#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 -1.07 0.00 1.61 0.15 -1.26 -5.17 113.70 107.97 1x5f s SER 2 Ca 0.00 1.17 -0.28 0.00 0.70 0.00 0.00 55.95 57.54 1x5f s SER 2 Cb 0.00 2.10 0.10 0.00 -1.71 0.00 0.00 66.02 66.50 1x5f s SER 2 CO 0.00 -0.20 0.86 -0.94 1.20 0.00 0.00 173.24 174.16 1x5f s SER 3 N 2.81 -0.39 0.10 5.45 1.04 -1.26 -5.11 113.70 116.35 1x5f s SER 3 Ca 0.02 0.04 0.00 0.00 0.48 0.00 0.00 55.95 56.49 1x5f s SER 3 Cb -0.12 0.41 0.00 0.00 0.10 0.00 0.00 66.02 66.41 1x5f s SER 3 CO -0.19 -0.64 0.00 0.61 0.98 0.00 0.00 173.24 174.00 1x5f n GLY 4 N -0.18 -1.57 3.55 7.32 0.00 -1.26 -5.05 105.19 108.01 1x5f n GLY 4 Ca -0.10 0.36 -0.38 0.00 0.00 0.00 0.00 46.02 45.90 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 -1.71 5.93 0.04 1.61 0.15 -1.26 -4.85 113.70 113.61 1x5f s SER 5 Ca 0.00 -0.65 -0.25 0.00 0.70 0.00 0.00 55.95 55.76 1x5f s SER 5 Cb 0.00 -2.56 -0.17 0.00 -1.71 0.00 0.00 66.02 61.58 1x5f s SER 5 CO 0.00 -1.99 1.52 -1.28 1.20 0.00 0.00 173.24 172.69 1x5f h SER 6 N 11.08 -0.04 0.00 5.45 0.87 -2.05 -3.49 113.55 125.38 1x5f h SER 6 Ca -0.07 -0.21 0.00 0.00 -1.23 0.00 0.00 61.79 60.28 1x5f h SER 6 Cb 1.05 0.01 0.00 0.00 -0.44 0.00 0.00 62.40 63.02 1x5f h SER 6 CO 1.30 0.19 0.00 0.61 -0.53 0.00 0.00 176.83 178.40 1x5f n GLY 7 N -0.52 0.68 3.80 5.77 0.00 -1.26 -5.14 105.19 108.53 1x5f n GLY 7 Ca -0.08 -0.86 -0.22 0.00 0.00 0.00 0.00 46.02 44.85 1x5f n GLY 7 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1x5f s GLU 8 N -0.46 2.45 -0.01 1.61 8.01 -1.26 -5.15 118.70 123.89 1x5f s GLU 8 Ca 0.00 -1.57 -0.04 0.00 0.01 0.00 0.00 54.97 53.37 1x5f s GLU 8 Cb 0.00 -2.25 0.00 0.00 -4.31 0.00 0.00 34.13 27.57 1x5f s GLU 8 CO 0.00 -0.04 0.09 -3.38 0.01 0.00 0.00 175.26 171.94 1x5f s HIS 9 N -2.46 0.03 -0.20 1.61 -3.43 -1.26 -5.14 115.29 104.44 1x5f s HIS 9 Ca 0.42 -0.06 0.01 0.00 -0.80 0.00 0.00 55.06 54.63 1x5f s HIS 9 Cb -0.02 -0.05 0.05 0.00 -1.43 0.00 0.00 32.58 31.13 1x5f s HIS 9 CO 0.25 -0.18 -0.08 0.00 -2.00 0.00 0.00 174.74 172.73 1x5f s ALA 10 N -0.87 1.87 0.86 -1.38 0.00 -1.26 -5.13 121.76 115.86 1x5f s ALA 10 Ca -0.10 -1.14 -0.11 0.00 0.00 0.00 0.00 51.96 50.61 1x5f s ALA 10 Cb -0.06 -1.27 0.11 0.00 0.00 0.00 0.00 23.12 21.90 1x5f s ALA 10 CO 0.01 -0.88 1.09 -1.25 0.00 0.00 0.00 175.76 174.73 1x5f s PRO 11 N 1.45 1.53 0.00 0.00 0.04 -1.26 -5.08 135.00 131.69 1x5f s PRO 11 Ca -0.02 0.92 0.02 0.00 0.04 0.00 0.00 61.00 61.97 1x5f s PRO 11 Cb -0.16 -1.83 -0.01 0.00 0.04 0.00 0.00 34.50 32.53 1x5f s PRO 11 CO -0.08 -2.08 -0.08 0.00 0.04 0.00 0.00 177.00 174.80 1x5f s ALA 12 N -2.92 0.66 0.25 8.56 0.00 -1.26 -5.13 121.76 121.91 1x5f s ALA 12 Ca 0.63 -0.40 -0.30 0.00 0.00 0.00 0.00 51.96 51.89 1x5f s ALA 12 Cb -0.18 -0.15 -0.09 0.00 0.00 0.00 0.00 23.12 22.71 1x5f s ALA 12 CO 0.57 0.14 1.27 0.95 0.00 0.00 0.00 175.76 178.69 1x5f s THR 13 N -0.32 3.15 -0.25 0.00 -4.23 -1.26 -5.02 115.64 107.71 1x5f s THR 13 Ca 0.02 1.03 -0.26 0.00 -1.18 0.00 0.00 61.69 61.30 1x5f s THR 13 Cb -0.04 -3.66 0.09 0.00 1.34 0.00 0.00 72.50 70.24 1x5f s THR 13 CO -0.00 0.19 0.84 0.28 -0.54 0.00 0.00 174.62 175.39 1x5f s THR 14 N -0.44 0.00 0.00 3.99 -1.32 -1.26 -5.17 115.64 111.45 1x5f s THR 14 Ca 0.52 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 61.00 1x5f s THR 14 Cb -0.36 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 69.63 1x5f s THR 14 CO 0.42 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.44 1x5f n GLY 15 N 2.24 -0.25 3.77 6.08 0.00 -1.26 -4.99 105.19 110.78 1x5f n GLY 15 Ca -0.14 -1.32 -0.37 0.00 0.00 0.00 0.00 46.02 44.19 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 0.00 3.80 0.10 1.61 0.04 -1.26 -5.05 135.00 134.24 1x5f s PRO 16 Ca 0.00 1.79 0.04 0.00 0.04 0.00 0.00 61.00 62.87 1x5f s PRO 16 Cb 0.00 -2.45 -0.04 0.00 0.04 0.00 0.00 34.50 32.05 1x5f s PRO 16 CO 0.00 -0.52 0.10 -0.51 0.04 0.00 0.00 177.00 176.11 1x5f s LEU 17 N -2.94 3.82 0.00 -3.56 1.43 -1.26 -4.99 118.68 111.18 1x5f s LEU 17 Ca 0.63 -0.04 -0.12 0.00 -1.03 0.00 0.00 54.13 53.57 1x5f s LEU 17 Cb -0.29 -2.48 0.18 0.00 0.03 0.00 0.00 46.19 43.63 1x5f s LEU 17 CO 0.36 0.14 0.65 -0.81 0.23 0.00 0.00 176.35 176.91 1x5f n PRO 18 N 0.21 -2.30 -4.70 1.29 -0.04 -1.26 -4.92 135.00 123.28 1x5f n PRO 18 Ca -0.08 -1.03 -0.28 0.00 -0.04 0.00 0.00 63.50 62.06 1x5f n PRO 18 Cb 0.52 -0.97 -0.14 0.00 -0.04 0.00 0.00 33.50 32.87 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 -3.25 3.01 0.68 3.54 0.15 -1.26 -3.25 113.70 113.32 1x5f s SER 19 Ca 0.42 -0.62 -0.17 0.00 0.70 0.00 0.00 55.95 56.29 1x5f s SER 19 Cb -0.04 -0.25 -0.03 0.00 -1.71 0.00 0.00 66.02 64.00 1x5f s SER 19 CO 0.32 0.21 0.80 0.00 1.20 0.00 0.00 173.24 175.77 1x5f n ALA 