#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x5f s SER 2 N 0.00 6.06 0.00 1.61 0.15 -1.26 -5.02 113.70 115.25 1x5f s SER 2 Ca 0.00 0.82 0.00 0.00 0.70 0.00 0.00 55.95 57.47 1x5f s SER 2 Cb 0.00 -2.06 0.00 0.00 -1.71 0.00 0.00 66.02 62.25 1x5f s SER 2 CO 0.00 -0.71 0.00 -1.20 1.20 0.00 0.00 173.24 172.53 1x5f n SER 3 N -2.32 0.37 0.00 5.45 7.64 -1.26 -5.17 113.62 118.33 1x5f n SER 3 Ca 0.02 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.90 1x5f n SER 3 Cb 0.56 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.76 1x5f n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1x5f n GLY 4 N 2.14 3.62 3.57 0.23 0.00 -1.26 -5.13 105.19 108.35 1x5f n GLY 4 Ca 0.00 -1.78 -0.00 0.00 0.00 0.00 0.00 46.02 44.23 1x5f n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1x5f s SER 5 N 0.00 -0.94 -0.23 1.61 0.15 -1.26 -5.14 113.70 107.89 1x5f s SER 5 Ca 0.00 1.30 -0.04 0.00 0.70 0.00 0.00 55.95 57.92 1x5f s SER 5 Cb 0.00 2.05 0.10 0.00 -1.71 0.00 0.00 66.02 66.45 1x5f s SER 5 CO 0.00 -0.18 0.19 -0.55 1.20 0.00 0.00 173.24 173.90 1x5f s SER 6 N 2.69 2.09 -0.43 5.45 0.15 -1.26 -5.07 113.70 117.32 1x5f s SER 6 Ca -0.05 -0.63 0.04 0.00 0.70 0.00 0.00 55.95 56.01 1x5f s SER 6 Cb -0.10 0.12 0.17 0.00 -1.71 0.00 0.00 66.02 64.51 1x5f s SER 6 CO -0.18 -0.37 0.42 -0.83 1.20 0.00 0.00 173.24 173.47 1x5f s GLY 7 N 2.25 0.64 -0.38 9.45 0.00 -1.26 -5.09 107.32 112.93 1x5f s GLY 7 Ca 0.07 -1.97 -0.08 0.00 0.00 0.00 0.00 44.72 42.74 1x5f s GLY 7 CO -0.21 2.46 0.18 -0.54 0.00 0.00 0.00 173.10 174.99 1x5f s GLU 8 N 0.30 2.62 -0.39 2.90 0.41 -1.26 -5.04 118.70 118.24 1x5f s GLU 8 Ca 0.31 -1.29 0.04 0.00 -0.41 0.00 0.00 54.97 53.62 1x5f s GLU 8 Cb 0.02 -3.62 0.11 0.00 -1.78 0.00 0.00 34.13 28.85 1x5f s GLU 8 CO -0.16 -0.79 0.11 -1.01 -0.49 0.00 0.00 175.26 172.92 1x5f s HIS 9 N 1.42 3.47 -0.07 1.61 3.76 -1.26 -5.09 115.29 119.14 1x5f s HIS 9 Ca 0.01 -2.98 0.05 0.00 -0.15 0.00 0.00 55.06 51.99 1x5f s HIS 9 Cb -0.21 -2.82 -0.00 0.00 1.11 0.00 0.00 32.58 30.66 1x5f s HIS 9 CO 0.03 -0.89 -0.23 0.00 -0.85 0.00 0.00 174.74 172.80 1x5f s ALA 10 N 0.60 2.03 -1.11 -1.40 0.00 -1.26 -5.00 121.76 115.62 1x5f s ALA 10 Ca 0.13 -0.94 0.14 0.00 0.00 0.00 0.00 51.96 51.29 1x5f s ALA 10 Cb -0.21 -0.69 0.64 0.00 0.00 0.00 0.00 23.12 22.86 1x5f s ALA 10 CO -0.06 0.34 1.44 -0.35 0.00 0.00 0.00 175.76 177.13 1x5f n PRO 11 N 3.20 0.05 -2.62 0.00 -0.04 -1.26 -4.86 135.00 129.47 1x5f n PRO 11 Ca -0.18 0.23 -0.17 0.00 -0.04 0.00 0.00 63.50 63.34 1x5f n PRO 11 Cb 0.52 -1.50 0.01 0.00 -0.04 0.00 0.00 33.50 32.50 1x5f n PRO 11 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1x5f n ALA 12 N -1.44 -0.64 -2.51 0.55 0.00 -1.26 -5.01 120.51 110.20 1x5f n ALA 12 Ca 0.04 0.19 -0.24 0.00 0.00 0.00 0.00 53.44 53.43 1x5f n ALA 12 Cb 0.15 -2.60 -0.15 0.00 0.00 0.00 0.00 19.45 16.85 1x5f n ALA 12 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1x5f s THR 13 N -2.94 1.36 -1.76 0.00 2.01 -1.26 -5.02 115.64 108.02 1x5f s THR 13 Ca 0.14 -0.77 0.15 0.00 0.31 0.00 0.00 61.69 61.51 1x5f s THR 13 Cb -0.06 -1.14 0.10 0.00 0.01 0.00 0.00 72.50 71.41 1x5f s THR 13 CO 0.17 0.35 0.94 1.07 -0.69 0.00 0.00 174.62 176.46 1x5f n THR 14 N 2.57 0.00 0.00 -0.82 5.66 -1.26 -5.10 114.28 115.32 1x5f n THR 14 Ca -0.15 -0.48 0.00 0.00 -3.05 0.00 0.00 64.05 60.37 1x5f n THR 14 Cb 0.54 1.29 0.00 0.00 -1.55 0.00 0.00 70.33 70.61 1x5f n THR 14 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1x5f n GLY 15 N 0.86 -1.04 3.77 1.09 0.00 -1.26 -4.94 105.19 103.67 1x5f n GLY 15 Ca 0.08 -1.63 -0.34 0.00 0.00 0.00 0.00 46.02 44.13 1x5f n GLY 15 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1x5f s PRO 16 N -1.12 3.04 0.19 1.61 0.04 -1.26 -5.06 135.00 132.44 1x5f s PRO 16 Ca 0.00 1.49 0.10 0.00 0.04 0.00 0.00 61.00 62.63 1x5f s PRO 16 Cb 0.00 -1.97 -0.04 0.00 0.04 0.00 0.00 34.50 32.52 1x5f s PRO 16 CO 0.00 -1.08 -0.18 -0.51 0.04 0.00 0.00 177.00 175.28 1x5f s LEU 17 N -4.40 2.66 0.00 -3.56 1.43 -1.26 -5.00 118.68 