#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 4.42 0.00 1.61 0.04 -1.26 -4.91 135.00 134.89 2ke0 s PRO 2 Ca 0.00 2.05 0.00 0.00 0.04 0.00 0.00 61.00 63.09 2ke0 s PRO 2 Cb 0.00 -3.17 0.00 0.00 0.04 0.00 0.00 34.50 31.37 2ke0 s PRO 2 CO 0.00 -0.17 0.00 0.41 0.04 0.00 0.00 177.00 177.28 2ke0 n GLY 3 N 1.88 1.93 3.71 0.56 0.00 -1.26 -5.08 105.19 106.94 2ke0 n GLY 3 Ca 0.04 -1.94 -0.43 0.00 0.00 0.00 0.00 46.02 43.69 2ke0 n GLY 3 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2ke0 n SER 4 N 0.00 3.79 -3.51 1.61 7.64 -1.26 -4.87 113.62 117.02 2ke0 n SER 4 Ca 0.00 1.08 -0.40 0.00 1.01 0.00 0.00 58.87 60.56 2ke0 n SER 4 Cb 0.00 -1.55 -0.01 0.00 -1.01 0.00 0.00 64.21 61.64 2ke0 n SER 4 CO 0.00 0.00 0.00 0.23 -3.01 0.00 0.00 175.04 172.26 2ke0 n MET 5 N 3.53 3.57 -2.77 1.43 2.81 -1.26 -4.95 117.12 119.48 2ke0 n MET 5 Ca 0.15 -2.63 -0.41 0.00 -1.81 0.00 0.00 57.70 53.00 2ke0 n MET 5 Cb 0.34 -2.94 -0.04 0.00 -0.71 0.00 0.00 33.22 29.87 2ke0 n MET 5 CO 0.00 0.00 0.00 0.99 1.51 0.00 0.00 175.97 178.47 2ke0 s THR 6 N 1.84 4.62 -0.05 2.03 2.01 -1.26 -5.05 115.64 119.77 2ke0 s THR 6 Ca 0.58 1.99 0.02 0.00 0.31 0.00 0.00 61.69 64.59 2ke0 s THR 6 Cb 0.16 -4.28 0.01 0.00 0.01 0.00 0.00 72.50 68.40 2ke0 s THR 6 CO -0.07 0.29 -0.10 0.54 -0.69 0.00 0.00 174.62 174.60 2ke0 s VAL 7 N 0.20 0.92 0.02 3.82 0.11 -1.26 -4.86 120.40 119.34 2ke0 s VAL 7 Ca 0.46 -0.37 0.05 0.00 -2.93 0.00 0.00 61.98 59.19 2ke0 s VAL 7 Cb -0.22 -0.85 -0.02 0.00 -1.53 0.00 0.00 36.38 33.76 2ke0 s VAL 7 CO 0.28 0.30 -0.16 0.54 -3.33 0.00 0.00 175.10 172.74 2ke0 s VAL 8 N 0.61 1.23 0.03 2.04 0.11 -1.26 -5.07 120.40 118.09 2ke0 s VAL 8 Ca -0.11 -0.87 0.06 0.00 -2.93 0.00 0.00 61.98 58.13 2ke0 s VAL 8 Cb -0.14 -1.07 -0.02 0.00 -1.53 0.00 0.00 36.38 33.62 2ke0 s VAL 8 CO 0.02 0.19 -0.18 0.42 -3.33 0.00 0.00 175.10 172.22 2ke0 s THR 9 N -0.61 1.46 0.19 5.04 -4.23 -1.26 -3.93 115.64 112.30 2ke0 s THR 9 Ca 0.04 -1.06 0.01 0.00 -1.18 0.00 0.00 61.69 59.50 2ke0 s THR 9 Cb -0.07 -1.27 0.01 0.00 1.34 0.00 0.00 72.50 72.51 2ke0 s THR 9 CO 0.00 0.18 0.08 0.35 -0.54 0.00 0.00 174.62 174.69 2ke0 n THR 10 N 2.01 0.00 0.32 3.99 -2.24 -1.23 -4.96 114.28 112.17 2ke0 n THR 10 Ca -0.17 -0.83 0.20 0.00 -2.27 0.00 0.00 64.05 60.98 2ke0 n THR 10 Cb 0.54 -0.09 1.10 0.00 -2.10 0.00 0.00 70.33 69.78 2ke0 n THR 10 CO 0.00 0.00 0.00 1.05 -0.57 0.00 0.00 175.07 175.55 2ke0 h GLU 11 N 0.00 0.00 0.12 -0.78 4.11 -2.01 -2.34 114.58 113.68 2ke0 h GLU 11 Ca -0.14 0.00 -0.25 0.00 0.07 0.00 0.00 59.36 59.04 2ke0 h GLU 11 Cb 0.46 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.72 2ke0 h GLU 11 CO 0.23 0.01 -1.25 0.66 0.07 0.00 0.00 179.01 178.72 2ke0 h SER 12 N 0.00 0.39 0.00 3.06 4.64 -1.98 -3.49 113.55 116.17 2ke0 h SER 12 Ca -0.00 -0.87 0.00 0.00 -0.47 0.00 0.00 61.79 60.45 2ke0 h SER 12 Cb 0.04 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 62.00 2ke0 h SER 12 CO 0.00 1.56 0.00 0.61 -0.87 0.00 0.00 176.83 178.13 2ke0 n GLY 13 N 1.71 0.99 3.27 -0.77 0.00 -0.88 -5.03 105.19 104.49 2ke0 n GLY 13 Ca -0.22 -0.09 -0.33 0.00 0.00 0.00 0.00 46.02 45.38 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 -2.28 -3.83 0.99 -0.00 -1.26 -4.52 117.00 106.09 2ke0 n LEU 14 Ca 0.00 -0.11 -0.12 0.00 -0.00 0.00 0.00 56.01 55.78 2ke0 n LEU 14 Cb 0.00 -0.95 -0.13 0.00 -0.00 0.00 0.00 43.42 42.35 2ke0 n LEU 14 CO 0.00 -3.08 -0.23 -0.54 -0.00 0.00 0.00 177.39 173.53 2ke0 s LYS 15 N -3.39 0.14 0.16 1.47 1.02 -0.54 -3.56 119.74 115.03 2ke0 s LYS 15 Ca 0.55 0.16 -0.00 0.00 0.02 0.00 0.00 55.97 56.70 2ke0 s LYS 15 Cb -0.11 0.07 -0.04 0.00 -0.52 0.00 0.00 37.83 37.22 2ke0 s LYS 15 CO 0.66 -0.02 0.06 1.52 -0.92 0.00 0.00 175.35 176.65 2ke0 s TYR 16 N 0.07 1.03 -0.09 3.18 1.13 -1.25 0.12 117.35 121.53 2ke0 s TYR 16 Ca -0.00 -1.20 -0.06 0.00 -1.41 0.00 0.00 57.07 54.40 2ke0 s TYR 16 Cb -0.01 -0.57 0.04 0.00 -1.10 0.00 0.00 41.96 40.32 2ke0 s TYR 16 CO 0.00 -0.45 0.23 -2.00 -2.51 0.00 0.00 175.55 170.82 2ke0 s GLU 17 N -4.03 0.21 0.37 -3.49 2.12 -0.26 -4.27 118.70 109.35 2ke0 s GLU 17 Ca 0.27 0.44 -0.26 0.00 0.36 0.00 0.00 54.97 55.78 2ke0 s GLU 17 Cb 0.07 -0.04 -0.12 0.00 0.26 0.00 0.00 34.13 34.30 2ke0 s GLU 17 CO 0.04 -0.12 1.09 -0.40 -0.54 0.00 0.00 175.26 175.33 2ke0 n ASP 18 N 3.80 1.68 -0.01 -1.70 5.75 -1.26 -1.17 116.55 123.64 2ke0 n ASP 18 Ca -0.21 1.12 -0.02 0.00 -0.01 0.00 0.00 54.79 55.67 2ke0 n ASP 18 Cb 0.55 -1.37 -0.02 0.00 -1.03 0.00 0.00 41.12 39.25 2ke0 n ASP 18 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 2ke0 n LEU 19 N 0.74 2.00 -3.40 -2.12 4.77 0.14 -4.73 117.00 114.39 2ke0 n LEU 19 Ca 0.08 -0.01 0.01 0.00 -0.03 0.00 0.00 56.01 56.06 2ke0 n LEU 19 Cb 0.37 -0.05 -0.03 0.00 -2.33 0.00 0.00 43.42 41.38 2ke0 n LEU 19 CO 0.59 0.38 0.19 -0.89 -1.33 0.00 0.00 177.39 176.34 2ke0 s THR 20 N -2.06 -0.97 0.10 -5.08 2.01 0.86 -4.93 115.64 105.57 2ke0 s THR 20 Ca -0.03 0.00 -0.31 0.00 0.31 0.00 0.00 61.69 61.66 2ke0 s THR 20 Cb 0.01 -0.98 -0.10 0.00 0.01 0.00 0.00 72.50 71.43 2ke0 s THR 20 CO 0.08 -0.00 1.87 1.21 -0.69 0.00 0.00 174.62 177.09 2ke0 n GLU 21 N 5.44 2.80 -0.83 4.92 4.07 -1.26 -1.25 120.64 134.52 2ke0 n GLU 21 Ca -0.06 1.02 -0.29 0.00 -0.06 0.00 0.00 57.16 57.77 2ke0 n GLU 21 Cb 0.50 -2.93 0.21 0.00 -0.06 0.00 0.00 31.44 29.16 2ke0 n GLU 21 CO 0.00 0.00 0.00 0.20 -0.06 0.00 0.00 177.13 177.27 2ke0 s GLY 22 N 3.16 1.56 -0.30 8.31 0.00 -1.26 -4.80 107.32 113.99 2ke0 s GLY 22 Ca 0.84 -0.20 0.20 0.00 0.00 0.00 0.00 44.72 45.56 2ke0 s GLY 22 CO 0.39 0.46 1.07 -1.14 0.00 0.00 0.00 173.10 173.88 2ke0 n SER 23 N -4.56 1.20 0.00 1.64 3.41 -1.15 -4.91 113.62 109.25 2ke0 n SER 23 Ca 0.04 -2.35 0.00 0.00 -0.26 0.00 0.00 58.87 56.30 2ke0 n SER 23 Cb 0.55 -0.37 0.00 0.00 -0.26 0.00 0.00 64.21 64.13 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 -0.41 2.76 3.10 5.00 0.00 -1.21 -4.98 105.19 109.45 2ke0 n GLY 24 Ca 0.06 -0.40 -0.17 0.00 0.00 0.00 0.00 46.02 45.52 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 -1.99 0.88 0.23 4.61 0.00 -1.26 -4.81 121.76 119.41 2ke0 s ALA 25 Ca 0.00 -0.75 -0.27 0.00 0.00 0.00 0.00 51.96 50.94 2ke0 s ALA 25 Cb 0.00 -0.09 -0.09 0.00 0.00 0.00 0.00 23.12 22.94 2ke0 s ALA 25 CO 0.00 0.12 0.88 -2.00 0.00 0.00 0.00 175.76 174.76 2ke0 s GLU 26 N -1.22 4.68 0.89 0.00 2.12 -1.26 -0.48 118.70 123.43 2ke0 s GLU 26 Ca -0.03 1.32 -0.12 0.00 0.36 0.00 0.00 54.97 56.51 2ke0 s GLU 26 Cb -0.08 -3.15 0.10 0.00 0.26 0.00 0.00 34.13 31.26 2ke0 s GLU 26 CO 0.01 0.48 0.96 0.00 -0.54 0.00 0.00 175.26 176.17 2ke0 n ALA 27 N 1.28 -1.08 -2.88 6.30 0.00 -0.54 -4.97 120.51 118.62 2ke0 n ALA 27 Ca -0.02 -0.50 -0.12 0.00 0.00 0.00 0.00 53.44 52.79 2ke0 n ALA 27 Cb 0.48 -2.10 -0.13 0.00 0.00 0.00 0.00 19.45 17.70 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 -4.20 0.19 0.16 0.00 0.52 -1.26 -4.59 118.95 109.77 2ke0 s ARG 28 Ca 0.66 -0.24 -0.31 0.00 -0.52 0.00 0.00 55.73 55.31 2ke0 s ARG 28 Cb -0.25 -0.07 -0.11 0.00 0.52 0.00 0.00 34.95 35.05 2ke0 s ARG 28 CO 0.59 0.01 1.76 0.00 0.02 0.00 0.00 175.30 177.67 2ke0 s ALA 29 N -0.49 3.84 0.00 2.13 0.00 -1.26 -1.42 121.76 124.56 2ke0 s ALA 29 Ca -0.04 1.50 0.00 0.00 0.00 0.00 0.00 51.96 53.41 2ke0 s ALA 29 Cb -0.04 -3.72 0.00 0.00 0.00 0.00 0.00 23.12 19.36 2ke0 s ALA 29 CO -0.00 -1.06 0.00 0.41 0.00 0.00 0.00 175.76 175.11 2ke0 n GLY 30 N 