#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 4.17 0.00 1.61 0.04 -1.26 -5.03 135.00 134.53 2ke0 s PRO 2 Ca 0.00 1.93 0.00 0.00 0.04 0.00 0.00 61.00 62.97 2ke0 s PRO 2 Cb 0.00 -2.82 0.00 0.00 0.04 0.00 0.00 34.50 31.72 2ke0 s PRO 2 CO 0.00 -0.25 0.00 0.41 0.04 0.00 0.00 177.00 177.20 2ke0 n GLY 3 N 0.73 0.72 2.88 0.56 0.00 -1.26 -5.09 105.19 103.74 2ke0 n GLY 3 Ca 0.03 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.76 2ke0 n GLY 3 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2ke0 s SER 4 N -0.21 3.38 -0.50 1.61 0.15 -1.26 -5.09 113.70 111.78 2ke0 s SER 4 Ca 0.00 -0.97 -0.23 0.00 0.70 0.00 0.00 55.95 55.45 2ke0 s SER 4 Cb 0.00 -0.97 0.04 0.00 -1.71 0.00 0.00 66.02 63.38 2ke0 s SER 4 CO 0.00 -0.24 0.83 -0.04 1.20 0.00 0.00 173.24 174.99 2ke0 s MET 5 N 1.57 3.33 0.20 5.44 -1.94 -1.26 -5.03 119.30 121.61 2ke0 s MET 5 Ca -0.03 -0.30 0.08 0.00 -1.71 0.00 0.00 55.69 53.72 2ke0 s MET 5 Cb -0.18 -4.02 -0.05 0.00 2.01 0.00 0.00 34.83 32.60 2ke0 s MET 5 CO -0.07 -1.30 -0.14 -0.08 -0.01 0.00 0.00 175.02 173.42 2ke0 s THR 6 N 3.47 1.71 0.06 2.05 -1.32 -1.26 -5.16 115.64 115.20 2ke0 s THR 6 Ca 0.28 -2.20 0.09 0.00 -1.21 0.00 0.00 61.69 58.64 2ke0 s THR 6 Cb -0.13 -2.03 -0.03 0.00 -1.51 0.00 0.00 72.50 68.79 2ke0 s THR 6 CO 0.19 -0.60 -0.24 0.54 -2.21 0.00 0.00 174.62 172.30 2ke0 s VAL 7 N -2.99 1.95 0.03 5.08 0.11 -1.26 -4.94 120.40 118.38 2ke0 s VAL 7 Ca 0.22 -1.39 0.08 0.00 -2.93 0.00 0.00 61.98 57.96 2ke0 s VAL 7 Cb -0.01 -1.70 -0.03 0.00 -1.53 0.00 0.00 36.38 33.12 2ke0 s VAL 7 CO 0.06 0.23 -0.22 0.54 -3.33 0.00 0.00 175.10 172.39 2ke0 s VAL 8 N -0.87 2.50 -0.00 2.04 0.11 -1.26 -5.06 120.40 117.85 2ke0 s VAL 8 Ca 0.10 -1.23 0.04 0.00 -2.93 0.00 0.00 61.98 57.96 2ke0 s VAL 8 Cb -0.10 -2.00 -0.01 0.00 -1.53 0.00 0.00 36.38 32.74 2ke0 s VAL 8 CO 0.03 0.39 -0.12 0.42 -3.33 0.00 0.00 175.10 172.48 2ke0 s THR 9 N -0.84 0.95 0.19 5.04 -4.23 -1.26 -3.82 115.64 111.67 2ke0 s THR 9 Ca 0.13 -0.59 0.01 0.00 -1.18 0.00 0.00 61.69 60.07 2ke0 s THR 9 Cb -0.10 -0.81 0.01 0.00 1.34 0.00 0.00 72.50 72.94 2ke0 s THR 9 CO 0.03 0.21 0.12 0.35 -0.54 0.00 0.00 174.62 174.80 2ke0 n THR 10 N 2.64 0.00 0.31 3.99 -2.24 -1.24 -4.97 114.28 112.78 2ke0 n THR 10 Ca -0.15 -0.79 0.20 0.00 -2.27 0.00 0.00 64.05 61.05 2ke0 n THR 10 Cb 0.56 -0.26 1.02 0.00 -2.10 0.00 0.00 70.33 69.55 2ke0 n THR 10 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 2ke0 h GLU 11 N 0.00 0.00 0.14 -0.78 5.08 -2.01 -2.58 114.58 114.43 2ke0 h GLU 11 Ca -0.13 0.00 -0.23 0.00 -1.00 0.00 0.00 59.36 58.00 2ke0 h GLU 11 Cb 0.45 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.71 2ke0 h GLU 11 CO 0.20 0.01 -1.11 0.77 -1.00 0.00 0.00 179.01 177.88 2ke0 h SER 12 N 0.00 0.46 0.00 1.42 0.02 -1.98 -3.49 113.55 109.98 2ke0 h SER 12 Ca -0.00 -0.91 0.00 0.00 -0.84 0.00 0.00 61.79 60.04 2ke0 h SER 12 Cb 0.17 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 62.56 2ke0 h SER 12 CO 0.00 1.51 0.00 0.61 -1.14 0.00 0.00 176.83 177.81 2ke0 n GLY 13 N 1.70 0.80 3.28 -3.77 0.00 -0.97 -5.05 105.19 101.18 2ke0 n GLY 13 Ca -0.19 -0.03 -0.33 0.00 0.00 0.00 0.00 46.02 45.48 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 -2.18 -3.83 0.99 -0.00 -1.26 -4.59 117.00 106.12 2ke0 n LEU 14 Ca 0.00 -0.09 -0.12 0.00 -0.00 0.00 0.00 56.01 55.80 2ke0 n LEU 14 Cb 0.00 -0.97 -0.13 0.00 -0.00 0.00 0.00 43.42 42.33 2ke0 n LEU 14 CO 0.00 -3.12 -0.24 -0.54 -0.00 0.00 0.00 177.39 173.49 2ke0 s LYS 15 N -3.43 0.13 0.17 1.47 1.02 -0.53 -3.62 119.74 114.94 2ke0 s LYS 15 Ca 0.56 0.15 0.00 0.00 0.02 0.00 0.00 55.97 56.70 2ke0 s LYS 15 Cb -0.12 0.06 -0.04 0.00 -0.52 0.00 0.00 37.83 37.21 2ke0 s LYS 15 CO 0.66 -0.02 0.05 1.52 -0.92 0.00 0.00 175.35 176.65 2ke0 