108.54 1x5f s LEU 17 Ca 0.69 -0.76 0.00 0.00 -1.03 0.00 0.00 54.13 53.04 1x5f s LEU 17 Cb -0.22 -1.36 0.00 0.00 0.03 0.00 0.00 46.19 44.64 1x5f s LEU 17 CO 0.35 0.11 0.00 -0.81 0.23 0.00 0.00 176.35 176.23 1x5f n PRO 18 N 0.12 -0.16 -4.19 1.29 -0.04 -1.26 -4.91 135.00 125.85 1x5f n PRO 18 Ca -0.11 0.00 -0.17 0.00 -0.04 0.00 0.00 63.50 63.17 1x5f n PRO 18 Cb 0.56 0.00 -0.12 0.00 -0.04 0.00 0.00 33.50 33.90 1x5f n PRO 18 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1x5f s SER 19 N -1.51 1.38 0.80 3.54 0.15 -1.26 -3.31 113.70 113.49 1x5f s SER 19 Ca 0.00 -0.52 -0.14 0.00 0.70 0.00 0.00 55.95 55.99 1x5f s SER 19 Cb 0.00 -0.04 0.04 0.00 -1.71 0.00 0.00 66.02 64.31 1x5f s SER 19 CO 0.00 -0.07 0.92 0.00 1.20 0.00 0.00 173.24 175.29 1x5f n ALA 20 N 1.61 -0.75 -1.17 5.45 0.00 -0.59 -4.57 120.51 120.49 1x5f n ALA 20 Ca -0.20 -0.34 -0.29 0.00 0.00 0.00 0.00 53.44 52.61 1x5f n ALA 20 Cb 0.55 -2.08 0.17 0.00 0.00 0.00 0.00 19.45 18.08 1x5f n ALA 20 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1x5f s PRO 21 N -3.68 0.51 0.41 0.00 0.04 -1.26 -4.38 135.00 126.64 1x5f s PRO 21 Ca 0.69 0.55 0.07 0.00 0.04 0.00 0.00 61.00 62.36 1x5f s PRO 21 Cb -0.30 -1.74 -0.08 0.00 0.04 0.00 0.00 34.50 32.42 1x5f s PRO 21 CO 0.55 -2.68 0.03 1.03 0.04 0.00 0.00 177.00 175.96 1x5f s ARG 22 N -4.96 2.00 -1.30 4.56 1.81 -1.20 -4.78 118.95 115.08 1x5f s ARG 22 Ca 0.65 -2.08 -0.02 0.00 -1.72 0.00 0.00 55.73 52.56 1x5f s ARG 22 Cb -0.19 -1.68 0.01 0.00 -0.45 0.00 0.00 34.95 32.64 1x5f s ARG 22 CO 0.58 -0.06 0.83 -0.25 -0.68 0.00 0.00 175.30 175.71 1x5f n ASP 23 N -1.01 -1.96 -4.62 0.23 8.00 -1.26 -0.23 116.55 115.70 1x5f n ASP 23 Ca -0.05 -0.75 -0.43 0.00 0.71 0.00 0.00 54.79 54.28 1x5f n ASP 23 Cb 0.67 -4.40 -0.02 0.00 -0.02 0.00 0.00 41.12 37.35 1x5f n ASP 23 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1x5f s VAL 24 N -3.54 4.14 0.26 2.53 1.01 -1.26 -4.11 120.40 119.44 1x5f s VAL 24 Ca 0.08 1.25 -0.04 0.00 0.00 0.00 0.00 61.98 63.28 1x5f s VAL 24 Cb -0.04 -4.26 -0.02 0.00 0.00 0.00 0.00 36.38 32.06 1x5f s VAL 24 CO 0.79 -0.61 0.33 0.68 0.00 0.00 0.00 175.10 176.29 1x5f s VAL 25 N 4.53 0.00 -0.42 2.92 -7.23 0.11 -5.00 120.40 115.32 1x5f s VAL 25 Ca 0.55 -1.73 -0.08 0.00 -1.81 0.00 0.00 61.98 58.90 1x5f s VAL 25 Cb -0.14 -2.45 0.08 0.00 0.56 0.00 0.00 36.38 34.43 1x5f s VAL 25 CO 0.25 0.00 0.25 0.00 -0.31 0.00 0.00 175.10 175.29 1x5f s ALA 26 N -3.76 3.27 0.54 1.32 0.00 -1.26 0.30 121.76 122.17 1x5f s ALA 26 Ca 0.32 -2.20 0.25 0.00 0.00 0.00 0.00 51.96 50.33 1x5f s ALA 26 Cb 0.02 -2.62 1.42 0.00 0.00 0.00 0.00 23.12 21.95 1x5f s ALA 26 CO 0.15 -1.67 2.03 1.03 0.00 0.00 0.00 175.76 177.30 1x5f h SER 27 N 8.36 0.00 -5.00 0.00 0.87 -0.72 -3.43 113.55 113.63 1x5f h SER 27 Ca -0.22 0.00 -0.06 0.00 -1.23 0.00 0.00 61.79 60.28 1x5f h SER 27 Cb 1.08 0.00 -0.18 0.00 -0.44 0.00 0.00 62.40 62.86 1x5f h SER 27 CO 0.75 0.00 0.13 -0.22 -0.53 0.00 0.00 176.83 176.96 1x5f s LEU 28 N -8.56 -0.43 -0.33 2.23 0.20 -0.95 -4.97 118.68 105.87 1x5f s LEU 28 Ca -0.05 0.53 0.02 0.00 0.69 0.00 0.00 54.13 55.32 1x5f s LEU 28 Cb 0.18 2.36 0.10 0.00 -0.43 0.00 0.00 46.19 48.41 1x5f s LEU 28 CO 0.69 -0.63 0.08 -0.69 -0.29 0.00 0.00 176.35 175.50 1x5f s VAL 29 N -1.56 1.63 0.59 1.68 1.01 -1.26 0.11 120.40 122.60 1x5f s VAL 29 Ca -0.10 -1.95 -0.06 0.00 0.00 0.00 0.00 61.98 59.87 1x5f s VAL 29 Cb -0.01 -2.21 0.00 0.00 0.00 0.00 0.00 36.38 34.16 1x5f s VAL 29 CO 0.06 -0.65 0.90 -0.55 0.00 0.00 0.00 175.10 174.87 1x5f s SER 30 N 1.18 5.66 0.39 3.32 0.15 0.21 -4.58 113.70 120.04 1x5f s SER 30 Ca 0.11 0.78 0.21 0.00 0.70 0.00 0.00 55.95 57.75 1x5f s SER 30 Cb -0.19 -1.79 0.57 0.00 -1.71 0.00 0.00 66.02 62.91 1x5f s SER 30 CO -0.15 -1.03 1.68 0.71 1.20 0.00 0.00 173.24 175.64 1x5f h THR 31 N -0.17 0.55 -0.00 6.45 1.35 -1.96 -3.23 112.91 115.90 1x5f h THR 31 Ca -0.45 -1.44 0.00 0.00 -0.55 0.00 0.00 66.41 63.97 1x5f h THR 31 Cb 1.25 2.01 0.00 0.00 -1.73 0.00 0.00 68.15 69.68 1x5f h THR 31 CO 