20 N 1.56 -0.58 -1.17 5.45 0.00 -1.14 -4.65 120.51 119.98 1x5f n ALA 20 Ca -0.17 -0.15 -0.29 0.00 0.00 0.00 0.00 53.44 52.83 1x5f n ALA 20 Cb 0.53 -2.01 0.17 0.00 0.00 0.00 0.00 19.45 18.13 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 -2.93 0.53 0.27 0.00 0.04 -1.26 -4.54 135.00 127.12 1x5f s PRO 21 Ca 0.71 0.57 0.01 0.00 0.04 0.00 0.00 61.00 62.33 1x5f s PRO 21 Cb -0.37 -1.75 0.01 0.00 0.04 0.00 0.00 34.50 32.43 1x5f s PRO 21 CO 0.52 -2.67 0.06 0.54 0.04 0.00 0.00 177.00 175.48 1x5f n ARG 22 N -4.14 1.27 -2.92 4.56 1.74 -1.20 -4.74 116.66 111.23 1x5f n ARG 22 Ca 0.05 -1.93 -0.19 0.00 -0.77 0.00 0.00 57.85 55.02 1x5f n ARG 22 Cb 0.57 0.44 0.00 0.00 -1.02 0.00 0.00 32.46 32.45 1x5f n ARG 22 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 1x5f n ASP 23 N -1.36 -4.15 -4.56 0.55 9.92 -1.26 -0.18 116.55 115.51 1x5f n ASP 23 Ca -0.09 -0.13 -0.39 0.00 -0.53 0.00 0.00 54.79 53.66 1x5f n ASP 23 Cb 0.34 -3.46 -0.03 0.00 -0.64 0.00 0.00 41.12 37.33 1x5f n ASP 23 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 1x5f s VAL 24 N -2.83 3.26 0.09 2.53 1.01 -1.26 -4.01 120.40 119.19 1x5f s VAL 24 Ca 0.22 0.18 -0.03 0.00 0.00 0.00 0.00 61.98 62.35 1x5f s VAL 24 Cb -0.11 -3.61 -0.03 0.00 0.00 0.00 0.00 36.38 32.62 1x5f s VAL 24 CO 0.27 -0.56 0.05 0.68 0.00 0.00 0.00 175.10 175.53 1x5f s VAL 25 N 9.64 0.16 -0.49 2.92 -7.23 0.10 -4.99 120.40 120.51 1x5f s VAL 25 Ca 0.78 -1.74 -0.17 0.00 -1.81 0.00 0.00 61.98 59.04 1x5f s VAL 25 Cb -0.16 -1.71 0.07 0.00 0.56 0.00 0.00 36.38 35.13 1x5f s VAL 25 CO 0.24 -0.71 0.50 0.00 -0.31 0.00 0.00 175.10 174.83 1x5f s ALA 26 N -3.96 3.48 0.55 1.32 0.00 -1.26 0.96 121.76 122.85 1x5f s ALA 26 Ca 0.14 -1.95 0.24 0.00 0.00 0.00 0.00 51.96 50.39 1x5f s ALA 26 Cb 0.07 -3.20 1.44 0.00 0.00 0.00 0.00 23.12 21.43 1x5f s ALA 26 CO -0.05 -1.86 2.06 1.03 0.00 0.00 0.00 175.76 176.94 1x5f h SER 27 N 8.87 0.00 -5.00 0.00 0.87 -0.68 -3.43 113.55 114.17 1x5f h SER 27 Ca -0.28 0.00 -0.06 0.00 -1.23 0.00 0.00 61.79 60.22 1x5f h SER 27 Cb 1.10 0.00 -0.18 0.00 -0.44 0.00 0.00 62.40 62.89 1x5f h SER 27 CO 0.92 0.00 0.16 -0.22 -0.53 0.00 0.00 176.83 177.16 1x5f s LEU 28 N -8.47 -0.53 -0.28 2.23 0.20 -0.99 -4.97 118.68 105.87 1x5f s LEU 28 Ca -0.05 0.53 0.01 0.00 0.69 0.00 0.00 54.13 55.32 1x5f s LEU 28 Cb 0.18 2.46 0.08 0.00 -0.43 0.00 0.00 46.19 48.47 