s TYR 16 N 0.06 1.08 -0.11 3.18 -0.85 -1.25 0.17 117.35 119.63 2ke0 s TYR 16 Ca -0.00 -1.17 -0.05 0.00 -0.52 0.00 0.00 57.07 55.33 2ke0 s TYR 16 Cb -0.01 -0.61 0.05 0.00 0.38 0.00 0.00 41.96 41.78 2ke0 s TYR 16 CO 0.00 -0.41 0.24 -2.00 -1.52 0.00 0.00 175.55 171.86 2ke0 s GLU 17 N -4.01 0.15 0.10 -3.49 2.12 -0.01 -4.06 118.70 109.50 2ke0 s GLU 17 Ca 0.27 0.62 -0.35 0.00 0.36 0.00 0.00 54.97 55.87 2ke0 s GLU 17 Cb 0.07 -0.11 -0.14 0.00 0.26 0.00 0.00 34.13 34.21 2ke0 s GLU 17 CO 0.05 -0.23 1.57 -3.47 -0.54 0.00 0.00 175.26 172.63 2ke0 n ASP 18 N 4.83 2.79 -0.10 -1.70 2.03 -1.26 -1.34 116.55 121.80 2ke0 n ASP 18 Ca -0.15 1.08 -0.17 0.00 0.52 0.00 0.00 54.79 56.06 2ke0 n ASP 18 Cb 0.51 -1.36 -0.13 0.00 -0.72 0.00 0.00 41.12 39.43 2ke0 n ASP 18 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 2ke0 n LEU 19 N 3.68 2.55 -3.24 -2.67 4.77 0.28 -4.84 117.00 117.54 2ke0 n LEU 19 Ca 0.18 -0.06 0.03 0.00 -0.03 0.00 0.00 56.01 56.13 2ke0 n LEU 19 Cb 0.26 -0.76 -0.02 0.00 -2.33 0.00 0.00 43.42 40.58 2ke0 n LEU 19 CO 0.65 0.87 0.23 -0.89 -1.33 0.00 0.00 177.39 176.91 2ke0 s THR 20 N -2.52 -0.92 0.29 -5.08 2.01 0.98 -4.92 115.64 105.48 2ke0 s THR 20 Ca -0.30 0.00 -0.30 0.00 0.31 0.00 0.00 61.69 61.41 2ke0 s THR 20 Cb 0.08 -1.00 -0.11 0.00 0.01 0.00 0.00 72.50 71.49 2ke0 s THR 20 CO 0.66 0.00 1.49 -0.70 -0.69 0.00 0.00 174.62 175.37 2ke0 s GLU 21 N 2.86 4.20 0.58 4.92 2.12 -1.26 -0.88 118.70 131.24 2ke0 s GLU 21 Ca 0.14 2.44 -0.04 0.00 0.36 0.00 0.00 54.97 57.87 2ke0 s GLU 21 Cb -0.14 -3.05 0.02 0.00 0.26 0.00 0.00 34.13 31.22 2ke0 s GLU 21 CO -0.20 -0.49 0.86 0.20 -0.54 0.00 0.00 175.26 175.09 2ke0 s GLY 22 N 0.23 1.64 -0.30 -1.50 0.00 -1.26 -4.77 107.32 101.36 2ke0 s GLY 22 Ca 0.58 -0.90 0.12 0.00 0.00 0.00 0.00 44.72 44.53 2ke0 s GLY 22 CO 0.49 -0.62 1.14 1.44 0.00 0.00 0.00 173.10 175.56 2ke0 n SER 23 N -2.51 3.68 0.00 1.64 7.64 -1.24 -4.91 113.62 117.92 2ke0 n SER 23 Ca 0.05 -3.16 0.00 0.00 1.01 0.00 0.00 58.87 56.77 2ke0 n SER 23 Cb 0.58 -0.41 0.00 0.00 -1.01 0.00 0.00 64.21 63.38 2ke0 n SER 23 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2ke0 n GLY 24 N -0.61 4.79 3.82 0.23 0.00 -1.25 -5.01 105.19 107.16 2ke0 n GLY 24 Ca 0.30 -0.77 -0.38 0.00 0.00 0.00 0.00 46.02 45.17 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 3.62 -0.16 4.61 0.00 -1.26 -4.67 121.76 121.90 2ke0 s ALA 25 Ca 0.00 -0.07 -0.15 0.00 0.00 0.00 0.00 51.96 51.74 2ke0 s ALA 25 Cb 0.00 -2.54 -0.04 0.00 0.00 0.00 0.00 23.12 20.54 2ke0 s ALA 25 CO 0.00 0.44 0.36 -2.00 0.00 0.00 0.00 175.76 174.55 2ke0 s GLU 26 N -1.27 4.26 0.16 0.00 2.12 -1.26 -0.04 118.70 122.67 2ke0 s GLU 26 Ca 0.29 0.20 -0.33 0.00 0.36 0.00 0.00 54.97 55.49 2ke0 s GLU 26 Cb -0.18 -3.45 -0.13 0.00 0.26 0.00 0.00 34.13 30.63 2ke0 s GLU 26 CO 0.17 0.16 1.68 0.00 -0.54 0.00 0.00 175.26 176.74 2ke0 n ALA 27 N 3.78 2.00 -2.38 6.30 0.00 -0.40 -4.95 120.51 124.86 2ke0 n ALA 27 Ca -0.10 0.40 -0.29 0.00 0.00 0.00 0.00 53.44 53.46 2ke0 n ALA 27 Cb 0.52 -2.45 -0.16 0.00 0.00 0.00 0.00 19.45 17.36 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 1.41 1.83 -0.09 0.00 1.81 -1.26 -3.44 118.95 119.20 2ke0 s ARG 28 Ca 0.79 -0.84 -0.35 0.00 -1.72 0.00 0.00 55.73 53.60 2ke0 s ARG 28 Cb -0.59 -1.79 -0.13 0.00 -0.45 0.00 0.00 34.95 31.99 2ke0 s ARG 28 CO 0.36 0.49 1.80 0.00 -0.68 0.00 0.00 175.30 177.28 2ke0 n ALA 29 N 2.44 0.65 0.00 2.13 0.00 -1.26 -1.58 120.51 122.88 2ke0 n ALA 29 Ca -0.16 0.33 0.00 0.00 0.00 0.00 0.00 53.44 53.61 2ke0 n ALA 29 Cb 0.52 -2.41 0.00 0.00 0.00 0.00 0.00 19.45 17.56 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 4.19 1.64 3.93 0.00 0.00 0.04 -4.97 105.19 110.02 2ke0 n GLY 30 Ca 0.23 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.98 