 22 N 4.26 -2.02 0.73 8.31 0.00 -1.26 -4.73 105.19 110.48 2ke0 n GLY 22 Ca 0.19 -0.76 0.05 0.00 0.00 0.00 0.00 46.02 45.50 2ke0 n GLY 22 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2ke0 n SER 23 N -1.56 1.28 0.00 1.61 2.88 -1.04 -4.88 113.62 111.92 2ke0 n SER 23 Ca 0.06 -2.79 0.00 0.00 -1.33 0.00 0.00 58.87 54.81 2ke0 n SER 23 Cb 0.55 -0.37 0.00 0.00 -0.75 0.00 0.00 64.21 63.63 2ke0 n SER 23 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2ke0 n GLY 24 N -0.48 3.24 3.14 0.46 0.00 -1.09 -4.99 105.19 105.46 2ke0 n GLY 24 Ca 0.11 -0.41 -0.17 0.00 0.00 0.00 0.00 46.02 45.54 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 -2.00 1.03 0.43 4.61 0.00 -1.26 -4.83 121.76 119.73 2ke0 s ALA 25 Ca 0.00 -0.90 -0.23 0.00 0.00 0.00 0.00 51.96 50.83 2ke0 s ALA 25 Cb 0.00 -0.08 -0.09 0.00 0.00 0.00 0.00 23.12 22.95 2ke0 s ALA 25 CO 0.00 0.13 1.04 -2.00 0.00 0.00 0.00 175.76 174.94 2ke0 s GLU 26 N -1.57 4.06 0.35 0.00 2.12 -1.26 -1.17 118.70 121.23 2ke0 s GLU 26 Ca -0.03 1.45 -0.28 0.00 0.36 0.00 0.00 54.97 56.47 2ke0 s GLU 26 Cb -0.09 -2.40 -0.10 0.00 0.26 0.00 0.00 34.13 31.79 2ke0 s GLU 26 CO 0.02 -0.22 1.36 0.00 -0.54 0.00 0.00 175.26 175.87 2ke0 s ALA 27 N -1.77 3.51 -0.05 6.30 0.00 -0.57 -4.95 121.76 124.23 2ke0 s ALA 27 Ca 0.61 1.35 0.02 0.00 0.00 0.00 0.00 51.96 53.93 2ke0 s ALA 27 Cb -0.20 -3.51 -0.03 0.00 0.00 0.00 0.00 23.12 19.38 2ke0 s ALA 27 CO 0.25 -0.76 -0.09 1.03 0.00 0.00 0.00 175.76 176.19 2ke0 s ARG 28 N -1.89 2.64 0.24 0.00 0.52 -1.26 -4.59 118.95 114.62 2ke0 s ARG 28 Ca 0.50 -0.62 -0.31 0.00 -0.52 0.00 0.00 55.73 54.78 2ke0 s ARG 28 Cb -0.42 -2.52 -0.13 0.00 0.52 0.00 0.00 34.95 32.40 2ke0 s ARG 28 CO 0.56 0.64 1.51 0.00 0.02 0.00 0.00 175.30 178.03 2ke0 n ALA 29 N 2.10 1.64 0.00 2.13 0.00 -1.26 -1.42 120.51 123.70 2ke0 n ALA 29 Ca -0.17 0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.68 2ke0 n ALA 29 Cb 0.53 -2.35 0.00 0.00 0.00 0.00 0.00 19.45 17.62 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 2.53 3.07 3.75 0.00 0.00 -0.76 -4.94 105.19 108.84 2ke0 n GLY 30 Ca 0.12 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.75 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 -0.71 4.41 -1.06 1.61 0.74 -0.51 -4.76 119.66 119.38 2ke0 s GLN 31 Ca 0.00 0.89 -0.21 0.00 0.05 0.00 0.00 55.36 56.09 2ke0 s GLN 31 Cb 0.00 -3.36 0.07 0.00 1.10 0.00 0.00 33.01 30.82 2ke0 s GLN 31 CO 0.00 0.31 1.44 0.99 -0.55 0.00 0.00 175.29 177.48 2ke0 s THR 32 N -0.06 4.14 0.33 -0.34 2.01 -1.26 -1.27 115.64 119.19 2ke0 s THR 32 Ca 0.35 -1.17 -0.08 0.00 0.31 0.00 0.00 61.69 61.09 2ke0 s THR 32 Cb -0.19 -5.03 -0.06 0.00 0.01 0.00 0.00 72.50 67.23 2ke0 s THR 32 CO 0.20 -1.87 0.65 0.68 -0.69 0.00 0.00 174.62 173.59 2ke0 s VAL 33 N 4.32 4.89 -0.14 3.82 -7.23 -0.62 -4.77 120.40 120.68 2ke0 s VAL 33 Ca 0.45 0.40 0.01 0.00 -1.81 0.00 0.00 61.98 61.02 2ke0 s VAL 33 Cb -0.00 -3.71 -0.01 0.00 0.56 0.00 0.00 36.38 33.22 2ke0 s VAL 33 CO -0.07 -0.36 -0.15 -0.44 -0.31 0.00 0.00 175.10 173.77 2ke0 s SER 34 N -3.00 3.74 0.11 4.85 0.01 -0.39 -1.39 113.70 117.63 2ke0 s SER 34 Ca 0.48 -0.42 0.02 0.00 1.31 0.00 0.00 55.95 57.34 2ke0 s SER 34 Cb -0.11 -1.57 -0.04 0.00 0.21 0.00 0.00 66.02 64.52 2ke0 s SER 34 CO 0.29 0.13 -0.06 0.68 0.41 0.00 0.00 173.24 174.68 2ke0 s VAL 35 N 0.55 0.77 -0.11 3.43 -7.23 -0.50 -1.32 120.40 115.98 2ke0 s VAL 35 Ca -0.10 -1.96 -0.00 0.00 -1.81 0.00 0.00 61.98 58.11 2ke0 s VAL 35 Cb -0.16 -1.76 -0.02 0.00 0.56 0.00 0.00 36.38 35.00 2ke0 s VAL 35 CO 0.04 -0.81 -0.10 -1.00 -0.31 0.00 0.00 175.10 172.92 2ke0 s HIS 36 N -3.58 2.86 -0.15 2.82 3.76 -0.14 -0.25 115.29 120.62 2ke0 s HIS 36 Ca 0.14 -0.37 -0.03 0.00 -0.15 0.00 0.00 55.06 54.65 2ke0 s HIS 36 Cb 0.05 -1.81 -0.03 0.00 1.11 0.00 0.00 32.58 31.91 2ke0 s HIS 36 CO -0.03 -0.01 -0.05 1.52 -0.85 0.00 0.00 174.74 175.32 2ke0 s TYR 37 N -0.03 3.00 -0.34 1.40 1.13 -1.25 -1.11 117.35 120.14 2ke0 s TYR 37 Ca -0.02 -0.32 -0.00 0.00 -1.41 0.00 0.00 57.07 55.32 2ke0 s TYR 37 Cb -0.14 -1.93 0.08 0.00 -1.10 0.00 0.00 41.96 38.87 2ke0 s TYR 37 CO 0.03 -0.04 0.07 0.99 -2.51 0.00 0.00 175.55 174.10 2ke0 s THR 38 N 0.30 2.81 0.44 -3.49 2.01 -0.24 -1.35 115.64 116.12 2ke0 s THR 38 Ca -0.04 -1.89 -0.24 0.00 0.31 0.00 0.00 61.69 59.83 2ke0 s THR 38 Cb -0.14 -2.84 -0.08 0.00 0.01 0.00 0.00 72.50 69.45 2ke0 s THR 38 CO 0.03 -0.42 1.16 -0.83 -0.69 0.00 0.00 174.62 173.87 2ke0 s GLY 39 N 1.33 2.80 -0.14 4.40 0.00 0.90 -0.61 107.32 116.00 2ke0 s GLY 39 Ca 0.03 0.93 -0.11 0.00 0.00 0.00 0.00 44.72 45.58 2ke0 s GLY 39 CO -0.04 1.40 0.36 -0.98 0.00 0.00 0.00 173.10 173.84 2ke0 s TRP 40 N -1.52 -0.45 1.12 1.90 0.51 0.13 -3.85 118.94 116.78 2ke0 s TRP 40 Ca 0.61 1.04 -0.18 0.00 -2.12 0.00 0.00 56.10 55.46 2ke0 s TRP 40 Cb -0.29 0.16 0.25 0.00 -0.81 0.00 0.00 33.47 32.79 2ke0 s TRP 40 CO 0.35 -0.24 1.16 -0.51 -0.51 0.00 0.00 176.95 177.20 2ke0 s LEU 41 N 0.70 1.30 0.60 2.99 1.43 0.84 -1.44 118.68 125.11 2ke0 s LEU 41 Ca -0.04 0.60 0.32 0.00 -1.03 0.00 0.00 54.13 53.98 2ke0 s LEU 41 Cb -0.05 -2.47 1.90 0.00 0.03 0.00 0.00 46.19 45.60 2ke0 s LEU 41 CO -0.05 -3.64 2.26 0.71 0.23 0.00 0.00 176.35 175.87 2ke0 h THR 42 N -2.25 0.45 0.00 5.49 1.35 -1.90 -0.40 112.91 115.64 2ke0 h THR 42 Ca -0.46 0.00 -0.01 0.00 -0.55 0.00 0.00 66.41 65.39 2ke0 h THR 42 Cb 1.29 0.99 -0.00 0.00 -1.73 0.00 0.00 68.15 68.69 2ke0 h THR 42 CO 0.38 0.00 -1.34 -0.67 -0.25 0.00 0.00 175.52 173.65 2ke0 n ASP 43 N -3.73 0.58 0.00 5.36 2.03 -1.26 -4.96 116.55 114.57 2ke0 n ASP 43 Ca -0.03 0.23 0.00 0.00 0.52 0.00 0.00 54.79 55.51 2ke0 n ASP 43 Cb 0.10 0.92 0.00 0.00 -0.72 0.00 0.00 41.12 41.42 2ke0 n ASP 43 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2ke0 n GLY 44 N 1.22 1.16 3.71 0.27 0.00 -0.16 -5.09 105.19 106.30 2ke0 n GLY 44 Ca -0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 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 -0.31 4.39 -0.44 1.61 0.74 -1.26 -4.56 119.66 119.83 2ke0 s GLN 45 Ca 0.00 1.87 -0.29 0.00 0.05 0.00 0.00 55.36 56.99 2ke0 s GLN 45 Cb 0.00 -3.33 0.03 0.00 1.10 0.00 0.00 33.01 30.80 2ke0 s GLN 45 CO 0.00 -0.33 