4.08 0.93 3.79 0.00 0.00 0.11 -4.94 105.19 109.15 2ke0 n GLY 30 Ca 0.17 0.00 -0.37 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 -0.66 4.03 -0.72 1.61 0.74 -0.50 -4.77 119.66 119.39 2ke0 s GLN 31 Ca 0.00 0.22 -0.25 0.00 0.05 0.00 0.00 55.36 55.38 2ke0 s GLN 31 Cb 0.00 -3.32 0.05 0.00 1.10 0.00 0.00 33.01 30.84 2ke0 s GLN 31 CO 0.00 0.47 1.14 0.99 -0.55 0.00 0.00 175.29 177.34 2ke0 s THR 32 N -0.28 4.01 0.24 -0.34 2.01 -1.26 -1.39 115.64 118.63 2ke0 s THR 32 Ca 0.20 -0.01 0.07 0.00 0.31 0.00 0.00 61.69 62.26 2ke0 s THR 32 Cb -0.14 -4.82 -0.04 0.00 0.01 0.00 0.00 72.50 67.51 2ke0 s THR 32 CO 0.08 -1.68 0.16 0.68 -0.69 0.00 0.00 174.62 173.17 2ke0 s VAL 33 N 4.91 4.34 -0.15 3.82 -7.23 -0.51 -4.80 120.40 120.79 2ke0 s VAL 33 Ca 0.30 -1.40 -0.02 0.00 -1.81 0.00 0.00 61.98 59.05 2ke0 s VAL 33 Cb -0.12 -3.32 -0.02 0.00 0.56 0.00 0.00 36.38 33.48 2ke0 s VAL 33 CO 0.12 -0.30 -0.07 -0.94 -0.31 0.00 0.00 175.10 173.59 2ke0 s SER 34 N -3.67 4.46 0.07 4.85 1.04 -0.45 -1.43 113.70 118.56 2ke0 s SER 34 Ca 0.32 -0.22 0.01 0.00 0.48 0.00 0.00 55.95 56.54 2ke0 s SER 34 Cb -0.08 -1.71 -0.04 0.00 0.10 0.00 0.00 66.02 64.29 2ke0 s SER 34 CO 0.24 0.16 -0.06 0.68 0.98 0.00 0.00 173.24 175.24 2ke0 s VAL 35 N 0.40 0.51 -0.06 5.02 -7.23 -0.46 -0.66 120.40 117.92 2ke0 s VAL 35 Ca -0.06 -1.60 0.02 0.00 -1.81 0.00 0.00 61.98 58.53 2ke0 s VAL 35 Cb -0.15 -1.25 -0.03 0.00 0.56 0.00 0.00 36.38 35.52 2ke0 s VAL 35 CO 0.04 -0.74 -0.11 -1.00 -0.31 0.00 0.00 175.10 172.98 2ke0 s HIS 36 N -2.92 2.80 -0.12 2.82 3.76 0.96 -0.14 115.29 122.46 2ke0 s HIS 36 Ca 0.03 -0.13 0.02 0.00 -0.15 0.00 0.00 55.06 54.82 2ke0 s HIS 36 Cb 0.01 -1.68 -0.01 0.00 1.11 0.00 0.00 32.58 32.01 2ke0 s HIS 36 CO -0.04 0.21 -0.18 1.52 -0.85 0.00 0.00 174.74 175.40 2ke0 s TYR 37 N -0.66 2.71 -0.31 1.40 1.13 -1.24 -0.80 117.35 119.58 2ke0 s TYR 37 Ca 0.10 -0.81 0.03 0.00 -1.41 0.00 0.00 57.07 54.98 2ke0 s TYR 37 Cb -0.11 -1.79 0.08 0.00 -1.10 0.00 0.00 41.96 39.04 2ke0 s TYR 37 CO 0.01 -0.30 -0.00 0.99 -2.51 0.00 0.00 175.55 173.74 2ke0 s THR 38 N 0.35 2.31 0.41 -3.49 2.01 -0.18 -3.26 115.64 113.78 2ke0 s THR 38 Ca -0.14 -2.06 -0.24 0.00 0.31 0.00 0.00 61.69 59.55 2ke0 s THR 38 Cb -0.17 -2.57 -0.08 0.00 0.01 0.00 0.00 72.50 69.69 2ke0 s THR 38 CO 0.07 -0.39 1.13 -0.83 -0.69 0.00 0.00 174.62 173.91 2ke0 s GLY 39 N 1.02 2.82 -0.12 4.40 0.00 0.87 -0.61 107.32 115.69 2ke0 s GLY 39 Ca 0.03 0.87 -0.09 0.00 0.00 0.00 0.00 44.72 45.54 2ke0 s GLY 39 CO -0.07 1.35 0.31 -0.98 0.00 0.00 0.00 173.10 173.71 2ke0 s TRP 40 N -1.51 -0.38 0.87 1.90 0.51 0.12 -3.24 118.94 117.22 2ke0 s TRP 40 Ca 0.58 0.89 -0.13 0.00 -2.12 0.00 0.00 56.10 55.32 2ke0 s TRP 40 Cb -0.28 0.12 0.12 0.00 -0.81 0.00 0.00 33.47 32.63 2ke0 s TRP 40 CO 0.34 -0.22 1.19 -0.51 -0.51 0.00 0.00 176.95 177.25 2ke0 s LEU 41 N 0.73 2.38 0.62 2.99 1.43 0.86 -1.49 118.68 126.20 2ke0 s LEU 41 Ca -0.05 0.73 0.34 0.00 -1.03 0.00 0.00 54.13 54.12 2ke0 s LEU 41 Cb -0.06 -3.08 1.90 0.00 0.03 0.00 0.00 46.19 44.98 2ke0 s LEU 41 CO -0.05 -2.26 2.18 0.71 0.23 0.00 0.00 176.35 177.16 2ke0 h THR 42 N -1.30 0.28 0.00 5.49 1.35 -1.90 0.15 112.91 116.97 2ke0 h THR 42 Ca -0.47 0.00 -0.01 0.00 -0.55 0.00 0.00 66.41 65.38 2ke0 h THR 42 Cb 1.31 0.89 -0.00 0.00 -1.73 0.00 0.00 68.15 68.62 2ke0 h THR 42 CO 0.59 0.00 -1.12 0.47 -0.25 0.00 0.00 175.52 175.22 2ke0 n ASP 43 N -3.48 0.77 0.00 5.36 9.92 -1.26 -4.95 116.55 122.91 2ke0 n ASP 43 Ca -0.01 0.30 0.00 0.00 -0.53 0.00 0.00 54.79 54.55 2ke0 n ASP 43 Cb 0.22 0.57 0.00 0.00 -0.64 0.00 0.00 41.12 41.27 2ke0 n ASP 43 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2ke0 n GLY 44 N 1.20 1.11 3.69 0.44 