2ke0 n GLY 30 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2ke0 s GLN 31 N -0.09 3.52 -0.29 1.61 -2.07 -0.62 -4.81 119.66 116.92 2ke0 s GLN 31 Ca 0.00 -0.35 -0.13 0.00 -1.82 0.00 0.00 55.36 53.07 2ke0 s GLN 31 Cb 0.00 -2.81 -0.04 0.00 -1.09 0.00 0.00 33.01 29.07 2ke0 s GLN 31 CO 0.00 0.36 0.25 0.99 -1.32 0.00 0.00 175.29 175.57 2ke0 s THR 32 N -1.94 5.26 0.26 3.63 2.01 -1.26 -1.27 115.64 122.33 2ke0 s THR 32 Ca 0.39 0.17 0.07 0.00 0.31 0.00 0.00 61.69 62.64 2ke0 s THR 32 Cb -0.11 -3.62 -0.05 0.00 0.01 0.00 0.00 72.50 68.73 2ke0 s THR 32 CO 0.30 0.15 -0.10 0.68 -0.69 0.00 0.00 174.62 174.96 2ke0 s VAL 33 N 1.84 1.75 -0.23 3.82 -7.23 -0.68 -4.71 120.40 114.97 2ke0 s VAL 33 Ca 0.09 -2.18 -0.03 0.00 -1.81 0.00 0.00 61.98 58.06 2ke0 s VAL 33 Cb -0.16 -2.32 0.01 0.00 0.56 0.00 0.00 36.38 34.47 2ke0 s VAL 33 CO 0.11 -0.40 -0.06 -0.44 -0.31 0.00 0.00 175.10 174.00 2ke0 s SER 34 N -3.41 4.22 0.25 4.85 0.01 -0.50 -1.47 113.70 117.64 2ke0 s SER 34 Ca 0.27 -0.60 0.11 0.00 1.31 0.00 0.00 55.95 57.04 2ke0 s SER 34 Cb 0.02 -1.69 -0.05 0.00 0.21 0.00 0.00 66.02 64.50 2ke0 s SER 34 CO 0.11 -0.06 -0.19 0.68 0.41 0.00 0.00 173.24 174.18 2ke0 s VAL 35 N 1.41 2.27 -0.11 3.43 -7.23 -0.50 -1.35 120.40 118.31 2ke0 s VAL 35 Ca 0.04 -2.29 -0.00 0.00 -1.81 0.00 0.00 61.98 57.92 2ke0 s VAL 35 Cb -0.15 -2.19 -0.02 0.00 0.56 0.00 0.00 36.38 34.58 2ke0 s VAL 35 CO -0.04 -0.40 -0.10 -1.00 -0.31 0.00 0.00 175.10 173.25 2ke0 s HIS 36 N -2.46 2.86 -0.14 2.82 3.76 0.81 -0.04 115.29 122.89 2ke0 s HIS 36 Ca 0.26 -0.39 -0.03 0.00 -0.15 0.00 0.00 55.06 54.75 2ke0 s HIS 36 Cb -0.05 -1.82 -0.03 0.00 1.11 0.00 0.00 32.58 31.80 2ke0 s HIS 36 CO 0.12 -0.03 -0.06 1.52 -0.85 0.00 0.00 174.74 175.44 2ke0 s TYR 37 N 0.03 2.98 -0.31 1.40 -0.85 -1.24 -1.11 117.35 118.24 2ke0 s TYR 37 Ca -0.03 -0.34 0.03 0.00 -0.52 0.00 0.00 57.07 56.21 2ke0 s TYR 37 Cb -0.14 -1.92 0.09 0.00 0.38 0.00 0.00 41.96 40.37 2ke0 s TYR 37 CO 0.04 -0.04 0.00 0.99 -1.52 0.00 0.00 175.55 175.02 2ke0 s THR 38 N 0.28 2.09 0.36 -3.49 2.01 -0.01 -3.41 115.64 113.47 2ke0 s THR 38 Ca -0.05 -2.01 -0.26 0.00 0.31 0.00 0.00 61.69 59.68 2ke0 s THR 38 Cb -0.14 -2.44 -0.09 0.00 0.01 0.00 0.00 72.50 69.84 2ke0 s THR 38 CO 0.03 -0.42 1.13 -0.83 -0.69 0.00 0.00 174.62 173.84 2ke0 s GLY 39 N 1.04 2.91 -0.11 4.40 0.00 0.46 -0.72 107.32 115.30 2ke0 s GLY 39 Ca 0.04 0.90 -0.07 0.00 0.00 0.00 0.00 44.72 45.59 2ke0 s GLY 39 CO -0.08 1.43 0.26 -0.98 0.00 0.00 0.00 173.10 173.73 2ke0 s TRP 40 N -1.37 -0.33 1.11 1.90 0.51 0.10 -3.33 118.94 117.54 2ke0 s TRP 40 Ca 0.53 0.78 -0.18 0.00 -2.12 0.00 0.00 56.10 55.10 2ke0 s TRP 40 Cb -0.30 0.09 0.26 0.00 -0.81 0.00 0.00 33.47 32.71 2ke0 s TRP 40 CO 0.38 -0.19 1.21 -0.51 -0.51 0.00 0.00 176.95 177.32 2ke0 s LEU 41 N 0.73 1.56 0.59 2.99 1.43 0.88 -1.60 118.68 125.26 2ke0 s LEU 41 Ca -0.05 0.41 0.33 0.00 -1.03 0.00 0.00 54.13 53.80 2ke0 s LEU 41 Cb -0.06 -2.23 1.86 0.00 0.03 0.00 0.00 46.19 45.79 2ke0 s LEU 41 CO -0.05 -3.60 2.22 0.71 0.23 0.00 0.00 176.35 175.87 2ke0 h THR 42 N -2.23 0.37 0.00 5.49 1.35 -1.91 -1.21 112.91 114.77 2ke0 h THR 42 Ca -0.44 -0.18 -0.01 0.00 -0.55 0.00 0.00 66.41 65.23 2ke0 h THR 42 Cb 1.26 1.12 -0.00 0.00 -1.73 0.00 0.00 68.15 68.80 2ke0 h THR 42 CO 0.33 0.03 -1.41 -0.67 -0.25 0.00 0.00 175.52 173.55 2ke0 n ASP 43 N -3.55 0.53 0.00 5.36 2.03 -1.26 -4.96 116.55 114.70 2ke0 n ASP 43 Ca -0.02 0.20 0.00 0.00 0.52 0.00 0.00 54.79 55.49 2ke0 n ASP 43 Cb 0.13 1.01 0.00 0.00 -0.72 0.00 0.00 41.12 41.55 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 1.23 1.19 3.69 0.27 0.00 -0.46 -5.09 105.19 106.02 2ke0 n GLY 44 Ca -0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.57 