1.10 0.21 -0.55 0.00 0.00 175.29 175.72 2ke0 s LYS 46 N 1.17 3.78 -0.09 1.67 2.20 -1.26 -0.11 119.74 127.09 2ke0 s LYS 46 Ca 0.61 0.63 0.18 0.00 -0.36 0.00 0.00 55.97 57.03 2ke0 s LYS 46 Cb -0.32 -3.87 -0.27 0.00 -1.51 0.00 0.00 37.83 31.87 2ke0 s LYS 46 CO 0.29 -1.26 0.27 1.97 -0.36 0.00 0.00 175.35 176.26 2ke0 n PHE 47 N 7.56 0.00 -3.70 4.03 1.16 -1.25 -4.95 117.46 120.31 2ke0 n PHE 47 Ca 0.11 0.00 -0.12 0.00 -1.87 0.00 0.00 57.45 55.57 2ke0 n PHE 47 Cb 0.49 -0.64 -0.13 0.00 -1.61 0.00 0.00 39.48 37.59 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 -4.66 -0.07 -0.13 5.98 1.01 -1.26 -5.06 116.67 112.48 2ke0 s ASP 48 Ca -0.08 0.59 0.00 0.00 0.71 0.00 0.00 52.55 53.78 2ke0 s ASP 48 Cb 0.09 0.57 0.02 0.00 1.01 0.00 0.00 42.92 44.61 2ke0 s ASP 48 CO 0.78 -0.20 -0.13 -0.94 0.21 0.00 0.00 175.17 174.89 2ke0 s SER 49 N 1.72 2.52 0.17 0.27 1.04 -1.26 -0.07 113.70 118.08 2ke0 s SER 49 Ca -0.05 -0.43 -0.08 0.00 0.48 0.00 0.00 55.95 55.87 2ke0 s SER 49 Cb -0.11 -1.08 0.03 0.00 0.10 0.00 0.00 66.02 64.96 2ke0 s SER 49 CO -0.09 -0.06 1.50 -1.28 0.98 0.00 0.00 173.24 174.28 2ke0 h SER 50 N 8.00 0.86 1.27 7.02 0.87 -1.54 -2.82 113.55 127.21 2ke0 h SER 50 Ca -0.35 -0.41 0.00 0.00 -1.23 0.00 0.00 61.79 59.80 2ke0 h SER 50 Cb 1.14 -0.24 0.00 0.00 -0.44 0.00 0.00 62.40 62.86 2ke0 h SER 50 CO 0.49 1.17 0.00 0.07 -0.53 0.00 0.00 176.83 178.03 2ke0 h LYS 51 N 0.64 0.00 0.00 2.24 -0.00 -1.85 -2.18 116.57 115.42 2ke0 h LYS 51 Ca 0.04 0.00 -0.03 0.00 -0.00 0.00 0.00 60.65 60.66 2ke0 h LYS 51 Cb 1.01 0.00 -0.00 0.00 -0.00 0.00 0.00 32.23 33.23 2ke0 h LYS 51 CO 0.10 0.00 -0.16 0.22 -0.00 0.00 0.00 179.45 179.60 2ke0 h ASP 52 N 0.00 0.00 -0.08 7.07 3.58 -1.88 -2.74 116.42 122.37 2ke0 h ASP 52 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 2ke0 h ASP 52 Cb 0.64 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.69 2ke0 h ASP 52 CO 0.00 0.16 0.00 -2.11 -2.88 0.00 0.00 179.24 174.41 2ke0 n ARG 53 N -3.48 2.25 -2.68 0.28 1.85 -1.15 -4.97 116.66 108.75 2ke0 n ARG 53 Ca -0.01 -2.22 -0.14 0.00 -1.00 0.00 0.00 57.85 54.48 2ke0 n ARG 53 Cb 0.33 -1.37 -0.00 0.00 -1.05 0.00 0.00 32.46 30.37 2ke0 n ARG 53 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 2ke0 n ASN 54 N -0.79 -3.76 -4.04 2.89 4.13 -1.03 -4.89 115.26 107.76 2ke0 n ASN 54 Ca 0.11 0.06 -0.35 0.00 1.68 0.00 0.00 54.58 56.08 2ke0 n ASN 54 Cb 0.53 -3.18 -0.07 0.00 -1.54 0.00 0.00 39.78 35.52 2ke0 n ASN 54 CO 0.00 0.00 0.00 -0.67 0.28 0.00 0.00 177.26 176.87 2ke0 n ASP 55 N -1.93 4.13 -4.68 6.41 2.03 -0.83 -5.03 116.55 116.65 2ke0 n ASP 55 Ca -0.11 -3.17 -0.42 0.00 0.52 0.00 0.00 54.79 51.61 2ke0 n ASP 55 Cb 0.59 -1.00 -0.03 0.00 -0.72 0.00 0.00 41.12 39.96 2ke0 n ASP 55 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 2ke0 s PRO 56 N -1.52 4.25 -0.45 -0.67 0.04 -1.26 -4.72 135.00 130.67 2ke0 s PRO 56 Ca 0.28 2.02 -0.27 0.00 0.04 0.00 0.00 61.00 63.07 2ke0 s PRO 56 Cb -0.05 -3.65 -0.04 0.00 0.04 0.00 0.00 34.50 30.80 2ke0 s PRO 56 CO -0.12 -0.64 2.09 0.12 0.04 0.00 0.00 177.00 178.49 