0.00 0.51 -5.09 105.19 107.05 2ke0 n GLY 44 Ca -0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.59 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 -0.40 4.39 -0.43 1.61 2.00 -1.26 -4.61 119.66 120.97 2ke0 s GLN 45 Ca 0.00 1.63 -0.29 0.00 -2.00 0.00 0.00 55.36 54.70 2ke0 s GLN 45 Cb 0.00 -3.51 0.02 0.00 0.80 0.00 0.00 33.01 30.32 2ke0 s GLN 45 CO 0.00 -0.36 1.23 0.21 -0.50 0.00 0.00 175.29 175.87 2ke0 s LYS 46 N 1.88 3.73 -0.04 1.67 2.20 -1.26 -0.10 119.74 127.82 2ke0 s LYS 46 Ca 0.55 0.78 0.21 0.00 -0.36 0.00 0.00 55.97 57.16 2ke0 s LYS 46 Cb -0.24 -3.92 -0.31 0.00 -1.51 0.00 0.00 37.83 31.84 2ke0 s LYS 46 CO 0.23 -1.37 0.46 1.97 -0.36 0.00 0.00 175.35 176.28 2ke0 n PHE 47 N 8.03 0.05 -4.07 4.03 1.16 -1.20 -4.93 117.46 120.54 2ke0 n PHE 47 Ca 0.14 0.02 -0.17 0.00 -1.87 0.00 0.00 57.45 55.56 2ke0 n PHE 47 Cb 0.48 -0.59 -0.16 0.00 -1.61 0.00 0.00 39.48 37.61 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 -4.69 0.60 -0.27 5.98 1.01 -1.25 -4.99 116.67 113.06 2ke0 s ASP 48 Ca -0.08 -0.07 -0.00 0.00 0.71 0.00 0.00 52.55 53.11 2ke0 s ASP 48 Cb 0.13 -0.23 0.15 0.00 1.01 0.00 0.00 42.92 43.98 2ke0 s ASP 48 CO 0.89 -0.03 0.40 -0.94 0.21 0.00 0.00 175.17 175.70 2ke0 s SER 49 N 0.60 0.31 0.02 0.27 1.04 -1.26 -0.09 113.70 114.58 2ke0 s SER 49 Ca -0.07 -0.10 -0.22 0.00 0.48 0.00 0.00 55.95 56.05 2ke0 s SER 49 Cb -0.10 1.13 -0.16 0.00 0.10 0.00 0.00 66.02 66.99 2ke0 s SER 49 CO -0.01 -0.33 1.33 0.77 0.98 0.00 0.00 173.24 175.99 2ke0 h SER 50 N 8.17 0.28 -0.28 7.02 4.64 -1.83 -2.96 113.55 128.58 2ke0 h SER 50 Ca -0.14 -0.47 0.08 0.00 -0.47 0.00 0.00 61.79 60.79 2ke0 h SER 50 Cb 1.13 -0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 63.14 2ke0 h SER 50 CO 0.27 0.69 0.29 0.07 -0.87 0.00 0.00 176.83 177.28 2ke0 h LYS 51 N -0.14 0.00 -0.18 4.77 5.09 -1.84 0.75 116.57 125.02 2ke0 h LYS 51 Ca 0.02 0.00 0.05 0.00 0.09 0.00 0.00 60.65 60.81 2ke0 h LYS 51 Cb 0.61 0.00 -0.01 0.00 0.10 0.00 0.00 32.23 32.93 2ke0 h LYS 51 CO 0.03 0.00 0.19 0.22 -2.09 0.00 0.00 179.45 177.80 2ke0 h ASP 52 N 0.00 0.00 0.00 7.07 3.58 -1.92 -1.55 116.42 123.59 2ke0 h ASP 52 Ca 0.13 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.58 2ke0 h ASP 52 Cb 0.70 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.75 2ke0 h ASP 52 CO -0.00 0.00 -0.12 -1.14 -2.88 0.00 0.00 179.24 175.09 2ke0 n ARG 53 N -3.87 1.13 -3.74 0.28 3.00 0.15 -4.99 116.66 108.62 2ke0 n ARG 53 Ca 0.02 -1.88 -0.26 0.00 -0.00 0.00 0.00 57.85 55.73 2ke0 n ARG 53 Cb 0.32 -1.11 0.05 0.00 0.00 0.00 0.00 32.46 31.72 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 -0.84 -4.34 -3.84 6.15 4.13 -0.59 -4.93 115.26 111.00 2ke0 n ASN 54 Ca 0.09 -0.70 -0.33 0.00 1.68 0.00 0.00 54.58 55.31 2ke0 n ASN 54 Cb 0.59 -4.37 -0.07 0.00 -1.54 0.00 0.00 39.78 34.40 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 -2.96 4.26 -4.68 6.41 2.03 -0.56 -4.98 116.55 116.07 2ke0 n ASP 55 Ca -0.06 -3.30 -0.42 0.00 0.52 0.00 0.00 54.79 51.53 2ke0 n ASP 55 Cb 0.58 -0.92 -0.03 0.00 -0.72 0.00 0.00 41.12 40.03 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 -2.00 4.26 -0.68 -0.67 0.04 -1.26 -4.58 135.00 130.11 2ke0 s PRO 56 Ca 0.32 2.02 -0.26 0.00 0.04 0.00 0.00 61.00 63.12 2ke0 s PRO 56 Cb 0.03 -3.63 -0.03 0.00 0.04 0.00 0.00 34.50 30.91 2ke0 s PRO 56 CO -0.06 -0.63 1.87 0.12 0.04 0.00 0.00 177.00 178.34 2ke0 s PHE 57 N 2.67 1.70 -0.20 0.56 2.19 0.81 -4.77 117.98 120.95 2ke0 s PHE 57 Ca 0.66 0.73 -0.07 0.00 0.33 0.00 0.00 56.93 58.58 2ke0 s PHE 57 Cb -0.32 -4.09 -0.04 0.00 -1.31 0.00 0.00 43.02 37.26 2ke0 s PHE 57 CO 0.27 -2.18 0.06 0.00 1.83 0.00 0.00 175.22 175.20 2ke0 s ALA 58 N 9.24 3.30 