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 -0.25 4.31 -0.46 1.61 2.00 -1.26 -4.56 119.66 121.04 2ke0 s GLN 45 Ca 0.00 1.89 -0.29 0.00 -2.00 0.00 0.00 55.36 54.96 2ke0 s GLN 45 Cb 0.00 -3.54 0.03 0.00 0.80 0.00 0.00 33.01 30.30 2ke0 s GLN 45 CO 0.00 -0.52 1.12 0.21 -0.50 0.00 0.00 175.29 175.60 2ke0 s LYS 46 N 2.21 3.76 -0.02 1.67 2.20 -1.26 -0.08 119.74 128.22 2ke0 s LYS 46 Ca 0.62 0.62 0.21 0.00 -0.36 0.00 0.00 55.97 57.05 2ke0 s LYS 46 Cb -0.30 -3.89 -0.28 0.00 -1.51 0.00 0.00 37.83 31.85 2ke0 s LYS 46 CO 0.26 -1.32 0.63 1.97 -0.36 0.00 0.00 175.35 176.53 2ke0 n PHE 47 N 7.71 0.00 -3.71 4.03 1.16 -1.21 -4.92 117.46 120.52 2ke0 n PHE 47 Ca 0.12 0.00 -0.14 0.00 -1.87 0.00 0.00 57.45 55.56 2ke0 n PHE 47 Cb 0.49 -0.27 -0.14 0.00 -1.61 0.00 0.00 39.48 37.94 2ke0 n PHE 47 CO 0.00 0.00 0.00 0.34 -1.87 0.00 0.00 176.76 175.23 2ke0 s ASP 48 N -3.76 0.14 -0.23 5.98 -1.08 -1.26 -5.00 116.67 111.46 2ke0 s ASP 48 Ca -0.01 0.39 -0.04 0.00 -0.52 0.00 0.00 52.55 52.37 2ke0 s ASP 48 Cb 0.14 0.31 0.10 0.00 -1.46 0.00 0.00 42.92 42.01 2ke0 s ASP 48 CO 0.85 -0.19 0.19 -0.94 0.52 0.00 0.00 175.17 175.61 2ke0 s SER 49 N 1.63 1.99 0.01 -0.34 1.04 -1.26 -0.40 113.70 116.36 2ke0 s SER 49 Ca -0.05 -0.58 -0.23 0.00 0.48 0.00 0.00 55.95 55.58 2ke0 s SER 49 Cb -0.12 0.16 -0.17 0.00 0.10 0.00 0.00 66.02 66.00 2ke0 s SER 49 CO -0.07 -0.36 1.30 0.77 0.98 0.00 0.00 173.24 175.86 2ke0 h SER 50 N 8.34 0.22 -0.38 7.02 4.64 -1.83 -3.02 113.55 128.53 2ke0 h SER 50 Ca -0.16 -0.49 0.11 0.00 -0.47 0.00 0.00 61.79 60.77 2ke0 h SER 50 Cb 1.11 -0.06 -0.02 0.00 -0.31 0.00 0.00 62.40 63.13 2ke0 h SER 50 CO 0.32 0.67 0.33 0.07 -0.87 0.00 0.00 176.83 177.34 2ke0 h LYS 51 N -0.23 0.00 -0.40 4.77 5.09 -1.84 0.60 116.57 124.56 2ke0 h LYS 51 Ca 0.01 0.00 0.11 0.00 0.09 0.00 0.00 60.65 60.87 2ke0 h LYS 51 Cb 0.61 0.00 -0.02 0.00 0.10 0.00 0.00 32.23 32.92 2ke0 h LYS 51 CO 0.02 0.00 0.36 0.22 -2.09 0.00 0.00 179.45 177.96 2ke0 h ASP 52 N 0.00 0.00 0.00 7.07 3.58 -1.93 -1.19 116.42 123.95 2ke0 h ASP 52 Ca 0.18 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.63 2ke0 h ASP 52 Cb 0.83 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.88 2ke0 h ASP 52 CO -0.00 0.00 -0.15 -1.14 -2.88 0.00 0.00 179.24 175.07 2ke0 n ARG 53 N -3.96 1.04 -3.74 0.28 3.00 0.07 -4.99 116.66 108.35 2ke0 n ARG 53 Ca 0.07 -1.80 -0.25 0.00 -0.00 0.00 0.00 57.85 55.87 2ke0 n ARG 53 Cb 0.54 -1.06 0.05 0.00 0.00 0.00 0.00 32.46 31.99 2ke0 n ARG 53 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.63 175.92 2ke0 n ASN 54 N -0.77 -4.13 -3.76 6.15 2.85 -0.45 -4.93 115.26 110.21 2ke0 n ASN 54 Ca 0.08 -0.71 -0.32 0.00 -0.11 0.00 0.00 54.58 53.52 2ke0 n ASN 54 Cb 0.59 -4.35 -0.07 0.00 1.24 0.00 0.00 39.78 37.19 2ke0 n ASN 54 CO 0.00 0.00 0.00 -0.67 -2.11 0.00 0.00 177.26 174.48 2ke0 n ASP 55 N -2.96 4.17 -4.77 1.20 2.03 -0.42 -4.97 116.55 110.83 2ke0 n ASP 55 Ca -0.08 -3.33 -0.40 0.00 0.52 0.00 0.00 54.79 51.51 2ke0 n ASP 55 Cb 0.58 -0.87 -0.03 0.00 -0.72 0.00 0.00 41.12 40.09 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 -2.10 4.33 -0.65 -0.67 0.04 -1.26 -4.60 135.00 130.09 2ke0 s PRO 56 Ca 0.33 2.00 -0.24 0.00 0.04 0.00 0.00 61.00 63.13 2ke0 s PRO 56 Cb 0.05 -2.98 0.05 0.00 0.04 0.00 0.00 34.50 31.66 2ke0 s PRO 56 CO -0.05 -0.13 1.04 0.12 0.04 0.00 0.00 177.00 178.02 2ke0 s PHE 57 N -1.23 2.61 -0.18 0.56 2.19 0.94 -4.86 117.98 118.01 2ke0 s PHE 57 Ca 0.50 -0.26 -0.08 0.00 0.33 0.00 0.00 56.93 57.42 2ke0 s PHE 57 Cb -0.35 -4.33 -0.04 0.00 -1.31 0.00 0.00 43.02 36.99 2ke0 s PHE 57 CO 0.46 -1.68 0.09 0.00 1.83 0.00 0.00 175.22 175.92 2ke0 s ALA 58 N 4.47 3.56 0.18 11.12 0.00 -1.26 -1.41 121.76 138.41 2ke0 s ALA 58 Ca 0.28 -0.71 -0.24 0.00 0.00 0.00 0.00 