2ke0 s PHE 57 N 2.75 1.41 -0.21 0.56 2.19 0.66 -4.72 117.98 120.61 2ke0 s PHE 57 Ca 0.66 0.99 -0.07 0.00 0.33 0.00 0.00 56.93 58.84 2ke0 s PHE 57 Cb -0.32 -3.90 -0.03 0.00 -1.31 0.00 0.00 43.02 37.46 2ke0 s PHE 57 CO 0.27 -2.78 0.05 0.00 1.83 0.00 0.00 175.22 174.59 2ke0 s ALA 58 N 9.60 3.21 0.16 11.12 0.00 -1.26 -1.41 121.76 143.18 2ke0 s ALA 58 Ca 0.85 -0.96 -0.17 0.00 0.00 0.00 0.00 51.96 51.68 2ke0 s ALA 58 Cb -0.19 -1.94 0.03 0.00 0.00 0.00 0.00 23.12 21.02 2ke0 s ALA 58 CO 0.27 -0.17 0.47 -0.59 0.00 0.00 0.00 175.76 175.74 2ke0 s PHE 59 N 1.04 -0.15 -0.15 0.00 -0.71 -0.49 -4.97 117.98 112.55 2ke0 s PHE 59 Ca 0.03 -0.17 -0.29 0.00 -1.04 0.00 0.00 56.93 55.46 2ke0 s PHE 59 Cb -0.14 0.33 -0.01 0.00 -1.21 0.00 0.00 43.02 41.99 2ke0 s PHE 59 CO 0.03 -0.82 1.10 0.14 -1.34 0.00 0.00 175.22 174.33 2ke0 s VAL 60 N -3.84 4.56 -0.50 -2.49 -7.23 -1.26 -1.59 120.40 108.05 2ke0 s VAL 60 Ca 0.07 1.86 -0.32 0.00 -1.81 0.00 0.00 61.98 61.78 2ke0 s VAL 60 Cb 0.00 -4.20 -0.12 0.00 0.56 0.00 0.00 36.38 32.62 2ke0 s VAL 60 CO -0.07 -0.09 2.34 -0.11 -0.31 0.00 0.00 175.10 176.87 2ke0 n LEU 61 N 5.79 1.84 0.00 1.32 7.94 -0.40 -2.61 117.00 130.89 2ke0 n LEU 61 Ca 0.11 0.14 0.00 0.00 -1.11 0.00 0.00 56.01 55.15 2ke0 n LEU 61 Cb 0.47 -1.28 0.00 0.00 0.53 0.00 0.00 43.42 43.14 2ke0 n LEU 61 CO 0.53 -0.94 0.00 0.61 -1.11 0.00 0.00 177.39 176.49 2ke0 n GLY 62 N 6.40 2.76 0.00 -3.96 0.00 -1.26 -1.84 105.19 107.29 2ke0 n GLY 62 Ca 0.45 -0.34 0.00 0.00 0.00 0.00 0.00 46.02 46.13 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 3.24 0.18 -0.02 0.00 -1.07 -5.03 105.19 102.49 2ke0 n GLY 63 Ca 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 45.89 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 -0.69 0.02 2.19 -0.02 0.00 -1.26 -4.72 105.19 100.70 2ke0 n GLY 64 Ca 0.00 -0.04 -0.02 0.00 0.00 0.00 0.00 46.02 45.96 2ke0 n GLY 64 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 2ke0 n MET 65 N -1.20 0.04 -2.46 1.61 -0.00 -1.26 -5.13 117.12 108.72 2ke0 n MET 65 Ca 0.00 -0.33 -0.05 0.00 -0.00 0.00 0.00 57.70 57.32 2ke0 n MET 65 Cb 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 33.22 33.21 2ke0 n MET 65 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 175.97 177.30 2ke0 n VAL 66 N -0.32 0.00 -4.19 3.17 0.24 -1.26 -5.18 118.33 110.79 2ke0 n VAL 66 Ca -0.19 -0.46 -0.24 0.00 -2.04 0.00 0.00 64.34 61.41 2ke0 n VAL 66 Cb 0.57 0.18 -0.08 0.00 -1.47 0.00 0.00 33.84 33.05 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 -1.95 2.49 0.19 1.34 -0.00 -1.26 -4.99 121.20 117.02 2ke0 s ILE 67 Ca 0.05 -1.77 -0.20 0.00 -0.00 0.00 0.00 60.65 58.73 2ke0 s ILE 67 Cb 0.00 -2.95 0.13 0.00 -0.00 0.00 0.00 42.46 39.64 2ke0 s ILE 67 CO 0.04 -0.08 1.59 0.11 -0.00 0.00 0.00 174.94 176.60 2ke0 h LYS 68 N 1.55 -0.15 -0.84 0.37 1.57 -1.99 0.10 116.57 117.18 2ke0 h LYS 68 Ca -0.43 0.01 0.18 0.00 -1.87 0.00 0.00 60.65 58.54 2ke0 h LYS 68 Cb 1.25 0.03 -0.11 0.00 0.08 0.00 0.00 32.23 33.49 2ke0 h LYS 68 CO 0.69 -0.10 0.37 0.78 -0.57 0.00 0.00 179.45 180.62 2ke0 h GLY 