0.25 11.12 0.00 -1.26 -1.36 121.76 143.06 2ke0 s ALA 58 Ca 0.67 -0.86 -0.20 0.00 0.00 0.00 0.00 51.96 51.58 2ke0 s ALA 58 Cb -0.11 -1.93 0.03 0.00 0.00 0.00 0.00 23.12 21.10 2ke0 s ALA 58 CO 0.16 -0.00 0.65 -0.59 0.00 0.00 0.00 175.76 175.97 2ke0 s PHE 59 N 0.71 -0.17 -0.17 0.00 -0.71 -0.52 -4.96 117.98 112.17 2ke0 s PHE 59 Ca 0.03 -0.23 -0.25 0.00 -1.04 0.00 0.00 56.93 55.43 2ke0 s PHE 59 Cb -0.13 0.59 -0.01 0.00 -1.21 0.00 0.00 43.02 42.25 2ke0 s PHE 59 CO 0.02 -1.11 0.84 0.14 -1.34 0.00 0.00 175.22 173.77 2ke0 s VAL 60 N -3.90 4.87 -0.35 -2.49 -7.23 -1.26 -1.42 120.40 108.62 2ke0 s VAL 60 Ca 0.11 1.65 -0.28 0.00 -1.81 0.00 0.00 61.98 61.65 2ke0 s VAL 60 Cb -0.04 -4.15 -0.07 0.00 0.56 0.00 0.00 36.38 32.68 2ke0 s VAL 60 CO 0.03 0.02 2.31 -0.11 -0.31 0.00 0.00 175.10 177.04 2ke0 n LEU 61 N 5.25 2.72 0.00 1.32 0.00 -0.49 -3.37 117.00 122.43 2ke0 n LEU 61 Ca 0.05 -0.03 0.00 0.00 0.00 0.00 0.00 56.01 56.02 2ke0 n LEU 61 Cb 0.49 -1.52 0.00 0.00 0.00 0.00 0.00 43.42 42.39 2ke0 n LEU 61 CO 0.48 -1.01 0.00 0.61 0.00 0.00 0.00 177.39 177.47 2ke0 n GLY 62 N 5.97 1.07 0.00 -3.96 0.00 -1.26 0.06 105.19 107.07 2ke0 n GLY 62 Ca 0.35 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.35 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 2.02 1.08 -0.02 0.00 -1.22 -5.09 105.19 101.96 2ke0 n GLY 63 Ca 0.00 0.24 0.00 0.00 0.00 0.00 0.00 46.02 46.26 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 0.00 -1.74 2.72 -0.02 0.00 -1.26 -4.90 105.19 99.99 2ke0 n GLY 64 Ca 0.00 0.52 -0.07 0.00 0.00 0.00 0.00 46.02 46.47 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 -2.86 0.73 -2.87 1.61 -0.00 -1.26 -5.15 117.12 107.32 2ke0 n MET 65 Ca 0.00 -1.56 -0.08 0.00 -0.00 0.00 0.00 57.70 56.06 2ke0 n MET 65 Cb 0.00 -0.91 -0.03 0.00 -0.00 0.00 0.00 33.22 32.28 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 0.79 0.00 -4.47 3.17 0.24 -1.26 -5.16 118.33 111.64 2ke0 n VAL 66 Ca 0.04 -0.98 -0.25 0.00 -2.04 0.00 0.00 64.34 61.11 2ke0 n VAL 66 Cb 0.69 0.53 -0.10 0.00 -1.47 0.00 0.00 33.84 33.49 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 -2.61 2.38 0.28 1.34 -0.00 -1.26 -5.01 121.20 116.33 2ke0 s ILE 67 Ca 0.16 -2.14 0.02 0.00 -0.00 0.00 0.00 60.65 58.69 2ke0 s ILE 67 Cb 0.00 -2.69 0.29 0.00 -0.00 0.00 0.00 42.46 40.07 2ke0 s ILE 67 CO 0.11 -0.21 1.67 0.11 -0.00 0.00 0.00 174.94 176.62 2ke0 h LYS 68 N 1.96 0.27 -0.73 0.37 6.56 -1.99 0.16 116.57 123.17 2ke0 h LYS 68 Ca -0.42 -0.02 0.04 0.00 -1.06 0.00 0.00 60.65 59.19 2ke0 h LYS 68 Cb 1.25 -0.06 -0.05 0.00 -0.57 0.00 0.00 32.23 32.80 2ke0 h LYS 68 CO 0.69 0.18 0.45 0.78 -2.06 0.00 0.00 179.45 179.49 2ke0 h GLY 69 N 0.28 1.06 1.13 3.86 0.00 -1.95 0.75 103.07 108.19 2ke0 h GLY 69 Ca 0.54 -0.34 -0.08 0.00 0.00 0.00 0.00 47.33 47.44 2ke0 h GLY 69 CO -0.59 0.28 0.06 1.49 0.00 0.00 0.00 176.54 177.77 2ke0 h TRP 70 N 0.88 1.13 -0.01 5.60 4.06 -1.13 -1.78 115.95 124.70 2ke0 h TRP 70 Ca 0.30 -0.17 -0.00 0.00 2.06 0.00 0.00 58.89 61.08 2ke0 h TRP 70 Cb 0.05 -0.30 -0.00 0.00 -1.00 0.00 0.00 29.16 27.90 2ke0 h TRP 70 CO -0.04 0.97 -0.00 0.22 -3.56 0.00 0.00 178.44 176.02 2ke0 h ASP 71 N 0.98 0.02 -0.79 -3.49 3.58 -0.72 0.32 116.42 116.31 2ke0 h ASP 71 Ca 0.19 -0.38 0.06 0.00 0.42 0.00 0.00 57.03 57.32 2ke0 h ASP 71 Cb 0.48 -0.00 -0.05 0.00 1.72 0.00 0.00 39.33 41.48 2ke0 h ASP 71 CO 0.02 0.39 0.51 -0.08 -2.88 0.00 0.00 179.24 177.21 2ke0 h GLU 72 N -0.36 0.84 0.16 0.28 4.57 -0.82 0.24 114.58 119.49 2ke0 h GLU 72 Ca 0.00 -0.05 -0.01 0.00 -1.18 0.00 0.00 59.36 58.12 2ke0 h GLU 72 Cb 0.38 -0.19 0.00 0.00 -0.16 0.00 0.00 28.75 28.79 2ke0 h GLU 72 CO 0.00 0.55 -0.08 0.78 -1.18 0.00 0.00 179.01 