1x5f s LEU 28 CO 0.66 -0.67 0.01 -0.69 -0.29 0.00 0.00 176.35 175.38 1x5f s VAL 29 N -1.70 1.49 0.49 1.68 1.01 -1.26 0.10 120.40 122.22 1x5f s VAL 29 Ca -0.09 -1.50 -0.01 0.00 0.00 0.00 0.00 61.98 60.38 1x5f s VAL 29 Cb -0.00 -1.94 0.00 0.00 0.00 0.00 0.00 36.38 34.44 1x5f s VAL 29 CO 0.05 -0.37 0.72 -0.55 0.00 0.00 0.00 175.10 174.95 1x5f s SER 30 N 1.36 5.72 0.37 3.32 0.15 0.23 -4.62 113.70 120.23 1x5f s SER 30 Ca 0.02 0.32 0.26 0.00 0.70 0.00 0.00 55.95 57.25 1x5f s SER 30 Cb -0.18 -1.48 0.72 0.00 -1.71 0.00 0.00 66.02 63.36 1x5f s SER 30 CO -0.12 -0.82 1.73 0.71 1.20 0.00 0.00 173.24 175.95 1x5f h THR 31 N 0.26 0.00 0.00 6.45 1.35 -1.96 -3.24 112.91 115.78 1x5f h THR 31 Ca -0.46 -0.68 0.00 0.00 -0.55 0.00 0.00 66.41 64.73 1x5f h THR 31 Cb 1.26 1.65 0.00 0.00 -1.73 0.00 0.00 68.15 69.33 1x5f h THR 31 CO 0.57 0.00 0.00 0.54 -0.25 0.00 0.00 175.52 176.38 1x5f n ARG 32 N -2.76 2.69 -3.68 4.72 1.74 -1.26 -2.30 116.66 115.81 1x5f n ARG 32 Ca 0.04 -0.26 -0.07 0.00 -0.77 0.00 0.00 57.85 56.78 1x5f n ARG 32 Cb 0.43 -0.76 0.03 0.00 -1.02 0.00 0.00 32.46 31.14 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 -0.46 -2.11 -3.69 -1.55 1.16 -1.22 -1.28 117.46 108.31 1x5f n PHE 33 Ca 0.00 -1.67 -0.11 0.00 -1.87 0.00 0.00 57.45 53.80 1x5f n PHE 33 Cb 0.00 0.83 -0.12 0.00 -1.61 0.00 0.00 39.48 38.59 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 -2.13 -0.19 -0.20 1.97 1.01 -1.03 0.76 121.20 121.39 1x5f s ILE 34 Ca 0.17 0.15 -0.26 0.00 0.00 0.00 0.00 60.65 60.71 1x5f s ILE 34 Cb -0.04 -0.53 -0.01 0.00 0.01 0.00 0.00 42.46 41.89 1x5f s ILE 34 CO 0.10 0.06 0.87 -0.75 0.00 0.00 0.00 174.94 175.23 1x5f s LYS 35 N 1.72 4.26 0.17 2.79 2.47 0.29 -2.57 119.74 128.86 1x5f s LYS 35 Ca -0.07 1.06 0.04 0.00 -1.56 0.00 0.00 55.97 55.45 1x5f s LYS 35 Cb -0.10 -3.61 -0.04 0.00 -1.46 0.00 0.00 37.83 32.63 1x5f s LYS 35 CO -0.11 -0.44 0.22 -0.51 0.16 0.00 0.00 175.35 174.67 1x5f s LEU 36 N 2.55 4.09 -0.25 5.43 2.01 -0.18 -0.02 118.68 132.31 1x5f s LEU 36 Ca 0.38 0.02 -0.10 0.00 0.01 0.00 0.00 54.13 54.44 1x5f s LEU 36 Cb -0.16 -2.67 0.10 0.00 0.01 0.00 0.00 46.19 43.47 1x5f s LEU 36 CO 0.10 0.05 0.56 0.42 1.01 0.00 0.00 176.35 178.49 1x5f s THR 37 N -1.78 -0.53 0.16 5.49 -4.23 0.27 -2.60 115.64 112.42 1x5f s THR 37 Ca 0.33 0.06 -0.01 0.00 -1.18 0.00 0.00 61.69 60.88 1x5f s THR 37 Cb -0.10 -0.85 -0.04 0.00 1.34 0.00 0.00 72.50 72.85 1x5f s THR 37 CO 0.26 0.02 0.09 -1.66 -0.54 0.00 0.00 174.62 172.80 1x5f s TRP 38 N 2.31 0.94 0.56 3.99 -2.14 -0.28 -0.72 118.94 123.59 1x5f s TRP 38 Ca -0.06 -1.26 0.09 0.00 2.66 0.00 0.00 56.10 57.53 1x5f s TRP 38 Cb -0.10 -0.49 0.07 0.00 -3.10 0.00 0.00 33.47 29.86 1x5f s TRP 38 CO -0.17 -0.57 0.73 1.03 -2.66 0.00 0.00 176.95 175.31 1x5f s ARG 39 N -4.08 2.35 0.50 3.25 1.81 0.75 -4.68 118.95 118.84 1x5f s ARG 39 Ca 0.29 -1.65 -0.21 0.00 -1.72 0.00 0.00 55.73 52.44 1x5f s ARG 39 Cb 0.07 -2.59 -0.07 0.00 -0.45 0.00 0.00 34.95 31.91 1x5f s ARG 39 CO 0.05 -0.78 1.13 0.95 -0.68 0.00 0.00 175.30 175.97 1x5f s THR 40 N -2.65 3.24 0.56 0.02 -4.23 -1.26 -3.26 115.64 108.05 1x5f s THR 40 Ca 0.58 0.84 -0.19 0.00 -1.18 0.00 0.00 61.69 61.74 1x5f s THR 40 Cb -0.06 -3.38 -0.05 0.00 1.34 0.00 0.00 72.50 70.36 1x5f s THR 40 CO 0.36 -0.10 1.13 -2.16 -0.54 0.00 0.00 174.62 173.31 1x5f s PRO 41 N -3.02 3.27 0.57 3.99 0.04 -1.14 -4.22 135.00 134.50 1x5f s PRO 41 Ca 0.68 1.58 0.27 0.00 0.04 0.00 0.00 61.00 63.57 1x5f s PRO 41 Cb -0.25 -2.00 1.59 0.00 0.04 0.00 0.00 34.50 33.89 1x5f s PRO 41 CO 0.29 -0.91 2.11 0.00 0.04 0.00 0.00 177.00 178.53 1x5f h ALA 42 N 1.02 1.89 0.16 8.56 0.00 -1.84 -1.20 119.26 127.85 1x5f h ALA 42 Ca -0.50 -0.01 -0.31 0.00 0.00 0.00 0.00 54.91 54.10 1x5f h ALA 42 Cb 1.26 0.01 0.01 0.00 0.00 0.00 0.00 17.79 19.07 1x5f h ALA 42 CO 0.56 -0.26 -1.44 0.66 0.00 0.00 0.00 179.25 178.77 1x5f h SER 43 N 0.00 0.54 -3.85 0.00 4.64 -1.91 -3.42 113.55 109.56 1x5f h SER 43 Ca 0.09 -0.64 -0.66 0.00 -0.47 0.00 0.00 61.79 60.10 1x5f h SER 43 Cb 0.43 -0.18 -0.40 0.00 -0.31 0.00 0.00 62.40 61.95 1x5f h SER 43 CO -0.00 1.52 -0.67 -1.81 -0.87 0.00 0.00 176.83 174.99 1x5f s ASP 44 N -7.22 4.72 0.00 4.97 1.01 -0.46 -4.94 116.67 114.75 1x5f s ASP 44 Ca -0.08 -2.37 0.15 0.00 0.71 0.00 0.00 52.55 50.96 1x5f s ASP 44 Cb 0.06 -1.66 0.69 0.00 1.01 0.00 0.00 42.92 43.03 1x5f s ASP 44 CO 0.89 -0.36 1.43 -0.81 0.21 0.00 0.00 175.17 176.53 1x5f n PRO 45 N 3.99 0.12 -0.00 8.23 -0.04 -1.22 -2.88 135.00 143.20 1x5f n PRO 45 Ca 0.04 0.19 -0.00 0.00 -0.04 0.00 0.00 63.50 63.69 1x5f n PRO 45 Cb 0.39 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.34 1x5f n PRO 45 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 1x5f n HIS 46 N -1.37 0.00 -2.76 0.54 8.25 -1.26 -4.91 115.22 113.70 1x5f n HIS 46 Ca 0.06 0.00 -0.17 0.00 -0.26 0.00 0.00 57.72 57.34 1x5f n HIS 46 Cb 0.14 -0.06 -0.03 0.00 1.12 0.00 0.00 29.99 31.16 1x5f n HIS 46 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1x5f n GLY 47 N 2.74 -0.24 0.06 -1.41 0.00 -1.14 -4.66 105.19 100.54 1x5f n GLY 47 Ca -0.02 0.03 0.01 0.00 0.00 0.00 0.00 46.02 46.04 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 -0.99 0.14 -1.69 1.61 -0.08 -1.26 -3.81 116.55 110.47 1x5f n ASP 48 Ca 0.05 0.06 0.02 0.00 -1.51 0.00 0.00 54.79 53.41 1x5f n ASP 48 Cb 0.26 1.28 0.30 0.00 2.34 0.00 0.00 41.12 45.31 1x5f n ASP 48 CO 0.00 0.00 0.00 -0.46 0.12 0.00 0.00 177.20 176.86 1x5f n ASN 49 N -2.57 4.69 -3.73 1.67 2.04 -1.26 -4.45 115.26 111.65 1x5f n ASN 49 Ca -0.17 -2.84 -0.12 0.00 -0.44 0.00 0.00 54.58 51.01 1x5f n ASN 49 Cb 0.86 -0.67 -0.11 0.00 -2.53 0.00 0.00 39.78 37.32 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 -2.31 0.39 0.74 -4.53 0.05 -1.26 -4.47 118.68 107.29 1x5f s LEU 50 Ca 0.45 0.73 -0.12 0.00 0.05 0.00 0.00 54.13 55.24 1x5f s LEU 50 Cb 0.35 1.15 0.03 0.00 -2.05 0.00 0.00 46.19 45.68 1x5f s LEU 50 CO 0.12 -0.15 1.12 -0.89 -0.55 0.00 0.00 176.35 176.00 1x5f s THR 51 N 0.76 3.10 -0.11 5.48 2.01 0.13 -3.17 115.64 123.84 1x5f s THR 51 Ca -0.05 0.36 0.03 0.00 0.31 0.00 0.00 61.69 62.34 1x5f s THR 51 Cb -0.06 -3.34 0.01 0.00 0.01 0.00 0.00 72.50 69.12 1x5f s THR 51 CO -0.05 -0.47 -0.20 -0.31 -0.69 0.00 0.00 174.62 172.90 1x5f s TYR 52 N -3.40 2.31 -0.05 4.92 2.02 -1.26 0.63 117.35 122.52 1x5f s TYR 52 Ca 0.59 -1.03 -0.03 0.00 -0.37 0.00 0.00 57.07 56.24 1x5f s TYR 52 Cb -0.11 -1.59 -0.04 0.00 -0.40 0.00 0.00 41.96 39.82 1x5f s TYR 52 CO 0.51 -0.46 0.09 -1.12 -1.57 0.00 0.00 175.55 173.00 1x5f s SER 53 N 0.64 5.86 -0.19 2.29 0.01 0.97 -2.74 113.70 120.54 1x5f s SER 53 Ca -0.13 0.26 0.01 0.00 1.31 0.00 0.00 55.95 57.40 1x5f s SER 53 Cb -0.16 -1.76 0.04 0.00 0.21 0.00 0.00 66.02 64.34 1x5f s SER 53 CO 0.03 0.33 -0.12 -0.69 0.41 0.00 0.00 173.24 173.20 1x5f s VAL 54 N -1.10 1.71 -0.29 3.43 1.01 -1.19 -0.99 120.40 122.98 1x5f s VAL 54 Ca 0.19 -0.98 -0.10 0.00 0.00 0.00 0.00 61.98 61.09 1x5f s VAL 54 Cb -0.12 -1.73 -0.03 0.00 0.00 0.00 0.00 36.38 34.50 1x5f s VAL 54 CO 0.09 0.24 0.17 -0.36 0.00 0.00 0.00 175.10 175.24 1x5f s PHE 55 N 1.38 3.18 0.01 5.22 0.40 