0.61 0.27 -0.04 0.54 -0.25 0.00 0.00 175.52 176.65 1x5f n ARG 32 N -3.28 1.07 -3.77 4.72 1.74 -1.26 -2.35 116.66 113.52 1x5f n ARG 32 Ca 0.01 -0.54 -0.09 0.00 -0.77 0.00 0.00 57.85 56.47 1x5f n ARG 32 Cb 0.54 -0.97 0.03 0.00 -1.02 0.00 0.00 32.46 31.04 1x5f n ARG 32 CO 0.00 0.00 0.00 1.97 -1.52 0.00 0.00 177.63 178.08 1x5f n PHE 33 N -0.11 -2.32 -3.68 -1.55 1.16 -1.22 -1.21 117.46 108.52 1x5f n PHE 33 Ca 0.02 -1.83 -0.10 0.00 -1.87 0.00 0.00 57.45 53.67 1x5f n PHE 33 Cb 0.08 0.91 -0.11 0.00 -1.61 0.00 0.00 39.48 38.75 1x5f n PHE 33 CO 0.00 0.00 0.00 0.42 -1.87 0.00 0.00 176.76 175.31 1x5f s ILE 34 N -2.10 -0.26 -0.21 1.97 1.01 -1.09 0.68 121.20 121.19 1x5f s ILE 34 Ca 0.16 0.14 -0.25 0.00 0.00 0.00 0.00 60.65 60.70 1x5f s ILE 34 Cb -0.05 -0.58 -0.01 0.00 0.01 0.00 0.00 42.46 41.84 1x5f s ILE 34 CO 0.12 0.06 0.86 -0.75 0.00 0.00 0.00 174.94 175.23 1x5f s LYS 35 N 1.87 4.24 0.18 2.79 2.47 0.30 -2.57 119.74 129.01 1x5f s LYS 35 Ca -0.06 1.03 0.05 0.00 -1.56 0.00 0.00 55.97 55.43 1x5f s LYS 35 Cb -0.10 -3.62 -0.04 0.00 -1.46 0.00 0.00 37.83 32.61 1x5f s LYS 35 CO -0.12 -0.47 0.22 -0.51 0.16 0.00 0.00 175.35 174.64 1x5f s LEU 36 N 2.64 4.05 -0.23 5.43 2.01 -0.16 -0.07 118.68 132.35 1x5f s LEU 36 Ca 0.37 -0.03 -0.17 0.00 0.01 0.00 0.00 54.13 54.32 1x5f s LEU 36 Cb -0.16 -2.62 0.06 0.00 0.01 0.00 0.00 46.19 43.49 1x5f s LEU 36 CO 0.09 0.03 0.58 0.42 1.01 0.00 0.00 176.35 178.48 1x5f s THR 37 N -1.84 -0.01 0.21 5.49 -4.23 0.15 -2.56 115.64 112.85 1x5f s THR 37 Ca 0.33 0.02 -0.12 0.00 -1.18 0.00 0.00 61.69 60.74 1x5f s THR 37 Cb -0.10 -0.83 -0.00 0.00 1.34 0.00 0.00 72.50 72.91 1x5f s THR 37 CO 0.26 0.01 0.41 -1.66 -0.54 0.00 0.00 174.62 173.10 1x5f s TRP 38 N 0.93 0.32 0.59 3.99 -2.14 -0.13 -0.71 118.94 121.78 1x5f s TRP 38 Ca -0.05 -0.67 0.10 0.00 2.66 0.00 0.00 56.10 58.14 1x5f s TRP 38 Cb -0.05 0.12 0.10 0.00 -3.10 0.00 0.00 33.47 30.53 1x5f s TRP 38 CO -0.08 -0.88 0.80 0.54 -2.66 0.00 0.00 176.95 174.67 1x5f n ARG 39 N -0.32 0.60 -2.39 3.25 3.00 0.68 -4.68 116.66 116.81 1x5f n ARG 39 Ca -0.05 -3.19 -0.38 0.00 -0.01 0.00 0.00 57.85 54.22 1x5f n ARG 39 Cb 0.62 -0.22 -0.03 0.00 0.00 0.00 0.00 32.46 32.84 1x5f n ARG 39 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.63 178.58 1x5f s THR 40 N -2.66 3.35 0.77 0.55 -4.23 -1.26 -3.25 115.64 108.91 1x5f s THR 40 Ca 0.61 1.17 -0.11 0.00 -1.18 0.00 0.00 61.69 62.18 1x5f s THR 40 Cb -0.05 -3.67 0.06 0.00 1.34 0.00 0.00 72.50 70.18 1x5f s THR 40 CO 0.38 0.13 1.09 -2.16 -0.54 0.00 0.00 174.62 173.53 1x5f s PRO 41 N -2.14 2.24 0.32 3.99 0.04 -1.04 -4.20 135.00 134.22 1x5f s PRO 41 Ca 0.54 1.16 0.02 0.00 0.04 0.00 0.00 61.00 62.76 1x5f s PRO 41 Cb -0.29 -1.90 0.55 0.00 0.04 0.00 0.00 34.50 32.90 1x5f s PRO 41 CO 0.37 -1.65 1.90 0.00 0.04 0.00 0.00 177.00 177.65 1x5f h ALA 42 N -1.14 1.37 -0.13 8.56 0.00 -1.83 -2.38 119.26 123.71 1x5f h ALA 42 Ca -0.44 -0.16 -0.13 0.00 0.00 0.00 0.00 54.91 54.19 1x5f h ALA 42 Cb 1.23 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.81 1x5f h ALA 42 CO 0.51 0.46 -0.47 1.03 0.00 0.00 0.00 179.25 180.78 1x5f h SER 43 N 0.70 0.36 -3.35 0.00 0.87 -1.90 -3.40 113.55 106.83 1x5f h SER 43 Ca 0.16 -0.17 -0.56 0.00 -1.23 0.00 0.00 61.79 59.99 1x5f h SER 43 Cb 0.20 -0.10 -0.39 0.00 -0.44 0.00 0.00 62.40 61.66 1x5f h SER 43 CO -0.01 0.78 -0.77 -1.81 -0.53 0.00 0.00 176.83 174.50 1x5f s ASP 44 N -6.88 3.50 0.10 6.23 1.11 -0.90 -4.93 116.67 114.90 1x5f s ASP 44 Ca -0.05 -1.16 -0.15 0.00 0.18 0.00 0.00 52.55 51.37 1x5f s ASP 44 Cb 0.13 -0.84 -0.09 0.00 1.07 0.00 0.00 42.92 43.19 1x5f s ASP 44 CO 0.80 -0.32 1.42 1.55 1.18 0.00 0.00 175.17 179.80 1x5f h PRO 45 N 8.11 0.69 0.00 8.23 0.13 -1.79 -2.74 132.00 144.64 1x5f h PRO 45 Ca -0.16 -0.36 -0.15 0.00 -0.87 0.00 0.00 66.00 64.46 1x5f h PRO 45 Cb 1.08 0.01 -0.02 0.00 0.13 0.00 0.00 31.00 32.20 1x5f h PRO 45 CO 0.40 0.98 -1.01 1.12 -0.23 0.00 0.00 178.00 179.26 1x5f h HIS 46 N 0.43 0.00 -4.41 1.56 2.07 -1.95 -3.43 115.15 109.42 1x5f h