51.96 51.29 2ke0 s ALA 58 Cb -0.13 -2.02 0.05 0.00 0.00 0.00 0.00 23.12 21.03 2ke0 s ALA 58 CO 0.14 0.22 0.85 -0.59 0.00 0.00 0.00 175.76 176.38 2ke0 s PHE 59 N 0.22 -0.20 -0.22 0.00 -0.71 -0.54 -4.98 117.98 111.55 2ke0 s PHE 59 Ca 0.06 -0.13 -0.23 0.00 -1.04 0.00 0.00 56.93 55.59 2ke0 s PHE 59 Cb -0.12 0.64 -0.01 0.00 -1.21 0.00 0.00 43.02 42.33 2ke0 s PHE 59 CO -0.00 -0.92 0.77 0.08 -1.34 0.00 0.00 175.22 173.80 2ke0 s VAL 60 N -3.49 4.89 -0.49 -2.49 1.01 -1.26 -1.68 120.40 116.89 2ke0 s VAL 60 Ca 0.10 1.46 -0.31 0.00 0.00 0.00 0.00 61.98 63.23 2ke0 s VAL 60 Cb -0.03 -4.07 -0.11 0.00 0.00 0.00 0.00 36.38 32.18 2ke0 s VAL 60 CO 0.01 -0.01 2.35 -0.11 0.00 0.00 0.00 175.10 177.34 2ke0 n LEU 61 N 5.68 2.00 0.00 3.92 7.94 -0.40 -0.96 117.00 135.18 2ke0 n LEU 61 Ca 0.03 0.06 0.00 0.00 -1.11 0.00 0.00 56.01 54.99 2ke0 n LEU 61 Cb 0.48 -1.34 0.00 0.00 0.53 0.00 0.00 43.42 43.09 2ke0 n LEU 61 CO 0.46 -0.99 0.00 0.61 -1.11 0.00 0.00 177.39 176.36 2ke0 n GLY 62 N 6.29 0.82 0.00 -3.96 0.00 -1.26 -0.78 105.19 106.31 2ke0 n GLY 62 Ca 0.43 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.45 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 -1.64 0.00 -0.02 0.00 -0.13 -4.98 105.19 98.41 2ke0 n GLY 63 Ca 0.00 0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.05 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 -0.06 0.61 0.35 -0.02 0.00 -1.26 -4.98 105.19 99.82 2ke0 n GLY 64 Ca 0.00 0.00 0.18 0.00 0.00 0.00 0.00 46.02 46.20 2ke0 n GLY 64 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 2ke0 h MET 65 N 0.00 0.00 0.00 1.61 2.86 -1.97 -3.42 114.93 114.01 2ke0 h MET 65 Ca 0.00 0.00 -0.08 0.00 -2.06 0.00 0.00 59.70 57.56 2ke0 h MET 65 Cb 0.00 0.00 0.02 0.00 0.06 0.00 0.00 31.60 31.68 2ke0 h MET 65 CO 0.00 0.00 0.05 1.33 1.06 0.00 0.00 176.91 179.35 2ke0 n VAL 66 N -3.78 0.00 -4.09 -2.22 0.24 -1.26 -5.11 118.33 102.11 2ke0 n VAL 66 Ca 0.03 -0.21 -0.22 0.00 -2.04 0.00 0.00 64.34 61.90 2ke0 n VAL 66 Cb 0.42 -1.62 -0.05 0.00 -1.47 0.00 0.00 33.84 31.12 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 -0.92 3.61 0.27 1.34 -0.00 -1.26 -4.97 121.20 119.26 2ke0 s ILE 67 Ca 0.12 -1.60 -0.01 0.00 -0.00 0.00 0.00 60.65 59.16 2ke0 s ILE 67 Cb -0.00 -3.10 0.29 0.00 -0.00 0.00 0.00 42.46 39.64 2ke0 s ILE 67 CO 0.08 -0.27 1.66 0.11 -0.00 0.00 0.00 174.94 176.52 2ke0 h LYS 68 N 1.55 0.22 -0.80 0.37 1.79 -1.95 0.17 116.57 117.93 2ke0 h LYS 68 Ca -0.45 -0.01 0.06 0.00 -2.18 0.00 0.00 60.65 58.07 2ke0 h LYS 68 Cb 1.25 -0.05 -0.06 0.00 -1.58 0.00 0.00 32.23 31.79 2ke0 h LYS 68 CO 0.61 0.15 0.48 0.78 -1.08 0.00 0.00 179.45 180.39 2ke0 h GLY 69 N 0.23 1.20 0.82 3.86 0.00 -1.95 0.05 103.07 107.28 2ke0 h GLY 69 Ca 0.50 -0.34 -0.04 0.00 0.00 0.00 0.00 47.33 47.45 2ke0 h GLY 69 CO -0.61 0.22 -0.01 1.49 0.00 0.00 0.00 176.54 177.63 2ke0 h TRP 70 N 0.87 0.42 0.24 5.60 4.06 -1.10 -1.87 115.95 124.18 2ke0 h TRP 70 Ca 0.35 -0.08 -0.01 0.00 2.06 0.00 0.00 58.89 61.22 2ke0 h TRP 70 Cb 0.19 -0.11 -0.00 0.00 -1.00 0.00 0.00 29.16 28.24 2ke0 h TRP 70 CO -0.05 0.59 -0.15 0.22 -3.56 0.00 0.00 178.44 175.49 2ke0 h ASP 71 N 0.13 -0.38 -0.66 -3.49 3.58 -0.83 0.21 116.42 114.97 2ke0 h ASP 71 Ca 0.06 0.02 0.08 0.00 0.42 0.00 0.00 57.03 57.61 2ke0 h ASP 71 Cb 0.43 0.12 -0.06 0.00 1.72 0.00 0.00 39.33 41.53 2ke0 h ASP 71 CO 0.01 -0.25 0.32 -0.08 -2.88 0.00 0.00 179.24 176.37 2ke0 h GLU 72 N -0.39 0.56 0.16 0.28 4.57 -1.01 -0.23 114.58 118.52 2ke0 h GLU 72 Ca -0.02 -0.03 -0.01 0.00 -1.18 0.00 0.00 59.36 58.12 2ke0 h GLU 72 Cb 0.32 -0.13 0.00 0.00 -0.16 0.00 0.00 28.75 28.79 2ke0 h GLU 72 CO 0.02 0.37 -0.08 0.78 -1.18 0.00 0.00 179.01 178.92 2ke0 h GLY 73 N 0.57 -0.23 1.45 1.92 0.00 -1.06 -2.98 103.07 102.75 2ke0 h GLY 