0.14 -1.75 117.98 126.56 1x5f s PHE 55 Ca -0.00 -0.23 0.07 0.00 -0.60 0.00 0.00 56.93 56.17 1x5f s PHE 55 Cb -0.16 -2.37 -0.03 0.00 0.51 0.00 0.00 43.02 40.98 1x5f s PHE 55 CO -0.09 -0.32 -0.21 1.52 0.70 0.00 0.00 175.22 176.82 1x5f s TYR 56 N 1.69 2.47 -0.20 0.36 1.13 -1.01 -0.47 117.35 121.33 1x5f s TYR 56 Ca 0.06 -0.32 -0.27 0.00 -1.41 0.00 0.00 57.07 55.13 1x5f s TYR 56 Cb -0.16 -1.49 0.08 0.00 -1.10 0.00 0.00 41.96 39.29 1x5f s TYR 56 CO 0.08 0.13 0.79 -0.08 -2.51 0.00 0.00 175.55 173.96 1x5f s THR 57 N -0.77 0.00 0.19 -3.49 -1.32 -1.17 -1.93 115.64 107.15 1x5f s THR 57 Ca 0.12 0.00 -0.30 0.00 -1.21 0.00 0.00 61.69 60.30 1x5f s THR 57 Cb -0.10 -1.00 -0.08 0.00 -1.51 0.00 0.00 72.50 69.80 1x5f s THR 57 CO 0.02 0.00 1.28 -0.75 -2.21 0.00 0.00 174.62 172.96 1x5f s LYS 58 N -0.26 4.41 0.42 7.08 2.20 -1.26 -0.67 119.74 131.66 1x5f s LYS 58 Ca -0.03 2.01 0.32 0.00 -0.36 0.00 0.00 55.97 57.91 1x5f s LYS 58 Cb -0.03 -3.21 1.42 0.00 -1.51 0.00 0.00 37.83 34.50 1x5f s LYS 58 CO 0.03 -0.22 1.46 -1.91 -0.36 0.00 0.00 175.35 174.34 1x5f n GLU 59 N 2.66 -0.03 -0.01 4.03 0.00 -1.25 0.36 120.64 126.40 1x5f n GLU 59 Ca 0.06 1.15 -0.20 0.00 0.00 0.00 0.00 57.16 58.17 1x5f n GLU 59 Cb 0.43 -2.31 -0.14 0.00 0.00 0.00 0.00 31.44 29.43 1x5f n GLU 59 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.13 177.91 1x5f h GLY 60 N 0.00 0.21 -4.70 8.31 0.00 -1.91 -3.46 103.07 101.53 1x5f h GLY 60 Ca 0.83 -0.53 -0.52 0.00 0.00 0.00 0.00 47.33 47.10 1x5f h GLY 60 CO -0.39 0.47 0.98 -0.42 0.00 0.00 0.00 176.54 177.17 1x5f s ILE 61 N -2.41 2.36 -0.49 2.60 1.01 0.16 -4.88 121.20 119.55 1x5f s ILE 61 Ca -0.20 0.20 0.06 0.00 0.00 0.00 0.00 60.65 60.71 1x5f s ILE 61 Cb 0.03 -3.13 0.42 0.00 0.01 0.00 0.00 42.46 39.79 1x5f s ILE 61 CO 0.74 0.01 1.27 0.00 0.00 0.00 0.00 174.94 176.96 1x5f n ALA 62 N 4.29 3.52 -2.70 9.38 0.00 -1.26 -4.29 120.51 129.45 1x5f n ALA 62 Ca 0.15 -1.19 -0.18 0.00 0.00 0.00 0.00 53.44 52.23 1x5f n ALA 62 Cb 0.37 -1.12 -0.13 0.00 0.00 0.00 0.00 19.45 18.57 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 -1.90 0.76 0.16 0.00 0.52 -1.26 -5.15 118.95 112.08 1x5f s ARG 63 Ca 0.30 -0.58 0.04 0.00 -0.52 0.00 0.00 55.73 54.98 1x5f s ARG 63 Cb 0.24 -0.71 -0.05 0.00 0.52 0.00 0.00 34.95 34.94 1x5f s ARG 63 CO 0.08 0.18 -0.09 -1.83 0.02 0.00 0.00 175.30 173.66 1x5f s GLU 64 