HIS 46 Ca 0.05 0.00 -0.12 0.00 -2.85 0.00 0.00 60.37 57.45 1x5f h HIS 46 Cb 0.85 0.00 -0.07 0.00 2.57 0.00 0.00 27.41 30.76 1x5f h HIS 46 CO 0.07 0.60 -0.17 0.41 -3.07 0.00 0.00 177.93 175.77 1x5f n GLY 47 N 1.33 -0.34 0.00 6.13 0.00 -1.22 -4.66 105.19 106.44 1x5f n GLY 47 Ca -0.04 0.01 0.11 0.00 0.00 0.00 0.00 46.02 46.10 1x5f n GLY 47 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1x5f n ASP 48 N -1.19 0.80 -1.13 1.61 2.03 -1.26 -3.94 116.55 113.48 1x5f n ASP 48 Ca 0.02 -0.71 0.08 0.00 0.52 0.00 0.00 54.79 54.71 1x5f n ASP 48 Cb 0.35 0.84 0.27 0.00 -0.72 0.00 0.00 41.12 41.85 1x5f n ASP 48 CO 0.00 0.00 0.00 -0.46 -1.92 0.00 0.00 177.20 174.82 1x5f n ASN 49 N -1.57 3.91 -3.78 1.67 2.04 -1.26 -4.56 115.26 111.72 1x5f n ASN 49 Ca 0.04 -2.34 -0.13 0.00 -0.44 0.00 0.00 54.58 51.70 1x5f n ASN 49 Cb 0.35 -0.45 -0.14 0.00 -2.53 0.00 0.00 39.78 37.01 1x5f n ASN 49 CO 0.00 0.00 0.00 -1.48 -0.44 0.00 0.00 177.26 175.34 1x5f s LEU 50 N -1.63 1.02 0.94 -4.53 0.05 -1.26 -4.47 118.68 108.80 1x5f s LEU 50 Ca 0.40 0.28 -0.14 0.00 0.05 0.00 0.00 54.13 54.73 1x5f s LEU 50 Cb 0.25 0.39 0.16 0.00 -2.05 0.00 0.00 46.19 44.94 1x5f s LEU 50 CO 0.20 -0.11 1.16 -0.89 -0.55 0.00 0.00 176.35 176.17 1x5f s THR 51 N 0.75 1.96 -0.07 5.48 2.01 0.25 -2.89 115.64 123.13 1x5f s THR 51 Ca -0.06 0.00 0.01 0.00 0.31 0.00 0.00 61.69 61.95 1x5f s THR 51 Cb -0.07 -2.78 0.02 0.00 0.01 0.00 0.00 72.50 69.68 1x5f s THR 51 CO -0.04 0.00 -0.06 -0.31 -0.69 0.00 0.00 174.62 173.52 1x5f s TYR 52 N -3.36 1.06 0.04 4.92 2.02 -1.26 0.57 117.35 121.34 1x5f s TYR 52 Ca 0.66 -0.39 0.00 0.00 -0.37 0.00 0.00 57.07 56.97 1x5f s TYR 52 Cb -0.12 -0.91 -0.04 0.00 -0.40 0.00 0.00 41.96 40.49 1x5f s TYR 52 CO 0.53 -0.31 0.16 -1.12 -1.57 0.00 0.00 175.55 173.25 1x5f s SER 53 N 1.23 6.10 -0.19 2.29 0.01 0.12 -2.84 113.70 120.42 1x5f s SER 53 Ca -0.05 0.21 -0.00 0.00 1.31 0.00 0.00 55.95 57.41 1x5f s SER 53 Cb -0.14 -1.83 0.05 0.00 0.21 0.00 0.00 66.02 64.31 1x5f s SER 53 CO -0.02 0.20 -0.05 -0.69 0.41 0.00 0.00 173.24 173.10 1x5f s VAL 54 N -1.41 1.21 -0.31 3.43 1.01 -1.05 -1.04 120.40 122.22 1x5f s VAL 54 Ca 0.31 -0.83 -0.12 0.00 0.00 0.00 0.00 61.98 61.34 1x5f s VAL 54 Cb -0.13 -1.44 -0.03 0.00 0.00 0.00 0.00 36.38 34.78 1x5f s VAL 54 CO 0.23 0.02 0.21 -0.36 0.00 0.00 0.00 175.10 175.20 1x5f s PHE 55 N 1.57 3.22 0.14 5.22 0.40 0.77 -0.88 117.98 128.41 1x5f s PHE 55 Ca -0.02 -0.14 0.09 0.00 -0.60 0.00 0.00 56.93 56.26 1x5f s PHE 55 Cb -0.17 -2.43 -0.04 0.00 0.51 0.00 0.00 43.02 40.90 1x5f s PHE 55 CO -0.07 -0.30 -0.15 1.52 0.70 0.00 0.00 175.22 176.92 1x5f s TYR 56 N 1.72 2.57 -0.26 0.36 1.13 -0.99 0.21 117.35 122.10 1x5f s TYR 56 Ca 0.06 -0.24 -0.26 0.00 -1.41 0.00 0.00 57.07 55.22 1x5f s TYR 56 Cb -0.17 -1.32 0.14 0.00 -1.10 0.00 0.00 41.96 39.50 1x5f s TYR 56 CO 0.10 0.44 1.10 -0.08 -2.51 0.00 0.00 175.55 174.60 1x5f s THR 57 N -1.36 0.00 0.24 -3.49 -1.32 -1.12 -2.17 115.64 106.42 1x5f s THR 57 Ca 0.21 0.00 -0.30 0.00 -1.21 0.00 0.00 61.69 60.39 1x5f s THR 57 Cb -0.10 -1.00 -0.09 0.00 -1.51 0.00 0.00 72.50 69.80 1x5f s THR 57 CO 0.12 0.00 1.34 -0.75 -2.21 0.00 0.00 174.62 173.12 1x5f s LYS 58 N -0.17 4.35 0.55 7.08 2.20 -1.26 -0.96 119.74 131.53 1x5f s LYS 58 Ca 0.03 2.15 0.35 0.00 -0.36 0.00 0.00 55.97 58.14 1x5f s LYS 58 Cb -0.04 -3.14 1.52 0.00 -1.51 0.00 0.00 37.83 34.66 1x5f s LYS 58 CO -0.06 -0.27 1.83 1.49 -0.36 0.00 0.00 175.35 177.97 1x5f h GLU 59 N 4.82 0.00 0.00 4.03 4.81 -1.94 0.55 114.58 126.85 1x5f h GLU 59 Ca -0.46 0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 58.70 1x5f h GLU 59 Cb 1.22 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.59 1x5f h GLU 59 CO 0.75 0.00 -1.23 0.41 -0.73 0.00 0.00 179.01 178.20 1x5f n GLY 60 N -1.74 -1.34 3.78 1.92 0.00 -1.26 -4.87 105.19 101.68 1x5f n GLY 60 Ca 0.23 -0.21 -0.37 0.00 0.00 0.00 0.00 46.02 45.66 1x5f n GLY 60 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1x5f s ILE 61 N -3.20 5.23 -1.24 -0.61 -1.09 0.19 -4.97 121.20 