69 N -0.15 1.37 0.97 3.86 0.00 -1.98 0.29 103.07 107.43 2ke0 h GLY 69 Ca 0.24 -0.18 -0.05 0.00 0.00 0.00 0.00 47.33 47.34 2ke0 h GLY 69 CO -0.67 -0.16 0.11 1.49 0.00 0.00 0.00 176.54 177.31 2ke0 h TRP 70 N 0.47 0.80 -0.30 5.60 4.06 -1.24 -1.56 115.95 123.78 2ke0 h TRP 70 Ca 0.49 -0.10 -0.04 0.00 2.06 0.00 0.00 58.89 61.30 2ke0 h TRP 70 Cb 0.82 -0.22 -0.01 0.00 -1.00 0.00 0.00 29.16 28.75 2ke0 h TRP 70 CO -0.14 0.72 0.02 -0.44 -3.56 0.00 0.00 178.44 175.05 2ke0 h ASP 71 N 0.64 0.50 0.13 -3.49 3.32 0.14 0.23 116.42 117.88 2ke0 h ASP 71 Ca 0.15 -0.29 -0.02 0.00 0.02 0.00 0.00 57.03 56.89 2ke0 h ASP 71 Cb 0.33 -0.13 -0.00 0.00 0.22 0.00 0.00 39.33 39.75 2ke0 h ASP 71 CO 0.00 0.66 -0.10 -0.08 -1.72 0.00 0.00 179.24 178.00 2ke0 h GLU 72 N 0.32 0.00 0.00 3.56 4.57 -0.42 -0.59 114.58 122.02 2ke0 h GLU 72 Ca 0.09 0.00 -0.12 0.00 -1.18 0.00 0.00 59.36 58.15 2ke0 h GLU 72 Cb 0.39 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 28.96 2ke0 h GLU 72 CO 0.01 0.10 -0.66 0.78 -1.18 0.00 0.00 179.01 178.07 2ke0 h GLY 73 N 0.36 0.00 2.00 1.92 0.00 -0.97 -3.35 103.07 103.04 2ke0 h GLY 73 Ca -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.32 2ke0 h GLY 73 CO 0.01 0.00 -0.02 -0.24 0.00 0.00 0.00 176.54 176.29 2ke0 h VAL 74 N -1.00 0.18 -0.35 4.60 3.04 -0.49 0.29 116.25 122.51 2ke0 h VAL 74 Ca -0.18 -0.18 -0.15 0.00 -1.01 0.00 0.00 66.70 65.18 2ke0 h VAL 74 Cb 1.11 1.15 -0.09 0.00 -2.01 0.00 0.00 31.29 31.45 2ke0 h VAL 74 CO -0.11 0.02 0.19 0.00 -1.01 0.00 0.00 177.57 176.66 2ke0 n GLN 75 N -3.29 1.77 0.00 4.17 10.64 -0.24 -4.16 117.38 126.27 2ke0 n GLN 75 Ca -0.02 -1.20 0.00 0.00 -1.83 0.00 0.00 57.00 53.95 2ke0 n GLN 75 Cb 0.14 -1.55 0.00 0.00 -0.86 0.00 0.00 30.24 27.97 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 -0.04 0.14 3.67 2.61 0.00 -0.67 -4.96 105.19 105.94 2ke0 n GLY 76 Ca 0.20 -0.08 -0.32 0.00 0.00 0.00 0.00 46.02 45.83 2ke0 n GLY 76 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2ke0 n MET 77 N -0.86 -0.30 -4.45 1.61 2.81 0.92 -4.62 117.12 112.23 2ke0 n MET 77 Ca 0.00 -0.02 -0.22 0.00 -1.81 0.00 0.00 57.70 55.65 2ke0 n MET 77 Cb 0.00 -2.38 -0.10 0.00 -0.71 0.00 0.00 33.22 30.03 2ke0 n MET 77 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 2ke0 s LYS 78 N -4.48 1.60 -0.04 0.03 3.01 -1.26 -1.52 119.74 117.08 2ke0 s LYS 78 Ca 0.68 -1.79 -0.36 0.00 -1.01 0.00 0.00 55.97 53.50 2ke0 s LYS 78 Cb -0.25 -1.35 -0.14 0.00 -1.01 0.00 0.00 37.83 35.09 2ke0 s LYS 78 CO 0.56 0.12 1.70 0.28 0.51 0.00 0.00 175.35 178.52 2ke0 n VAL 79 N -0.61 0.30 -0.69 3.17 0.31 -0.32 0.09 118.33 120.58 2ke0 n VAL 79 Ca -0.06 -0.05 0.00 0.00 -0.01 0.00 0.00 64.34 64.22 2ke0 n VAL 79 Cb 0.63 -1.50 0.00 0.00 -0.91 0.00 0.00 33.84 32.05 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 3.85 0.84 3.82 2.92 0.00 0.15 -2.49 105.19 114.28 2ke0 n GLY 80 Ca 0.21 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.88 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 -1.71 2.55 -0.03 -0.02 0.00 0.11 -4.57 107.32 103.65 2ke0 s GLY 81 Ca 0.00 0.22 