73 Ca 0.32 0.08 0.07 0.00 0.00 0.00 0.00 47.33 47.80 2ke0 h GLY 73 CO -0.24 -0.08 0.21 -2.08 0.00 0.00 0.00 176.54 174.34 2ke0 h VAL 74 N -0.55 0.69 0.00 4.60 2.07 -0.35 -1.70 116.25 121.01 2ke0 h VAL 74 Ca -0.02 0.00 -0.43 0.00 0.82 0.00 0.00 66.70 67.06 2ke0 h VAL 74 Cb 0.42 0.85 -0.01 0.00 -1.52 0.00 0.00 31.29 31.03 2ke0 h VAL 74 CO 0.04 0.00 2.01 0.00 0.02 0.00 0.00 177.57 179.63 2ke0 n GLN 75 N -4.18 2.77 0.00 1.57 6.02 -0.12 -3.52 117.38 119.92 2ke0 n GLN 75 Ca 0.03 -1.59 0.00 0.00 -0.01 0.00 0.00 57.00 55.43 2ke0 n GLN 75 Cb 0.35 -2.42 0.00 0.00 1.02 0.00 0.00 30.24 29.20 2ke0 n GLN 75 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2ke0 n GLY 76 N 3.17 1.04 3.56 1.08 0.00 -1.16 -4.99 105.19 107.89 2ke0 n GLY 76 Ca 0.59 -0.06 -0.41 0.00 0.00 0.00 0.00 46.02 46.14 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 0.00 1.07 -4.10 1.61 2.81 -0.65 -4.60 117.12 113.25 2ke0 n MET 77 Ca 0.00 0.39 -0.25 0.00 -1.81 0.00 0.00 57.70 56.02 2ke0 n MET 77 Cb 0.00 -1.87 -0.05 0.00 -0.71 0.00 0.00 33.22 30.59 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 -1.91 2.86 0.13 0.03 1.02 -1.26 -1.27 119.74 119.33 2ke0 s LYS 78 Ca 0.64 -0.94 -0.32 0.00 0.02 0.00 0.00 55.97 55.36 2ke0 s LYS 78 Cb -0.57 -2.59 -0.12 0.00 -0.52 0.00 0.00 37.83 34.03 2ke0 s LYS 78 CO 0.57 0.46 1.75 0.28 -0.92 0.00 0.00 175.35 177.49 2ke0 n VAL 79 N -0.53 0.22 -0.80 3.17 0.31 0.94 -0.81 118.33 120.83 2ke0 n VAL 79 Ca -0.08 -0.04 0.00 0.00 -0.01 0.00 0.00 64.34 64.21 2ke0 n VAL 79 Cb 0.56 -1.91 0.00 0.00 -0.91 0.00 0.00 33.84 31.57 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 3.98 0.90 3.85 2.92 0.00 0.91 -3.66 105.19 114.09 2ke0 n GLY 80 Ca 0.18 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.86 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 -1.80 2.41 -0.03 -0.02 0.00 0.01 -4.70 107.32 103.19 2ke0 s GLY 81 Ca 0.00 -0.08 0.06 0.00 0.00 0.00 0.00 44.72 44.70 2ke0 s GLY 81 CO 0.00 0.16 -0.22 0.14 0.00 0.00 0.00 173.10 173.18 2ke0 s VAL 82 N -1.68 2.41 0.00 1.40 1.01 -0.06 -1.56 120.40 121.92 2ke0 s VAL 82 Ca 0.45 -0.97 -0.02 0.00 0.00 0.00 0.00 61.98 61.44 2ke0 s VAL 82 Cb -0.13 -1.88 -0.01 0.00 0.00 0.00 0.00 36.38 34.36 2ke0 s VAL 82 CO 0.20 0.58 0.02 -0.60 0.00 0.00 0.00 175.10 175.30 2ke0 s ARG 83 N -0.60 0.24 -0.39 2.72 3.52 -0.09 -0.01 118.95 124.34 2ke0 s ARG 83 Ca 0.09 -0.33 -0.14 0.00 -0.13 0.00 0.00 55.73 55.22 2ke0 s ARG 83 Cb -0.11 0.09 0.01 0.00 -1.56 0.00 0.00 34.95 33.38 2ke0 s ARG 83 CO -0.00 -0.04 0.28 0.50 -0.81 0.00 0.00 175.30 175.23 2ke0 s ARG 84 N -0.90 3.14 -0.10 5.12 3.52 -0.45 -1.09 118.95 128.19 2ke0 s ARG 84 Ca -0.10 -0.89 -0.11 0.00 -0.13 0.00 0.00 55.73 54.50 2ke0 s ARG 84 Cb -0.06 -3.92 -0.05 0.00 -1.56 0.00 0.00 34.95 29.36 2ke0 s ARG 84 CO -0.00 -0.65 0.25 -1.17 -0.81 0.00 0.00 175.30 172.91 2ke0 s LEU 85 N 1.70 4.37 -0.20 -0.88 0.20 0.11 -0.83 118.68 123.16 2ke0 s LEU 85 Ca 0.06 0.60 0.01 0.00 0.69 0.00 0.00 54.13 55.48 2ke0 s LEU 85 Cb -0.18 -2.28 0.05 0.00 -0.43 0.00 0.00 46.19 43.34 2ke0 s LEU 85 CO 0.10 0.30 -0.09 -0.89 -0.29 0.00 0.00 176.35 175.49 2ke0 s THR 86 N -0.62 1.56 -0.10 3.68 2.01 0.13 -0.02 115.64 122.28 2ke0 s THR 86 Ca 0.17 -1.02 0.03 0.00 0.31 0.00 0.00 61.69 61.19 2ke0 s THR 86 Cb -0.13 -1.69 -0.01 0.00 0.01 0.00 0.00 72.50 70.68 2ke0 s THR 86 CO 0.06 0.10 -0.21 -0.63 -0.69 0.00 0.00 174.62 173.26 2ke0 s ILE 87 N 1.42 2.37 0.98 1.82 1.01 -0.47 -1.46 121.20 126.87 2ke0 s ILE 87 Ca -0.02 -0.92 -0.12 0.00 0.00 0.00 0.00 60.65 59.59 2ke0 s ILE 87 Cb -0.17 -1.93 0.18 0.00 0.01 0.00 0.00 42.46 40.55 2ke0 s ILE 87 CO -0.08 0.55 1.09 -2.16 0.00 0.00 0.00 174.94 174.35 2ke0 s PRO 88 N 0.22 0.60 0.25 2.79 0.04 -1.26 -1.12 135.00 136.51 2ke0 s