115.52 1x5f s ILE 61 Ca -0.02 0.65 0.10 0.00 -2.23 0.00 0.00 60.65 59.14 1x5f s ILE 61 Cb 0.09 -3.65 0.40 0.00 -1.58 0.00 0.00 42.46 37.72 1x5f s ILE 61 CO 0.81 0.47 1.22 0.00 -1.23 0.00 0.00 174.94 176.20 1x5f n ALA 62 N 2.87 2.88 -2.82 9.38 0.00 -1.26 -4.15 120.51 127.41 1x5f n ALA 62 Ca -0.13 -0.87 -0.34 0.00 0.00 0.00 0.00 53.44 52.11 1x5f n ALA 62 Cb 0.52 -1.02 -0.12 0.00 0.00 0.00 0.00 19.45 18.83 1x5f n ALA 62 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1x5f s ARG 63 N -1.73 3.23 0.03 0.00 0.52 -1.26 -5.11 118.95 114.63 1x5f s ARG 63 Ca 0.28 -0.56 0.02 0.00 -0.52 0.00 0.00 55.73 54.95 1x5f s ARG 63 Cb 0.18 -2.72 -0.02 0.00 0.52 0.00 0.00 34.95 32.91 1x5f s ARG 63 CO 0.13 0.41 -0.08 -1.83 0.02 0.00 0.00 175.30 173.96 1x5f s GLU 64 N -0.13 0.53 0.05 3.54 1.03 -1.26 -4.33 118.70 118.12 1x5f s GLU 64 Ca 0.01 -0.64 0.09 0.00 0.03 0.00 0.00 54.97 54.47 1x5f s GLU 64 Cb -0.13 -0.36 -0.03 0.00 -0.80 0.00 0.00 34.13 32.81 1x5f s GLU 64 CO 0.03 0.07 -0.25 1.03 -1.33 0.00 0.00 175.26 174.81 1x5f s ARG 65 N -1.24 1.65 -0.12 -4.83 0.52 -0.92 -4.92 118.95 109.09 1x5f s ARG 65 Ca -0.07 -1.10 -0.14 0.00 -0.52 0.00 0.00 55.73 53.90 1x5f s ARG 65 Cb -0.08 -1.85 -0.05 0.00 0.52 0.00 0.00 34.95 33.50 1x5f s ARG 65 CO 0.00 0.47 0.34 0.54 0.02 0.00 0.00 175.30 176.68 1x5f s VAL 66 N -0.84 5.25 -0.31 3.52 0.11 -1.26 -2.35 120.40 124.52 1x5f s VAL 66 Ca 0.11 0.66 0.03 0.00 -2.93 0.00 0.00 61.98 59.84 1x5f s VAL 66 Cb -0.10 -3.67 0.08 0.00 -1.53 0.00 0.00 36.38 31.17 1x5f s VAL 66 CO 0.02 0.42 -0.01 -0.70 -3.33 0.00 0.00 175.10 171.51 1x5f s GLU 67 N 0.17 1.87 0.07 1.54 2.12 -0.06 -4.90 118.70 119.51 1x5f s GLU 67 Ca 0.19 -1.63 -0.30 0.00 0.36 0.00 0.00 54.97 53.59 1x5f s GLU 67 Cb -0.14 -3.10 -0.06 0.00 0.26 0.00 0.00 34.13 31.09 1x5f s GLU 67 CO 0.07 -0.78 1.17 0.54 -0.54 0.00 0.00 175.26 175.71 1x5f s ASN 68 N 1.06 7.12 0.15 -1.70 2.20 -1.26 -2.54 114.94 119.97 1x5f s ASN 68 Ca 0.02 2.00 -0.33 0.00 -0.94 0.00 0.00 52.86 53.61 1x5f s ASN 68 Cb -0.20 -2.58 -0.13 0.00 -2.00 0.00 0.00 41.25 36.34 1x5f s ASN 68 CO -0.06 -0.42 1.68 0.35 -2.94 0.00 0.00 177.10 175.71 1x5f n THR 69 N 3.71 0.10 -0.44 0.54 -2.24 -1.13 -4.79 114.28 110.03 1x5f n THR 69 Ca 0.08 -0.02 0.40 0.00 -2.27 0.00 0.00 64.05 62.24 1x5f n THR 69 Cb 0.47 -1.78 0.65 0.00 -2.10 0.00 0.00 70.33 67.56 1x5f n THR 69 CO 0.00 0.00 0.00 -1.28 -0.57 0.00 0.00 175.07 173.22 1x5f h SER 70 N 6.80 0.00 -4.49 3.42 0.87 -1.93 -3.38 113.55 114.84 1x5f h SER 70 Ca -0.45 0.00 -0.20 0.00 -1.23 0.00 0.00 61.79 59.91 1x5f h SER 70 Cb 1.23 0.00 -0.24 0.00 -0.44 0.00 0.00 62.40 62.96 1x5f h SER 70 CO 0.92 0.00 -0.71 -1.00 -0.53 0.00 0.00 176.83 175.51 1x5f s HIS 71 N -4.67 0.20 0.27 2.24 3.76 -1.26 -5.14 115.29 110.69 1x5f s HIS 71 Ca -0.04 -0.33 -0.29 0.00 -0.15 0.00 0.00 55.06 54.25 1x5f s HIS 71 Cb 0.21 -0.14 -0.10 0.00 1.11 0.00 0.00 32.58 33.66 1x5f s HIS 71 CO 0.69 -0.11 1.25 -1.25 -0.85 0.00 0.00 174.74 174.47 1x5f s PRO 72 N -0.90 4.44 0.00 8.40 0.04 -1.26 -2.98 135.00 142.74 1x5f s PRO 72 Ca -0.09 2.05 0.00 0.00 0.04 0.00 0.00 61.00 63.00 1x5f s PRO 72 Cb -0.06 -3.14 0.00 0.00 0.04 0.00 0.00 34.50 31.33 1x5f s PRO 72 CO -0.01 -0.10 0.00 0.41 0.04 0.00 0.00 177.00 177.34 1x5f n GLY 73 N 1.41 3.03 3.26 0.56 0.00 -1.14 -4.93 105.19 107.38 1x5f n GLY 73 Ca 0.02 0.00 -0.59 0.00 0.00 0.00 0.00 46.02 45.44 1x5f n GLY 73 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1x5f n GLU 74 N -0.99 0.00 -0.07 1.61 4.07 -1.16 -4.76 120.64 119.34 1x5f n GLU 74 Ca 0.00 0.00 0.03 0.00 -0.06 0.00 0.00 57.16 57.13 1x5f n GLU 74 Cb 0.00 -1.33 0.10 0.00 -0.06 0.00 0.00 31.44 30.15 1x5f n GLU 74 CO 0.00 0.00 0.00 -1.33 -0.06 0.00 0.00 177.13 175.74 1x5f n MET 75 N 3.94 1.31 -3.62 5.31 2.81 -1.26 -4.79 117.12 120.82 1x5f n MET 75 Ca 0.30 -0.49 -0.13 0.00 -1.81 0.00 0.00 57.70 55.57 1x5f n MET 75 Cb -0.05 -1.13 -0.07 0.00 -0.71 0.00 0.00 33.22 31.26 1x5f n MET 75 CO 0.00 0.00 0.00 1.14 1.51 0.00 0.00 175.97 178.62 1x5f s