0.07 0.00 0.00 0.00 0.00 44.72 45.01 2ke0 s GLY 81 CO 0.00 0.55 -0.24 0.14 0.00 0.00 0.00 173.10 173.55 2ke0 s VAL 82 N -1.73 2.23 -0.11 1.40 1.01 0.43 -1.37 120.40 122.27 2ke0 s VAL 82 Ca 0.49 -1.04 -0.05 0.00 0.00 0.00 0.00 61.98 61.39 2ke0 s VAL 82 Cb -0.15 -1.79 0.05 0.00 0.00 0.00 0.00 36.38 34.49 2ke0 s VAL 82 CO 0.20 0.58 0.23 -0.60 0.00 0.00 0.00 175.10 175.50 2ke0 s ARG 83 N -0.56 0.15 -0.58 2.72 3.00 -0.34 -0.83 118.95 122.51 2ke0 s ARG 83 Ca 0.08 0.59 -0.24 0.00 -1.00 0.00 0.00 55.73 55.16 2ke0 s ARG 83 Cb -0.11 -0.12 0.05 0.00 0.00 0.00 0.00 34.95 34.77 2ke0 s ARG 83 CO -0.00 -0.22 0.96 0.50 0.00 0.00 0.00 175.30 176.54 2ke0 s ARG 84 N 1.77 3.28 -0.02 5.12 3.52 -0.06 -1.26 118.95 131.31 2ke0 s ARG 84 Ca -0.04 -0.37 -0.16 0.00 -0.13 0.00 0.00 55.73 55.03 2ke0 s ARG 84 Cb -0.11 -4.09 -0.06 0.00 -1.56 0.00 0.00 34.95 29.13 2ke0 s ARG 84 CO -0.08 -1.58 0.45 -1.17 -0.81 0.00 0.00 175.30 172.11 2ke0 s LEU 85 N 4.06 4.44 -0.23 -0.88 2.96 0.33 -1.15 118.68 128.21 2ke0 s LEU 85 Ca 0.29 0.98 0.01 0.00 -0.22 0.00 0.00 54.13 55.18 2ke0 s LEU 85 Cb -0.13 -2.66 0.06 0.00 0.50 0.00 0.00 46.19 43.95 2ke0 s LEU 85 CO 0.17 0.24 -0.06 -0.89 -1.32 0.00 0.00 176.35 174.49 2ke0 s THR 86 N -0.66 1.50 -0.12 3.68 2.01 0.11 0.00 115.64 122.16 2ke0 s THR 86 Ca 0.25 -1.16 0.00 0.00 0.31 0.00 0.00 61.69 61.09 2ke0 s THR 86 Cb -0.17 -1.75 -0.02 0.00 0.01 0.00 0.00 72.50 70.58 2ke0 s THR 86 CO 0.14 -0.07 -0.13 -0.63 -0.69 0.00 0.00 174.62 173.24 2ke0 s ILE 87 N 1.42 3.10 0.99 1.82 1.01 -0.34 -1.39 121.20 127.80 2ke0 s ILE 87 Ca -0.05 -0.65 -0.12 0.00 0.00 0.00 0.00 60.65 59.82 2ke0 s ILE 87 Cb -0.18 -2.29 0.18 0.00 0.01 0.00 0.00 42.46 40.18 2ke0 s ILE 87 CO -0.06 0.53 1.09 -2.16 0.00 0.00 0.00 174.94 174.34 2ke0 s PRO 88 N 0.18 0.51 0.24 2.79 0.04 -1.26 -0.90 135.00 136.60 2ke0 s PRO 88 Ca -0.07 0.55 0.01 0.00 0.04 0.00 0.00 61.00 61.53 2ke0 s PRO 88 Cb -0.15 -1.74 0.28 0.00 0.04 0.00 0.00 34.50 32.92 2ke0 s PRO 88 CO 0.05 -2.69 1.61 -1.00 0.04 0.00 0.00 177.00 175.01 2ke0 h PRO 89 N -1.86 0.44 -0.22 0.56 0.13 -1.89 -1.42 132.00 127.74 2ke0 h PRO 89 Ca -0.54 -0.23 -0.14 0.00 -0.87 0.00 0.00 66.00 64.22 2ke0 h PRO 89 Cb 1.32 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.46 2ke0 h PRO 89 CO 0.57 0.80 -0.39 -0.56 -0.23 0.00 0.00 178.00 178.19 2ke0 h GLN 90 N 0.36 0.66 -0.71 0.86 3.07 -1.90 0.25 115.11 117.70 2ke0 h GLN 90 Ca 0.03 -0.41 -0.03 0.00 0.09 0.00 0.00 58.65 58.33 2ke0 h GLN 90 Cb 0.91 0.05 -0.02 0.00 0.08 0.00 0.00 27.48 28.51 2ke0 h GLN 90 CO 0.08 1.03 0.03 -0.11 0.09 0.00 0.00 178.83 179.95 2ke0 n LEU 91 N -4.23 4.61 0.00 0.06 7.94 -1.21 -4.52 117.00 119.66 2ke0 n LEU 91 Ca -0.05 -2.35 0.00 0.00 -1.11 0.00 0.00 56.01 52.50 2ke0 n LEU 91 Cb 0.53 -0.65 0.00 0.00 0.53 0.00 0.00 43.42 43.84 2ke0 n LEU 91 CO 0.46 0.55 0.00 0.61 -1.11 0.00 0.00 177.39 177.90 2ke0 n GLY 92 N 0.39 2.61 0.16 -3.96 0.00 -0.54 -4.74 105.19 99.11 2ke0 n GLY 92 Ca 0.22 -0.29 -0.07 0.00 0.00 0.00 0.00 46.02 45.88 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 