179.08 2ke0 h GLY 73 N 0.86 -0.23 1.32 1.92 0.00 -1.24 -3.27 103.07 102.43 2ke0 h GLY 73 Ca 0.34 0.09 0.08 0.00 0.00 0.00 0.00 47.33 47.83 2ke0 h GLY 73 CO -0.11 -0.08 0.26 -0.24 0.00 0.00 0.00 176.54 176.36 2ke0 h VAL 74 N -0.98 0.54 0.00 4.60 3.04 -0.83 -1.86 116.25 120.76 2ke0 h VAL 74 Ca -0.02 0.00 -0.45 0.00 -1.01 0.00 0.00 66.70 65.22 2ke0 h VAL 74 Cb 0.42 0.80 -0.00 0.00 -2.01 0.00 0.00 31.29 30.49 2ke0 h VAL 74 CO 0.04 0.00 2.20 0.00 -1.01 0.00 0.00 177.57 178.80 2ke0 n GLN 75 N -3.94 2.77 0.00 4.17 6.02 0.06 -3.59 117.38 122.87 2ke0 n GLN 75 Ca 0.04 -1.62 0.00 0.00 -0.01 0.00 0.00 57.00 55.41 2ke0 n GLN 75 Cb 0.41 -2.44 0.00 0.00 1.02 0.00 0.00 30.24 29.23 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 3.25 1.86 3.49 1.08 0.00 -1.16 -4.97 105.19 108.73 2ke0 n GLY 76 Ca 0.59 -0.17 -0.36 0.00 0.00 0.00 0.00 46.02 46.08 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 0.30 -4.15 1.61 2.81 -0.71 -4.51 117.12 112.48 2ke0 n MET 77 Ca 0.00 0.15 -0.24 0.00 -1.81 0.00 0.00 57.70 55.80 2ke0 n MET 77 Cb 0.00 -1.90 -0.07 0.00 -0.71 0.00 0.00 33.22 30.54 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 -2.91 2.30 0.14 0.03 1.02 -1.26 -1.47 119.74 117.58 2ke0 s LYS 78 Ca 0.66 -1.62 -0.32 0.00 0.02 0.00 0.00 55.97 54.72 2ke0 s LYS 78 Cb -0.34 -2.10 -0.11 0.00 -0.52 0.00 0.00 37.83 34.75 2ke0 s LYS 78 CO 0.57 0.09 1.80 0.28 -0.92 0.00 0.00 175.35 177.17 2ke0 n VAL 79 N -1.12 0.26 -0.72 3.17 0.31 0.37 -0.97 118.33 119.62 2ke0 n VAL 79 Ca -0.03 -0.05 0.00 0.00 -0.01 0.00 0.00 64.34 64.25 2ke0 n VAL 79 Cb 0.62 -2.06 0.00 0.00 -0.91 0.00 0.00 33.84 31.49 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 4.14 1.01 3.76 2.92 0.00 0.91 -2.92 105.19 114.99 2ke0 n GLY 80 Ca 0.18 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.80 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 3.06 -0.08 -0.02 0.00 -0.15 -4.64 107.32 103.69 2ke0 s GLY 81 Ca 0.00 0.64 0.04 0.00 0.00 0.00 0.00 44.72 45.39 2ke0 s GLY 81 CO 0.00 1.19 -0.20 0.14 0.00 0.00 0.00 173.10 174.23 2ke0 s VAL 82 N -1.25 2.47 -0.02 1.40 1.01 -0.38 -1.47 120.40 122.15 2ke0 s VAL 82 Ca 0.43 -0.90 -0.01 0.00 0.00 0.00 0.00 61.98 61.50 2ke0 s VAL 82 Cb -0.25 -1.96 0.01 0.00 0.00 0.00 0.00 36.38 34.18 2ke0 s VAL 82 CO 0.32 0.56 0.05 -0.60 0.00 0.00 0.00 175.10 175.43 2ke0 s ARG 83 N -0.02 0.04 -0.52 2.72 3.52 -0.54 -0.10 118.95 124.05 2ke0 s ARG 83 Ca -0.06 0.11 -0.21 0.00 -0.13 0.00 0.00 55.73 55.44 2ke0 s ARG 83 Cb -0.15 -0.03 0.05 0.00 -1.56 0.00 0.00 34.95 33.26 2ke0 s ARG 83 CO 0.05 -0.05 0.73 0.50 -0.81 0.00 0.00 175.30 175.73 2ke0 s ARG 84 N 0.29 3.20 -0.03 5.12 3.52 -0.32 -1.24 118.95 129.50 2ke0 s ARG 84 Ca -0.02 -0.65 -0.16 0.00 -0.13 0.00 0.00 55.73 54.77 2ke0 s ARG 84 Cb -0.03 -4.08 -0.05 0.00 -1.56 0.00 0.00 34.95 29.23 2ke0 s ARG 84 CO -0.01 -1.30 0.42 -1.17 -0.81 0.00 0.00 175.30 172.43 2ke0 s LEU 85 N 3.09 4.43 -0.22 -0.88 2.96 0.45 -1.10 118.68 127.41 2ke0 s LEU 85 Ca 0.21 0.92 0.01 0.00 -0.22 0.00 0.00 54.13 55.05 2ke0 s LEU 85 Cb -0.17 -2.61 0.05 0.00 0.50 0.00 0.00 46.19 43.97 2ke0 s LEU 85 CO 0.15 0.25 -0.10 -0.89 -1.32 0.00 0.00 176.35 174.44 2ke0 s THR 86 N -0.67 1.78 -0.12 3.68 2.01 0.12 0.06 115.64 122.50 2ke0 s THR 86 Ca 0.24 -1.22 -0.00 0.00 0.31 0.00 0.00 61.69 61.01 2ke0 s THR 86 Cb -0.16 -1.90 -0.02 0.00 0.01 0.00 0.00 72.50 70.43 2ke0 s THR 86 CO 0.12 0.07 -0.12 -0.63 -0.69 0.00 0.00 174.62 173.37 2ke0 s ILE 87 N 1.31 3.12 0.98 1.82 1.01 -0.35 -1.47 121.20 127.62 2ke0 s ILE 87 Ca -0.04 -0.65 -0.12 0.00 0.00 0.00 0.00 60.65 59.84 2ke0 s ILE 87 Cb -0.18 -2.30 0.18 0.00 0.01 0.00 0.00 42.46 40.17 2ke0 s ILE 87 CO -0.07 0.53 