PRO 88 Ca -0.13 0.58 0.02 0.00 0.04 0.00 0.00 61.00 61.51 2ke0 s PRO 88 Cb -0.16 -1.75 0.29 0.00 0.04 0.00 0.00 34.50 32.91 2ke0 s PRO 88 CO 0.07 -2.63 1.62 -1.00 0.04 0.00 0.00 177.00 175.09 2ke0 h PRO 89 N -1.82 0.41 -0.22 0.56 0.13 -1.89 -0.74 132.00 128.44 2ke0 h PRO 89 Ca -0.53 -0.22 -0.17 0.00 -0.87 0.00 0.00 66.00 64.21 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 0.78 -0.51 -0.56 -0.23 0.00 0.00 178.00 178.04 2ke0 h GLN 90 N 0.34 0.73 -0.67 0.86 3.07 -1.91 0.25 115.11 117.78 2ke0 h GLN 90 Ca 0.02 -0.50 -0.06 0.00 0.09 0.00 0.00 58.65 58.21 2ke0 h GLN 90 Cb 0.91 0.07 -0.03 0.00 0.08 0.00 0.00 27.48 28.51 2ke0 h GLN 90 CO 0.08 1.12 0.07 -0.11 0.09 0.00 0.00 178.83 180.08 2ke0 n LEU 91 N -4.12 5.38 0.00 0.06 7.94 -1.20 -4.20 117.00 120.86 2ke0 n LEU 91 Ca -0.06 -2.75 0.00 0.00 -1.11 0.00 0.00 56.01 52.09 2ke0 n LEU 91 Cb 0.60 -0.68 0.00 0.00 0.53 0.00 0.00 43.42 43.87 2ke0 n LEU 91 CO 0.48 0.64 0.00 0.61 -1.11 0.00 0.00 177.39 178.01 2ke0 n GLY 92 N 0.37 0.31 0.10 -3.96 0.00 -0.29 -4.72 105.19 97.01 2ke0 n GLY 92 Ca 0.28 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.19 2ke0 n GLY 92 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2ke0 n TYR 93 N -0.71 0.36 0.00 1.61 4.02 -1.10 -5.06 117.16 116.27 2ke0 n TYR 93 Ca 0.00 0.12 0.00 0.00 -0.01 0.00 0.00 57.90 58.01 2ke0 n TYR 93 Cb 0.00 -1.06 0.00 0.00 -0.02 0.00 0.00 39.34 38.26 2ke0 n TYR 93 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2ke0 n GLY 94 N 1.76 0.61 0.14 2.72 0.00 0.87 -4.43 105.19 106.86 2ke0 n GLY 94 Ca -0.30 -2.17 0.13 0.00 0.00 0.00 0.00 46.02 43.68 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 2.99 -0.10 4.61 0.00 -1.26 -4.04 120.51 121.71 2ke0 n ALA 95 Ca 0.00 -0.32 -0.14 0.00 0.00 0.00 0.00 53.44 52.98 2ke0 n ALA 95 Cb 0.00 -1.23 -0.09 0.00 0.00 0.00 0.00 19.45 18.14 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 -0.96 0.47 0.00 0.00 3.00 -1.26 -4.69 116.66 113.22 2ke0 n ARG 96 Ca 0.12 0.12 0.00 0.00 -0.01 0.00 0.00 57.85 58.07 2ke0 n ARG 96 Cb 0.32 -1.37 0.00 0.00 0.00 0.00 0.00 32.46 31.41 2ke0 n ARG 96 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2ke0 n GLY 97 N 2.51 -0.94 0.23 -0.13 0.00 -1.26 -3.77 105.19 101.83 2ke0 n GLY 97 Ca -0.34 -1.53 0.00 0.00 0.00 0.00 0.00 46.02 44.14 2ke0 n GLY 97 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ke0 n ALA 98 N 1.91 0.99 -2.05 4.61 0.00 -0.41 -4.88 120.51 120.68 2ke0 n ALA 98 Ca 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.35 2ke0 n ALA 98 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2ke0 n ALA 98 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ke0 n GLY 99 N 2.58 2.83 1.30 0.00 0.00 -1.26 -4.99 105.19 105.65 2ke0 n GLY 99 Ca 0.00 0.07 0.04 0.00 0.00 0.00 0.00 46.02 46.13 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 2.28 0.00 -0.02 0.00 -1.26 -3.97 105.19 102.22 2ke0 n GLY 100 Ca 0.00 -0.55 0.00 0.00 0.00 0.00 0.00 46.02 45.47 2ke0 n GLY 100 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2ke0 n VAL 101 N 0.41 0.00 -3.44 1.61 0.31 -1.26 -4.92 118.33 111.04 2ke0 n VAL 101 Ca 0.17 0.00 -0.26 0.00 -0.01 0.00 0.00 64.34 64.23 2ke0 n VAL 101 Cb 0.78 -0.48 -0.09 0.00 -0.91 0.00 0.00 33.84 33.15 2ke0 n VAL 101 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 2ke0 n ILE 102 N -2.30 0.44 -1.18 2.52 5.41 -1.26 -4.96 119.36 118.03 2ke0 n ILE 102 Ca 0.00 -4.36 -0.29 0.00 1.00 0.00 0.00 62.75 59.10 2ke0 n ILE 102 Cb 0.43 -1.97 0.16 0.00 -0.71 0.00 0.00 39.64 37.56 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 -1.27 0.72 0.75 0.38 0.04 -1.25 -1.29 135.00 133.07 2ke0 s PRO 103 Ca 0.34 0.63 -0.11 0.00 0.04 0.00 0.00 61.00 61.90 2ke0 s PRO 103 Cb 0.09 -1.76 0.05 0.00 0.04 0.00 