GLN 76 N -1.83 0.80 0.17 0.03 0.00 -1.26 -0.96 119.66 116.61 1x5f s GLN 76 Ca 0.11 0.79 -0.01 0.00 -0.00 0.00 0.00 55.36 56.25 1x5f s GLN 76 Cb 0.06 0.39 -0.04 0.00 0.00 0.00 0.00 33.01 33.41 1x5f s GLN 76 CO 0.08 -0.13 0.10 0.54 0.00 0.00 0.00 175.29 175.88 1x5f s VAL 77 N 0.09 0.05 -0.05 3.63 0.11 -1.06 -4.98 120.40 118.19 1x5f s VAL 77 Ca -0.01 -1.93 0.06 0.00 -2.93 0.00 0.00 61.98 57.17 1x5f s VAL 77 Cb -0.04 -2.26 -0.01 0.00 -1.53 0.00 0.00 36.38 32.53 1x5f s VAL 77 CO 0.01 -0.23 -0.25 -0.89 -3.33 0.00 0.00 175.10 170.41 1x5f s THR 78 N -4.10 2.11 -0.51 5.04 2.01 -1.26 -0.99 115.64 117.93 1x5f s THR 78 Ca 0.31 -1.06 -0.00 0.00 0.31 0.00 0.00 61.69 61.25 1x5f s THR 78 Cb 0.07 -1.76 0.13 0.00 0.01 0.00 0.00 72.50 70.96 1x5f s THR 78 CO 0.07 0.57 0.29 -0.63 -0.69 0.00 0.00 174.62 174.23 1x5f s ILE 79 N -0.27 3.18 0.81 1.82 -1.09 -1.06 -4.98 121.20 119.60 1x5f s ILE 79 Ca -0.00 -2.75 -0.08 0.00 -2.23 0.00 0.00 60.65 55.59 1x5f s ILE 79 Cb -0.13 -3.15 0.14 0.00 -1.58 0.00 0.00 42.46 37.74 1x5f s ILE 79 CO 0.03 -0.78 1.13 -1.10 -1.23 0.00 0.00 174.94 172.98 1x5f s GLN 80 N 0.30 1.38 -0.61 2.79 -0.21 -1.26 -2.68 119.66 119.36 1x5f s GLN 80 Ca 0.14 -0.67 -0.01 0.00 0.02 0.00 0.00 55.36 54.84 1x5f s GLN 80 Cb -0.22 -2.11 0.00 0.00 1.00 0.00 0.00 33.01 31.68 1x5f s GLN 80 CO -0.03 -1.78 0.52 0.09 -2.12 0.00 0.00 175.29 171.96 1x5f n ASN 81 N -3.21 -2.55 -4.56 5.90 3.02 -0.94 -4.93 115.26 107.99 1x5f n ASN 81 Ca 0.14 -0.30 -0.26 0.00 -0.03 0.00 0.00 54.58 54.13 1x5f n ASN 81 Cb 0.60 -2.78 -0.10 0.00 -0.61 0.00 0.00 39.78 36.88 1x5f n ASN 81 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1x5f s LEU 82 N -4.15 2.76 -0.14 3.41 1.43 -0.35 -5.03 118.68 116.61 1x5f s LEU 82 Ca 0.07 -1.20 -0.07 0.00 -1.03 0.00 0.00 54.13 51.90 1x5f s LEU 82 Cb -0.03 -1.01 -0.04 0.00 0.03 0.00 0.00 46.19 45.13 1x5f s LEU 82 CO 0.36 -0.23 0.12 -0.32 0.23 0.00 0.00 176.35 176.51 1x5f s MET 83 N -3.62 3.58 0.68 1.70 -2.45 -1.26 -4.48 119.30 113.45 1x5f s MET 83 Ca 0.33 -0.19 -0.14 0.00 -1.25 0.00 0.00 55.69 54.43 1x5f s MET 83 Cb 0.03 -3.19 0.01 0.00 1.25 0.00 0.00 34.83 32.93 1x5f s MET 83 CO 0.17 0.64 1.11 -1.25 1.05 0.00 0.00 175.02 176.73 1x5f s PRO 84 N -0.64 2.68 -1.62 4.11 0.04 -0.99 -3.53 135.00 135.05 1x5f s PRO 84 Ca 0.13 1.34 -0.16 0.00 0.04 0.00 0.00 61.00 62.34 1x5f s PRO 84 Cb -0.12 -1.94 0.12 0.00 0.04 0.00 0.00 34.50 32.61 1x5f s PRO 84 CO 0.02 -1.34 0.88 0.00 0.04 0.00 0.00 177.00 176.60 1x5f n ALA 85 N -2.66 -1.25 -3.69 8.56 0.00 -1.15 -4.84 120.51 115.48 1x5f n ALA 85 Ca 0.10 0.10 -0.22 0.00 0.00 0.00 0.00 53.44 53.42 1x5f n ALA 85 Cb 0.52 -3.97 -0.18 0.00 0.00 0.00 0.00 19.45 15.83 1x5f n ALA 85 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1x5f s THR 86 N -3.27 0.04 0.60 0.00 2.01 -1.23 -4.91 115.64 108.87 1x5f s THR 86 Ca 0.70 0.23 -0.20 0.00 0.31 0.00 0.00 61.69 62.74 1x5f s THR 86 Cb -0.37 -0.34 -0.03 0.00 0.01 0.00 0.00 72.50 71.77 1x5f s THR 86 CO 0.87 0.11 1.29 -0.69 -0.69 0.00 0.00 174.62 175.51 1x5f s VAL 87 N 2.10 2.23 -0.09 3.82 1.01 -1.26 -3.58 120.40 124.63 1x5f s VAL 87 Ca 0.04 0.15 -0.07 0.00 0.00 0.00 0.00 61.98 62.11 1x5f s VAL 87 Cb -0.13 -3.07 0.03 0.00 0.00 0.00 0.00 36.38 33.22 1x5f s VAL 87 CO -0.05 -0.02 0.23 -0.31 0.00 0.00 0.00 175.10 174.96 1x5f s TYR 88 N -1.42 -0.28 -0.52 5.22 2.02 0.17 -3.97 117.35 118.58 1x5f s TYR 88 Ca 0.77 0.67 -0.18 0.00 -0.37 0.00 0.00 57.07 57.97 1x5f s TYR 88 Cb -0.36 0.07 0.08 0.00 -0.40 0.00 0.00 41.96 41.34 1x5f s TYR 88 CO 0.40 -0.16 0.58 0.42 -1.57 0.00 0.00 175.55 175.22 1x5f s ILE 89 N 0.57 4.97 -0.06 2.71 -1.09 -0.14 -1.23 121.20 126.93 1x5f s ILE 89 Ca -0.04 -0.79 -0.16 0.00 -2.23 0.00 0.00 60.65 57.43 1x5f s ILE 89 Cb -0.05 -4.30 -0.05 0.00 -1.58 0.00 0.00 42.46 36.48 1x5f s ILE 89 CO -0.03 -0.82 0.43 -0.36 -1.23 0.00 0.00 174.94 172.92 1x5f s PHE 90 N 2.34 3.62 -0.14 3.97 0.40 0.11 -2.81 117.98 125.47 1x5f s PHE 90 Ca 0.11 0.92 0.00 0.00 -0.60 0.00 0.00 56.93 57.36 1x5f s PHE 