1.09 -2.16 0.00 0.00 0.00 174.94 174.33 2ke0 s PRO 88 N 0.23 0.57 0.29 2.79 0.04 -1.26 -1.13 135.00 136.53 2ke0 s PRO 88 Ca -0.08 0.58 0.08 0.00 0.04 0.00 0.00 61.00 61.62 2ke0 s PRO 88 Cb -0.15 -1.75 0.45 0.00 0.04 0.00 0.00 34.50 33.09 2ke0 s PRO 88 CO 0.05 -2.65 1.68 -1.00 0.04 0.00 0.00 177.00 175.12 2ke0 h PRO 89 N -1.84 0.16 -0.08 0.56 0.13 -1.90 -0.71 132.00 128.33 2ke0 h PRO 89 Ca -0.54 -0.08 -0.19 0.00 -0.87 0.00 0.00 66.00 64.32 2ke0 h PRO 89 Cb 1.32 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.46 2ke0 h PRO 89 CO 0.57 0.60 -0.68 -0.56 -0.23 0.00 0.00 178.00 177.70 2ke0 h GLN 90 N 0.13 0.60 -0.66 0.86 3.07 -1.91 0.23 115.11 117.43 2ke0 h GLN 90 Ca 0.01 -0.54 0.00 0.00 0.09 0.00 0.00 58.65 58.21 2ke0 h GLN 90 Cb 0.88 0.13 0.00 0.00 0.08 0.00 0.00 27.48 28.57 2ke0 h GLN 90 CO 0.07 1.16 0.00 1.28 0.09 0.00 0.00 178.83 181.43 2ke0 n LEU 91 N -4.10 4.68 0.00 0.06 4.77 -1.20 -4.38 117.00 116.84 2ke0 n LEU 91 Ca -0.09 -2.37 0.00 0.00 -0.03 0.00 0.00 56.01 53.52 2ke0 n LEU 91 Cb 0.70 -0.63 0.00 0.00 -2.33 0.00 0.00 43.42 41.16 2ke0 n LEU 91 CO 0.50 0.58 0.00 0.61 -1.33 0.00 0.00 177.39 177.75 2ke0 n GLY 92 N 0.60 0.87 0.10 -0.72 0.00 -0.28 -4.74 105.19 101.04 2ke0 n GLY 92 Ca 0.22 -0.01 -0.14 0.00 0.00 0.00 0.00 46.02 46.09 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 0.29 0.00 1.61 -1.99 -1.76 -3.50 116.97 111.61 2ke0 h TYR 93 Ca 0.00 -0.21 0.00 0.00 2.00 0.00 0.00 58.73 60.52 2ke0 h TYR 93 Cb 0.00 -0.01 0.00 0.00 2.00 0.00 0.00 36.73 38.72 2ke0 h TYR 93 CO 0.00 1.31 0.00 0.41 -0.00 0.00 0.00 178.16 179.88 2ke0 n GLY 94 N 1.67 0.44 0.22 3.88 0.00 0.81 -4.46 105.19 107.76 2ke0 n GLY 94 Ca -0.18 -2.23 0.14 0.00 0.00 0.00 0.00 46.02 43.75 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 2.63 -0.09 4.61 0.00 -1.26 -3.84 120.51 121.56 2ke0 n ALA 95 Ca 0.00 -0.31 -0.14 0.00 0.00 0.00 0.00 53.44 52.99 2ke0 n ALA 95 Cb 0.00 -1.33 -0.08 0.00 0.00 0.00 0.00 19.45 18.04 2ke0 n ALA 95 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 2ke0 n ARG 96 N -0.44 0.42 0.00 0.00 3.00 -1.26 -4.69 116.66 113.68 2ke0 n ARG 96 Ca 0.21 0.12 0.00 0.00 -0.00 0.00 0.00 57.85 58.17 2ke0 n ARG 96 Cb 0.21 -1.29 0.00 0.00 0.00 0.00 0.00 32.46 31.38 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 2.49 -1.61 0.32 5.14 0.00 -1.25 -4.00 105.19 106.29 2ke0 n GLY 97 Ca -0.32 -1.48 0.00 0.00 0.00 0.00 0.00 46.02 44.23 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 1.50 1.28 -2.21 4.61 0.00 -0.39 -4.91 120.51 120.39 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 2.70 3.39 0.88 0.00 0.00 -1.26 -4.98 105.19 105.92 2ke0 n GLY 99 Ca 0.00 -0.12 0.05 0.00 0.00 0.00 0.00 46.02 45.94 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 1.31 0.01 -0.02 0.00 -1.26 -3.81 105.19 101.42 2ke0 n GLY 100 Ca 0.00 -0.41 -0.01 0.00 0.00 0.00 0.00 46.02 45.60 2ke0 n GLY 100 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2ke0 n VAL 101 N 0.45 0.12 -3.28 1.61 0.24 -1.26 -4.88 118.33 111.33 2ke0 n VAL 101 Ca 0.13 -0.08 -0.25 0.00 -2.04 0.00 0.00 64.34 62.09 2ke0 n VAL 101 Cb 0.47 -0.74 -0.08 0.00 -1.47 0.00 0.00 33.84 32.02 2ke0 n VAL 101 CO 0.00 0.00 0.00 -0.38 -2.14 0.00 0.00 176.83 174.31 2ke0 n ILE 102 N -2.00 -0.86 -1.18 1.34 5.41 -1.25 -4.85 119.36 115.98 2ke0 n ILE 102 Ca -0.03 -3.79 -0.29 0.00 1.00 0.00 0.00 62.75 59.64 2ke0 n ILE 102 Cb 0.49 -1.84 0.16 0.00 -0.71 0.00 0.00 39.64 37.75 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 -0.68 0.70 0.59 0.38 0.04 -1.25 -1.26 135.00 133.51 2ke0 s PRO 103 Ca 0.34 0.62 -0.18 0.00 0.04 0.00 0.00 61.00 61.83 2ke0 s PRO 103 Cb 0.11 -1.76 -0.04 0.00 0.04 0.00 0.00 34.50 32.86 