0.00 34.50 32.92 2ke0 s PRO 103 CO -0.12 -2.56 1.09 -1.25 0.04 0.00 0.00 177.00 174.20 2ke0 s PRO 104 N -4.95 2.34 -1.93 0.56 0.04 -1.25 -3.41 135.00 126.40 2ke0 s PRO 104 Ca 0.65 1.21 0.00 0.00 0.04 0.00 0.00 61.00 62.90 2ke0 s PRO 104 Cb -0.18 -1.90 0.00 0.00 0.04 0.00 0.00 34.50 32.45 2ke0 s PRO 104 CO 0.57 -1.58 0.00 0.09 0.04 0.00 0.00 177.00 176.12 2ke0 n ASN 105 N -3.34 -5.45 -4.00 6.66 5.03 -1.26 -4.96 115.26 107.94 2ke0 n ASN 105 Ca 0.09 0.30 -0.30 0.00 0.87 0.00 0.00 54.58 55.54 2ke0 n ASN 105 Cb 0.53 -4.61 -0.16 0.00 -1.02 0.00 0.00 39.78 34.52 2ke0 n ASN 105 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2ke0 s ALA 106 N -2.82 1.89 0.31 5.41 0.00 -1.22 -4.96 121.76 120.37 2ke0 s ALA 106 Ca 0.00 -1.02 -0.29 0.00 0.00 0.00 0.00 51.96 50.65 2ke0 s ALA 106 Cb 0.00 -1.15 -0.10 0.00 0.00 0.00 0.00 23.12 21.87 2ke0 s ALA 106 CO 0.00 -0.59 1.23 0.99 0.00 0.00 0.00 175.76 177.40 2ke0 s THR 107 N 1.46 3.01 -0.05 0.00 2.01 -1.26 -3.75 115.64 117.05 2ke0 s THR 107 Ca 0.02 1.01 0.05 0.00 0.31 0.00 0.00 61.69 63.08 2ke0 s THR 107 Cb -0.14 -3.64 -0.02 0.00 0.01 0.00 0.00 72.50 68.70 2ke0 s THR 107 CO -0.09 0.24 -0.19 -1.48 -0.69 0.00 0.00 174.62 172.41 2ke0 s LEU 108 N -1.61 2.47 -0.16 4.42 2.34 -0.27 -3.96 118.68 121.90 2ke0 s LEU 108 Ca 0.48 -0.32 -0.04 0.00 0.06 0.00 0.00 54.13 54.30 2ke0 s LEU 108 Cb -0.37 -1.48 -0.03 0.00 -0.56 0.00 0.00 46.19 43.75 2ke0 s LEU 108 CO 0.48 0.30 -0.03 -0.69 -1.06 0.00 0.00 176.35 175.35 2ke0 s VAL 109 N -0.49 3.94 -0.08 1.48 1.01 -0.63 -1.37 120.40 124.27 2ke0 s VAL 109 Ca 0.06 -0.34 0.04 0.00 0.00 0.00 0.00 61.98 61.74 2ke0 s VAL 109 Cb -0.12 -2.73 0.00 0.00 0.00 0.00 0.00 36.38 33.53 2ke0 s VAL 109 CO 0.01 0.49 -0.21 -0.36 0.00 0.00 0.00 175.10 175.03 2ke0 s PHE 110 N 0.40 2.26 -0.28 5.22 0.08 0.97 0.02 117.98 126.65 2ke0 s PHE 110 Ca -0.03 -0.86 -0.14 0.00 0.12 0.00 0.00 56.93 56.02 2ke0 s PHE 110 Cb -0.14 -1.53 -0.04 0.00 -0.57 0.00 0.00 43.02 40.75 2ke0 s PHE 110 CO 0.03 -0.34 0.33 -2.00 -0.10 0.00 0.00 175.22 173.14 2ke0 s GLU 111 N 0.30 3.94 -0.26 0.44 2.12 0.10 0.10 118.70 125.42 2ke0 s GLU 111 Ca -0.14 -0.11 -0.09 0.00 0.36 0.00 0.00 54.97 54.99 2ke0 s GLU 111 Cb -0.16 -3.68 -0.04 0.00 0.26 0.00 0.00 34.13 30.51 2ke0 s GLU 111 CO 0.07 -0.29 0.13 0.08 -0.54 0.00 0.00 175.26 174.70 2ke0 s VAL 112 N 1.99 4.81 -0.17 3.70 1.01 -0.25 -0.83 120.40 130.66 2ke0 s VAL 112 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 61.98 62.11 2ke0 s VAL 112 Cb -0.16 -3.27 0.04 0.00 0.00 0.00 0.00 36.38 32.98 2ke0 s VAL 112 CO 0.10 0.30 -0.09 -0.70 0.00 0.00 0.00 175.10 174.71 2ke0 s GLU 113 N 1.68 1.85 0.09 2.72 2.12 -0.27 -0.91 118.70 125.99 2ke0 s GLU 113 Ca 0.07 -0.63 -0.30 0.00 0.36 0.00 0.00 54.97 54.47 2ke0 s GLU 113 Cb -0.16 -2.15 -0.06 0.00 0.26 0.00 0.00 34.13 32.03 2ke0 s GLU 113 CO 0.07 -0.38 1.05 -1.17 -0.54 0.00 0.00 175.26 174.30 2ke0 s LEU 114 N 1.52 4.44 -0.25 2.70 2.96 -0.60 -0.14 118.68 129.30 2ke0 s LEU 114 Ca 0.01 1.89 -0.14 0.00 -0.22 0.00 0.00 54.13 55.67 2ke0 s LEU 114 Cb -0.15 -3.59 -0.11 0.00 0.50 0.00 0.00 46.19 42.85 2ke0 s LEU 114 CO -0.09 -0.24 -0.34 0.18 -1.32 0.00 0.00 176.35 174.54 2ke0 n LEU 115 N 3.16 1.88 -3.61 -0.68 4.77 -0.46 -0.06 117.00 121.99 2ke0 n LEU 115 Ca 0.05 0.33 -0.03 0.00 -0.03 0.00 0.00 56.01 56.32 2ke0 n LEU 115 Cb 0.48 -0.78 -0.01 0.00 -2.33 0.00 0.00 43.42 40.78 2ke0 n LEU 115 CO 0.53 0.43 0.92 -1.81 -1.33 0.00 0.00 177.39 176.13 2ke0 s ASP 116 N -7.19 -0.16 0.00 -1.43 1.01 -1.23 -4.10 116.67 103.56 2ke0 s ASP 116 Ca -0.36 -0.11 0.25 0.00 0.71 0.00 0.00 52.55 53.04 2ke0 s ASP 116 Cb 0.13 0.25 0.34 0.00 1.01 0.00 0.00 42.92 44.65 2ke0 s ASP 116 CO 0.46 -0.44 1.34 1.33 0.21 0.00 0.00 175.17 178.08