0.37 0.00 1.61 -1.99 -1.76 -3.49 116.97 111.71 2ke0 h TYR 93 Ca 0.00 0.01 0.00 0.00 2.00 0.00 0.00 58.73 60.74 2ke0 h TYR 93 Cb 0.00 -0.11 0.00 0.00 2.00 0.00 0.00 36.73 38.62 2ke0 h TYR 93 CO 0.00 0.21 0.00 0.41 -0.00 0.00 0.00 178.16 178.78 2ke0 n GLY 94 N -1.20 0.71 0.03 3.88 0.00 0.88 -4.57 105.19 104.91 2ke0 n GLY 94 Ca 0.01 -2.08 0.13 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 -1.00 2.96 -0.06 4.61 0.00 -1.26 -3.75 120.51 122.02 2ke0 n ALA 95 Ca 0.00 -0.23 -0.02 0.00 0.00 0.00 0.00 53.44 53.19 2ke0 n ALA 95 Cb 0.00 -1.25 -0.16 0.00 0.00 0.00 0.00 19.45 18.04 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 -1.73 0.67 0.00 0.00 5.12 -1.26 -4.67 116.66 114.78 2ke0 n ARG 96 Ca 0.05 -0.06 0.00 0.00 -1.93 0.00 0.00 57.85 55.92 2ke0 n ARG 96 Cb 0.37 -1.55 0.00 0.00 -1.16 0.00 0.00 32.46 30.13 2ke0 n ARG 96 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2ke0 n GLY 97 N 1.54 -0.41 0.02 -0.13 0.00 -1.25 -4.54 105.19 100.42 2ke0 n GLY 97 Ca -0.21 -0.97 -0.01 0.00 0.00 0.00 0.00 46.02 44.83 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 -0.92 0.00 0.00 4.61 0.00 -1.47 -3.48 119.26 118.00 2ke0 h ALA 98 Ca 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.67 2ke0 h ALA 98 Cb 0.00 0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.88 2ke0 h ALA 98 CO 0.00 0.09 0.00 0.41 0.00 0.00 0.00 179.25 179.75 2ke0 n GLY 99 N 1.77 1.03 5.00 0.00 0.00 -1.25 -4.97 105.19 106.76 2ke0 n GLY 99 Ca -0.01 0.34 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 1.40 0.22 -0.02 0.00 -1.26 -4.42 105.19 101.11 2ke0 n GLY 100 Ca 0.00 -0.02 -0.15 0.00 0.00 0.00 0.00 46.02 45.85 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 0.64 -2.71 1.61 2.07 -2.03 -3.36 116.25 112.47 2ke0 h VAL 101 Ca 0.00 -0.30 -0.61 0.00 0.82 0.00 0.00 66.70 66.61 2ke0 h VAL 101 Cb 0.00 0.80 -0.41 0.00 -1.52 0.00 0.00 31.29 30.16 2ke0 h VAL 101 CO 0.00 0.06 -0.64 -0.38 0.02 0.00 0.00 177.57 176.63 2ke0 n ILE 102 N -5.23 1.49 -1.17 4.57 5.41 -1.26 -4.99 119.36 118.18 2ke0 n ILE 102 Ca -0.10 -4.81 -0.29 0.00 1.00 0.00 0.00 62.75 58.55 2ke0 n ILE 102 Cb 0.25 -2.10 0.17 0.00 -0.71 0.00 0.00 39.64 37.25 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 -1.62 0.62 0.87 0.38 0.04 -1.26 -1.18 135.00 132.84 2ke0 s PRO 103 Ca 0.30 0.60 -0.11 0.00 0.04 0.00 0.00 61.00 61.83 2ke0 s PRO 103 Cb 0.03 -1.75 0.11 0.00 0.04 0.00 0.00 34.50 32.93 2ke0 s PRO 103 CO -0.12 -2.62 1.09 -1.25 0.04 0.00 0.00 177.00 174.13 2ke0 s PRO 104 N -4.95 1.47 -2.11 0.56 0.04 -1.26 -3.50 135.00 125.25 2ke0 s PRO 104 Ca 0.65 0.90 0.00 0.00 0.04 0.00 0.00 61.00 62.59 2ke0 s PRO 104 Cb -0.18 -1.83 0.00 0.00 0.04 0.00 0.00 34.50 32.53 2ke0 s PRO 104 CO 0.57 -2.11 0.00 0.09 0.04 0.00 0.00 177.00 175.59 2ke0 n ASN 105 N -3.81 -5.55 -4.05 6.66 4.13 -1.26 -4.95 115.26 106.43 2ke0 n ASN 105 Ca 0.07 0.40 -0.30 0.00 1.68 0.00 0.00 54.58 56.43 2ke0 n ASN 105 Cb 0.55 -4.84 -0.16 0.00 -1.54 0.00 0.00 39.78 33.79 2ke0 n ASN 105 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2ke0 s ALA 