90 Cb -0.22 -2.40 0.03 0.00 0.51 0.00 0.00 43.02 40.93 1x5f s PHE 90 CO 0.09 0.41 -0.11 1.03 0.70 0.00 0.00 175.22 177.34 1x5f s ARG 91 N -0.25 1.95 0.03 0.44 0.52 0.13 -0.30 118.95 121.47 1x5f s ARG 91 Ca 0.24 -0.47 -0.07 0.00 -0.52 0.00 0.00 55.73 54.91 1x5f s ARG 91 Cb -0.16 -1.94 -0.05 0.00 0.52 0.00 0.00 34.95 33.32 1x5f s ARG 91 CO 0.11 -0.28 0.31 0.08 0.02 0.00 0.00 175.30 175.54 1x5f s VAL 92 N 1.57 5.24 -0.09 3.52 1.01 -1.26 -0.16 120.40 130.23 1x5f s VAL 92 Ca 0.04 0.24 -0.17 0.00 0.00 0.00 0.00 61.98 62.09 1x5f s VAL 92 Cb -0.13 -3.59 0.04 0.00 0.00 0.00 0.00 36.38 32.70 1x5f s VAL 92 CO -0.09 0.34 0.42 -0.32 0.00 0.00 0.00 175.10 175.44 1x5f s MET 93 N -1.81 0.64 0.32 2.72 0.00 -0.21 0.45 119.30 121.42 1x5f s MET 93 Ca 0.29 0.24 -0.05 0.00 0.00 0.00 0.00 55.69 56.18 1x5f s MET 93 Cb -0.13 0.30 -0.05 0.00 0.00 0.00 0.00 34.83 34.95 1x5f s MET 93 CO 0.17 -0.14 0.59 0.00 0.00 0.00 0.00 175.02 175.64 1x5f s ALA 94 N -0.57 3.59 -0.10 4.11 0.00 -1.26 0.11 121.76 127.63 1x5f s ALA 94 Ca -0.07 -0.56 -0.04 0.00 0.00 0.00 0.00 51.96 51.29 1x5f s ALA 94 Cb -0.04 -2.34 0.05 0.00 0.00 0.00 0.00 23.12 20.79 1x5f s ALA 94 CO 0.03 0.14 0.21 -0.65 0.00 0.00 0.00 175.76 175.49 1x5f s GLN 95 N -3.77 0.15 0.50 0.00 -0.21 0.19 -2.57 119.66 113.95 1x5f s GLN 95 Ca 0.44 0.52 0.02 0.00 0.02 0.00 0.00 55.36 56.37 1x5f s GLN 95 Cb -0.10 -0.14 -0.01 0.00 1.00 0.00 0.00 33.01 33.75 1x5f s GLN 95 CO 0.32 -0.20 0.06 0.54 -2.12 0.00 0.00 175.29 173.89 1x5f s ASN 96 N 1.52 4.19 0.63 5.90 2.20 -0.74 0.88 114.94 129.51 1x5f s ASN 96 Ca -0.06 -1.56 0.20 0.00 -0.94 0.00 0.00 52.86 50.49 1x5f s ASN 96 Cb -0.11 0.41 0.78 0.00 -2.00 0.00 0.00 41.25 40.32 1x5f s ASN 96 CO -0.08 -0.85 1.33 0.07 -2.94 0.00 0.00 177.10 174.64 1x5f h LYS 97 N 1.30 0.00 0.14 3.55 2.10 -2.02 0.85 116.57 122.49 1x5f h LYS 97 Ca -0.43 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.21 1x5f h LYS 97 Cb 1.31 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.64 1x5f h LYS 97 CO 0.72 0.00 -0.07 0.45 -2.00 0.00 0.00 179.45 178.56 1x5f h HIS 98 N 0.00 -0.17 0.00 0.07 3.86 -1.93 -3.51 115.15 113.47 1x5f h HIS 98 Ca 0.28 -0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.49 1x5f h HIS 98 Cb 2.28 0.06 0.00 0.00 1.06 0.00 0.00 27.41 30.81 1x5f h HIS 98 CO 0.00 -0.11 0.00 0.41 0.86 0.00 0.00 177.93 179.09 1x5f n GLY 99 N 1.28 -0.32 3.41 2.45 0.00 0.29 -5.13 105.19 107.17 1x5f n GLY 99 Ca -0.02 0.37 -0.32 0.00 0.00 0.00 0.00 46.02 46.04 1x5f n GLY 99 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1x5f s SER 100 N -4.00 3.81 0.00 1.61 0.15 -1.26 -1.80 113.70 112.22 1x5f s SER 100 Ca 0.00 -0.29 0.00 0.00 0.70 0.00 0.00 55.95 56.36 1x5f s SER 100 Cb 0.00 -0.98 0.00 0.00 -1.71 0.00 0.00 66.02 63.33 1x5f s SER 100 CO 0.00 0.29 0.00 0.61 1.20 0.00 0.00 173.24 175.34 1x5f n GLY 101 N 2.68 0.70 3.75 9.45 0.00 -1.06 -4.86 105.19 115.84 1x5f n GLY 101 Ca -0.17 -0.19 -0.39 0.00 0.00 0.00 0.00 46.02 45.27 1x5f n GLY 101 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1x5f s GLU 102 N 3.69 4.37 -0.14 1.61 2.12 -1.21 -4.94 118.70 124.21 1x5f s GLU 102 Ca 0.00 0.79 -0.28 0.00 0.36 0.00 0.00 54.97 55.84 1x5f s GLU 102 Cb 0.00 -3.37 -0.01 0.00 0.26 0.00 0.00 34.13 31.01 1x5f s GLU 102 CO 0.00 0.28 0.94 -1.12 -0.54 0.00 0.00 175.26 174.83 1x5f s SER 103 N 0.08 7.13 1.26 -1.70 0.01 -1.26 -1.54 113.70 117.68 1x5f s SER 103 Ca 0.33 1.39 -0.19 0.00 1.31 0.00 0.00 55.95 58.79 1x5f s SER 103 Cb -0.18 -2.52 0.28 0.00 0.21 0.00 0.00 66.02 63.81 1x5f s SER 103 CO 0.18 -0.45 0.64 -1.54 0.41 0.00 0.00 173.24 172.49 1x5f n SER 104 N 5.19 -3.28 -4.79 2.44 3.41 0.17 -4.89 113.62 111.88 1x5f n SER 104 Ca 0.07 -0.54 -0.35 0.00 -0.26 0.00 0.00 58.87 57.78 1x5f n SER 104 Cb 0.48 -0.97 -0.03 0.00 -0.26 0.00 0.00 64.21 63.43 1x5f n SER 104 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1x5f s ALA 105 N -2.16 2.97 -0.16 7.33 0.00 -1.26 -4.64 121.76 123.84 1x5f s ALA 105 Ca 0.57 0.69 -0.29 0.00 0.00 0.00 0.00 51.96 