2ke0 s PRO 103 CO -0.15 -2.58 1.12 -1.25 0.04 0.00 0.00 177.00 174.19 2ke0 s PRO 104 N -4.95 3.14 -1.53 0.56 0.04 -1.26 -3.37 135.00 127.63 2ke0 s PRO 104 Ca 0.65 1.52 0.00 0.00 0.04 0.00 0.00 61.00 63.21 2ke0 s PRO 104 Cb -0.18 -1.98 0.00 0.00 0.04 0.00 0.00 34.50 32.37 2ke0 s PRO 104 CO 0.57 -1.01 0.00 0.09 0.04 0.00 0.00 177.00 176.70 2ke0 n ASN 105 N -1.74 -5.20 -3.93 6.66 3.02 -1.26 -4.99 115.26 107.82 2ke0 n ASN 105 Ca 0.11 -0.01 -0.27 0.00 -0.03 0.00 0.00 54.58 54.39 2ke0 n ASN 105 Cb 0.51 -4.27 -0.17 0.00 -0.61 0.00 0.00 39.78 35.24 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 -2.88 1.35 0.34 5.41 0.00 -1.22 -4.98 121.76 119.79 2ke0 s ALA 106 Ca 0.00 -0.55 -0.28 0.00 0.00 0.00 0.00 51.96 51.13 2ke0 s ALA 106 Cb 0.00 -0.87 -0.10 0.00 0.00 0.00 0.00 23.12 22.15 2ke0 s ALA 106 CO 0.00 -0.34 1.22 0.99 0.00 0.00 0.00 175.76 177.64 2ke0 s THR 107 N 1.54 3.01 -0.06 0.00 2.01 -1.26 -3.81 115.64 117.06 2ke0 s THR 107 Ca 0.02 0.97 0.06 0.00 0.31 0.00 0.00 61.69 63.05 2ke0 s THR 107 Cb -0.13 -3.60 -0.01 0.00 0.01 0.00 0.00 72.50 68.77 2ke0 s THR 107 CO -0.07 0.20 -0.25 -1.48 -0.69 0.00 0.00 174.62 172.33 2ke0 s LEU 108 N -1.90 2.09 -0.13 4.42 0.05 -0.28 -3.86 118.68 119.06 2ke0 s LEU 108 Ca 0.50 -0.51 -0.04 0.00 0.05 0.00 0.00 54.13 54.14 2ke0 s LEU 108 Cb -0.36 -1.38 -0.03 0.00 -2.05 0.00 0.00 46.19 42.37 2ke0 s LEU 108 CO 0.46 0.24 0.00 -0.69 -0.55 0.00 0.00 176.35 175.82 2ke0 s VAL 109 N -0.15 4.29 -0.08 1.48 1.01 -0.56 -1.21 120.40 125.19 2ke0 s VAL 109 Ca -0.04 -0.23 0.04 0.00 0.00 0.00 0.00 61.98 61.75 2ke0 s VAL 109 Cb -0.14 -2.86 0.00 0.00 0.00 0.00 0.00 36.38 33.38 2ke0 s VAL 109 CO 0.04 0.54 -0.20 -0.36 0.00 0.00 0.00 175.10 175.12 2ke0 s PHE 110 N -0.19 2.09 -0.33 5.22 0.08 0.11 0.16 117.98 125.11 2ke0 s PHE 110 Ca 0.05 -0.77 -0.16 0.00 0.12 0.00 0.00 56.93 56.18 2ke0 s PHE 110 Cb -0.12 -1.42 -0.02 0.00 -0.57 0.00 0.00 43.02 40.89 2ke0 s PHE 110 CO 0.02 -0.31 0.39 -2.00 -0.10 0.00 0.00 175.22 173.22 2ke0 s GLU 111 N 0.32 3.67 -0.17 0.44 -6.30 0.22 -0.41 118.70 116.47 2ke0 s GLU 111 Ca -0.13 -0.27 -0.15 0.00 -2.50 0.00 0.00 54.97 51.91 2ke0 s GLU 111 Cb -0.16 -3.77 -0.04 0.00 0.00 0.00 0.00 34.13 30.16 2ke0 s GLU 111 CO 0.06 -0.49 0.37 0.08 0.02 0.00 0.00 175.26 175.29 2ke0 s VAL 112 N 2.10 5.24 -0.20 3.70 1.01 -0.37 -1.01 120.40 130.87 2ke0 s VAL 112 Ca 0.14 0.68 -0.02 0.00 0.00 0.00 0.00 61.98 62.78 2ke0 s VAL 112 Cb -0.16 -3.70 0.06 0.00 0.00 0.00 0.00 36.38 32.57 2ke0 s VAL 112 CO 0.12 0.32 -0.00 -0.70 0.00 0.00 0.00 175.10 174.84 2ke0 s GLU 113 N 0.86 1.01 0.10 2.72 2.12 0.02 -1.47 118.70 124.05 2ke0 s GLU 113 Ca 0.19 -0.57 -0.30 0.00 0.36 0.00 0.00 54.97 54.65 2ke0 s GLU 113 Cb -0.14 -2.19 -0.06 0.00 0.26 0.00 0.00 34.13 31.99 2ke0 s GLU 113 CO 0.07 -0.59 1.19 -0.51 -0.54 0.00 0.00 175.26 174.87 2ke0 s LEU 114 N 1.71 4.40 -0.18 2.70 2.01 -0.54 -0.03 118.68 128.75 2ke0 s LEU 114 Ca -0.02 2.07 -0.14 0.00 0.01 0.00 0.00 54.13 56.05 2ke0 s LEU 114 Cb -0.17 -3.59 -0.07 0.00 0.01 0.00 0.00 46.19 42.37 2ke0 s LEU 114 CO -0.07 -0.42 -0.30 0.18 1.01 0.00 0.00 176.35 176.75 2ke0 n LEU 115 N 3.46 1.74 -3.63 1.79 4.77 0.17 -0.07 117.00 125.23 2ke0 n LEU 115 Ca 0.07 0.29 -0.11 0.00 -0.03 0.00 0.00 56.01 56.24 2ke0 n LEU 115 Cb 0.46 -0.68 -0.05 0.00 -2.33 0.00 0.00 43.42 40.82 2ke0 n LEU 115 CO 0.55 0.03 0.17 -1.81 -1.33 0.00 0.00 177.39 175.00 2ke0 s ASP 116 N -6.47 -0.26 0.00 -1.43 1.01 -1.20 -4.26 116.67 104.06 2ke0 s ASP 116 Ca -0.28 -0.23 0.00 0.00 0.71 0.00 0.00 52.55 52.75 2ke0 s ASP 116 Cb 0.08 0.47 0.00 0.00 1.01 0.00 0.00 42.92 44.47 2ke0 s ASP 116 CO 0.39 -0.81 0.49 1.33 0.21 0.00 0.00 175.17 176.77