106 N -2.82 1.89 0.16 5.41 0.00 -1.23 -4.95 121.76 120.23 2ke0 s ALA 106 Ca 0.00 -0.90 -0.30 0.00 0.00 0.00 0.00 51.96 50.76 2ke0 s ALA 106 Cb 0.00 -1.00 -0.07 0.00 0.00 0.00 0.00 23.12 22.04 2ke0 s ALA 106 CO 0.00 -0.27 1.10 0.99 0.00 0.00 0.00 175.76 177.58 2ke0 s THR 107 N 1.29 3.91 -0.08 0.00 2.01 -1.26 -3.53 115.64 117.98 2ke0 s THR 107 Ca 0.01 1.62 -0.00 0.00 0.31 0.00 0.00 61.69 63.62 2ke0 s THR 107 Cb -0.14 -4.03 -0.03 0.00 0.01 0.00 0.00 72.50 68.31 2ke0 s THR 107 CO -0.08 0.26 -0.04 -1.48 -0.69 0.00 0.00 174.62 172.60 2ke0 s LEU 108 N -0.23 3.34 -0.12 4.42 2.34 -0.08 -3.82 118.68 124.54 2ke0 s LEU 108 Ca 0.50 0.05 -0.02 0.00 0.06 0.00 0.00 54.13 54.72 2ke0 s LEU 108 Cb -0.29 -1.74 -0.03 0.00 -0.56 0.00 0.00 46.19 43.57 2ke0 s LEU 108 CO 0.34 0.37 -0.06 -0.69 -1.06 0.00 0.00 176.35 175.25 2ke0 s VAL 109 N -0.81 3.75 -0.07 1.48 1.01 -0.52 -1.20 120.40 124.03 2ke0 s VAL 109 Ca 0.12 -0.43 0.04 0.00 0.00 0.00 0.00 61.98 61.71 2ke0 s VAL 109 Cb -0.11 -2.60 0.00 0.00 0.00 0.00 0.00 36.38 33.67 2ke0 s VAL 109 CO 0.02 0.54 -0.20 -0.36 0.00 0.00 0.00 175.10 175.10 2ke0 s PHE 110 N -0.10 2.09 -0.39 5.22 0.08 0.10 0.17 117.98 125.15 2ke0 s PHE 110 Ca 0.01 -0.77 -0.18 0.00 0.12 0.00 0.00 56.93 56.12 2ke0 s PHE 110 Cb -0.13 -1.42 0.01 0.00 -0.57 0.00 0.00 43.02 40.91 2ke0 s PHE 110 CO 0.03 -0.31 0.47 -2.00 -0.10 0.00 0.00 175.22 173.31 2ke0 s GLU 111 N 0.31 3.36 -0.26 0.44 -6.30 0.22 -0.51 118.70 115.95 2ke0 s GLU 111 Ca -0.13 -0.47 -0.16 0.00 -2.50 0.00 0.00 54.97 51.70 2ke0 s GLU 111 Cb -0.16 -3.89 -0.03 0.00 0.00 0.00 0.00 34.13 30.05 2ke0 s GLU 111 CO 0.06 -0.76 0.45 0.08 0.02 0.00 0.00 175.26 175.11 2ke0 s VAL 112 N 2.29 5.12 -0.22 3.70 1.01 -0.39 -1.08 120.40 130.82 2ke0 s VAL 112 Ca 0.15 0.73 0.01 0.00 0.00 0.00 0.00 61.98 62.88 2ke0 s VAL 112 Cb -0.16 -3.77 0.06 0.00 0.00 0.00 0.00 36.38 32.51 2ke0 s VAL 112 CO 0.14 0.12 -0.07 -0.70 0.00 0.00 0.00 175.10 174.60 2ke0 s GLU 113 N 2.16 1.72 0.16 2.72 2.12 -0.27 -1.20 118.70 126.11 2ke0 s GLU 113 Ca 0.18 -0.94 -0.31 0.00 0.36 0.00 0.00 54.97 54.26 2ke0 s GLU 113 Cb -0.16 -2.53 -0.08 0.00 0.26 0.00 0.00 34.13 31.62 2ke0 s GLU 113 CO 0.09 -0.55 1.36 -0.51 -0.54 0.00 0.00 175.26 175.12 2ke0 s LEU 114 N 1.40 4.39 -0.17 2.70 2.01 -0.47 -0.96 118.68 127.58 2ke0 s LEU 114 Ca -0.05 2.39 -0.12 0.00 0.01 0.00 0.00 54.13 56.37 2ke0 s LEU 114 Cb -0.18 -3.60 -0.07 0.00 0.01 0.00 0.00 46.19 42.35 2ke0 s LEU 114 CO -0.07 -0.61 -0.27 0.18 1.01 0.00 0.00 176.35 176.60 2ke0 n LEU 115 N 3.24 1.61 -3.51 1.79 4.77 -0.44 -0.67 117.00 123.79 2ke0 n LEU 115 Ca 0.09 0.27 -0.15 0.00 -0.03 0.00 0.00 56.01 56.19 2ke0 n LEU 115 Cb 0.42 -0.64 -0.05 0.00 -2.33 0.00 0.00 43.42 40.83 2ke0 n LEU 115 CO 0.58 0.08 0.38 -0.62 -1.33 0.00 0.00 177.39 176.48 2ke0 s ASP 116 N -6.49 -0.57 0.00 -1.43 2.15 -1.16 -4.38 116.67 104.79 2ke0 s ASP 116 Ca -0.27 0.39 0.15 0.00 0.43 0.00 0.00 52.55 53.26 2ke0 s ASP 116 Cb 0.08 0.54 0.12 0.00 -0.30 0.00 0.00 42.92 43.36 2ke0 s ASP 116 CO 0.36 -0.72 0.99 1.33 -0.17 0.00 0.00 175.17 176.95