52.93 1x5f s ALA 105 Cb -0.13 -3.28 -0.03 0.00 0.00 0.00 0.00 23.12 19.68 1x5f s ALA 105 CO 0.52 -0.32 1.57 -1.25 0.00 0.00 0.00 175.76 176.29 1x5f s PRO 106 N -2.84 3.97 -0.14 0.00 0.04 -1.26 -4.58 135.00 130.20 1x5f s PRO 106 Ca 0.63 1.82 -0.18 0.00 0.04 0.00 0.00 61.00 63.31 1x5f s PRO 106 Cb -0.20 -3.98 -0.04 0.00 0.04 0.00 0.00 34.50 30.31 1x5f s PRO 106 CO 0.25 -1.07 0.46 -1.17 0.04 0.00 0.00 177.00 175.50 1x5f s LEU 107 N 4.60 4.25 -0.50 -3.56 2.96 0.59 -4.88 118.68 122.15 1x5f s LEU 107 Ca 0.69 0.75 -0.19 0.00 -0.22 0.00 0.00 54.13 55.17 1x5f s LEU 107 Cb -0.27 -2.65 0.06 0.00 0.50 0.00 0.00 46.19 43.83 1x5f s LEU 107 CO 0.27 -0.01 0.59 -0.60 -1.32 0.00 0.00 176.35 175.28 1x5f s ARG 108 N 0.75 3.11 -0.04 1.98 3.52 -1.26 -0.71 118.95 126.30 1x5f s ARG 108 Ca 0.24 -0.92 0.04 0.00 -0.13 0.00 0.00 55.73 54.96 1x5f s ARG 108 Cb -0.15 -4.09 -0.03 0.00 -1.56 0.00 0.00 34.95 29.12 1x5f s ARG 108 CO 0.09 -1.18 -0.15 0.08 -0.81 0.00 0.00 175.30 173.33 1x5f s VAL 109 N 2.50 2.99 -0.17 7.11 1.01 -0.37 -4.94 120.40 128.54 1x5f s VAL 109 Ca 0.14 -0.80 0.01 0.00 0.00 0.00 0.00 61.98 61.33 1x5f s VAL 109 Cb -0.20 -2.18 0.02 0.00 0.00 0.00 0.00 36.38 34.02 1x5f s VAL 109 CO 0.12 0.56 -0.20 -0.70 0.00 0.00 0.00 175.10 174.88 1x5f s GLU 110 N -0.83 2.90 1.20 2.72 2.12 -1.26 0.41 118.70 125.97 1x5f s GLU 110 Ca 0.12 -0.80 -0.18 0.00 0.36 0.00 0.00 54.97 54.47 1x5f s GLU 110 Cb -0.11 -2.49 0.28 0.00 0.26 0.00 0.00 34.13 32.08 1x5f s GLU 110 CO 0.01 -0.18 1.08 0.95 -0.54 0.00 0.00 175.26 176.58 1x5f s THR 111 N 1.24 1.63 -0.05 -1.70 -4.23 -1.23 -4.93 115.64 106.37 1x5f s THR 111 Ca 0.03 0.00 -0.03 0.00 -1.18 0.00 0.00 61.69 60.51 1x5f s THR 111 Cb -0.13 -2.41 -0.04 0.00 1.34 0.00 0.00 72.50 71.26 1x5f s THR 111 CO -0.11 0.00 0.10 -1.10 -0.54 0.00 0.00 174.62 172.97 1x5f s GLN 112 N -5.25 3.22 -0.46 3.99 -1.52 -1.26 -3.53 119.66 114.85 1x5f s GLN 112 Ca 0.70 -0.35 -0.28 0.00 -1.95 0.00 0.00 55.36 53.48 1x5f s GLN 112 Cb -0.12 -2.98 -0.02 0.00 -0.22 0.00 0.00 33.01 29.67 1x5f s GLN 112 CO 0.57 0.70 1.77 -1.25 -0.25 0.00 0.00 175.29 176.82 1x5f s PRO 113 N -1.45 3.06 -0.12 2.91 0.04 -1.26 -2.92 135.00 135.26 1x5f s PRO 113 Ca 0.20 1.00 0.15 0.00 0.04 0.00 0.00 61.00 62.39 1x5f s PRO 113 Cb -0.12 -4.25 -0.24 0.00 0.04 0.00 0.00 34.50 29.92 1x5f s PRO 113 CO 0.10 -2.19 0.36 -0.85 0.04 0.00 0.00 177.00 174.46 1x5f n GLU 114 N 8.71 0.66 -2.45 4.56 -0.00 -1.26 -4.95 120.64 125.91 1x5f n GLU 114 Ca 0.21 0.14 -0.33 0.00 -0.00 0.00 0.00 57.16 57.18 1x5f n GLU 114 Cb 0.49 -1.65 -0.03 0.00 -0.00 0.00 0.00 31.44 30.24 1x5f n GLU 114 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.13 177.58 1x5f s SER 115 N -5.78 6.51 0.00 -1.84 0.15 -1.26 -4.73 113.70 106.75 1x5f s SER 115 Ca -0.07 1.69 0.00 0.00 0.70 0.00 0.00 55.95 58.26 1x5f s SER 115 Cb 0.07 -2.53 0.00 0.00 -1.71 0.00 0.00 66.02 61.85 1x5f s SER 115 CO 0.83 -0.66 0.00 0.61 1.20 0.00 0.00 173.24 175.21 1x5f n GLY 116 N -1.08 0.57 0.25 9.45 0.00 -1.26 -4.88 105.19 108.24 1x5f n GLY 116 Ca 0.07 -1.63 0.13 0.00 0.00 0.00 0.00 46.02 44.59 1x5f n GLY 116 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1x5f h PRO 117 N 0.00 0.00 -6.36 1.61 0.13 -2.02 -3.44 132.00 121.92 1x5f h PRO 117 Ca 0.00 0.00 -0.46 0.00 -0.87 0.00 0.00 66.00 64.67 1x5f h PRO 117 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1x5f h PRO 117 CO 0.00 0.13 -0.28 -1.12 -0.23 0.00 0.00 178.00 176.50 1x5f s SER 118 N -6.00 5.35 -0.04 1.44 0.01 -1.26 -5.07 113.70 108.14 1x5f s SER 118 Ca 0.00 -0.61 -0.02 0.00 1.31 0.00 0.00 55.95 56.63 1x5f s SER 118 Cb 0.10 -0.47 -0.02 0.00 0.21 0.00 0.00 66.02 65.85 1x5f s SER 118 CO 0.59 -0.81 -0.05 -1.54 0.41 0.00 0.00 173.24 171.84 1x5f n SER 119 N -1.80 0.60 0.00 2.44 3.41 -1.26 -4.84 113.62 112.17 1x5f n SER 119 Ca 0.07 0.04 0.00 0.00 -0.26 0.00 0.00 58.87 58.72 1x5f n SER 119 Cb 0.60 -0.11 0.00 0.00 -0.26 0.00 0.00 64.21 64.45 1x5f n SER 119 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49