N -0.85 1.11 -0.04 3.54 1.03 -1.26 -4.45 118.70 117.78 1x5f s GLU 64 Ca 0.00 -1.49 0.06 0.00 0.03 0.00 0.00 54.97 53.57 1x5f s GLU 64 Cb -0.06 -0.64 -0.01 0.00 -0.80 0.00 0.00 34.13 32.61 1x5f s GLU 64 CO 0.00 0.06 -0.21 1.03 -1.33 0.00 0.00 175.26 174.81 1x5f s ARG 65 N -3.76 1.98 -0.13 -4.83 1.81 -0.81 -4.90 118.95 108.32 1x5f s ARG 65 Ca 0.18 -0.76 -0.14 0.00 -1.72 0.00 0.00 55.73 53.29 1x5f s ARG 65 Cb 0.03 -1.79 -0.05 0.00 -0.45 0.00 0.00 34.95 32.69 1x5f s ARG 65 CO 0.02 0.38 0.32 0.54 -0.68 0.00 0.00 175.30 175.88 1x5f s VAL 66 N -0.26 5.27 -0.28 3.52 0.11 -1.26 -2.40 120.40 125.10 1x5f s VAL 66 Ca 0.02 0.61 0.02 0.00 -2.93 0.00 0.00 61.98 59.69 1x5f s VAL 66 Cb -0.11 -3.65 0.08 0.00 -1.53 0.00 0.00 36.38 31.17 1x5f s VAL 66 CO 0.01 0.43 -0.01 -0.70 -3.33 0.00 0.00 175.10 171.50 1x5f s GLU 67 N 0.13 1.56 -0.01 1.54 -6.30 -0.72 -4.91 118.70 110.00 1x5f s GLU 67 Ca 0.18 -1.32 -0.30 0.00 -2.50 0.00 0.00 54.97 51.04 1x5f s GLU 67 Cb -0.14 -2.73 -0.05 0.00 0.00 0.00 0.00 34.13 31.21 1x5f s GLU 67 CO 0.06 -0.74 1.38 -0.80 0.02 0.00 0.00 175.26 175.17 1x5f s ASN 68 N 1.23 6.88 -0.03 -1.70 -0.87 -1.26 -3.15 114.94 116.04 1x5f s ASN 68 Ca 0.01 2.07 -0.36 0.00 -1.57 0.00 0.00 52.86 53.00 1x5f s ASN 68 Cb -0.19 -2.56 -0.14 0.00 -0.02 0.00 0.00 41.25 38.34 1x5f s ASN 68 CO -0.09 -0.71 1.63 0.35 -2.57 0.00 0.00 177.10 175.72 1x5f n THR 69 N 4.69 0.22 -0.28 1.60 -2.24 -1.11 -4.76 114.28 112.40 1x5f n THR 69 Ca 0.13 -0.04 0.25 0.00 -2.27 0.00 0.00 64.05 62.12 1x5f n THR 69 Cb 0.44 -1.37 0.45 0.00 -2.10 0.00 0.00 70.33 67.75 1x5f n THR 69 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1x5f n SER 70 N 4.48 0.19 -4.10 3.42 7.64 -1.26 -4.16 113.62 119.83 1x5f n SER 70 Ca 0.21 1.06 -0.18 0.00 1.01 0.00 0.00 58.87 60.97 1x5f n SER 70 Cb 0.23 -0.52 -0.13 0.00 -1.01 0.00 0.00 64.21 62.77 1x5f n SER 70 CO 0.00 0.00 0.00 -1.00 -3.01 0.00 0.00 175.04 171.03 1x5f s HIS 71 N -4.90 1.01 0.15 1.43 3.76 -1.26 -5.13 115.29 110.34 1x5f s HIS 71 Ca -0.06 -0.33 -0.31 0.00 -0.15 0.00 0.00 55.06 54.21 1x5f s HIS 71 Cb 0.23 -0.61 -0.08 0.00 1.11 0.00 0.00 32.58 33.23 1x5f s HIS 71 CO 0.56 0.00 1.34 -1.25 -0.85 0.00 0.00 174.74 174.54 1x5f s PRO 72 N -1.03 4.36 0.00 8.40 0.04 -1.26 -2.76 135.00 142.75 1x5f s PRO 72 Ca -0.00 2.04 0.00 0.00 0.04 0.00 0.00 61.00 63.08 1x5f s PRO 72 Cb -0.07 -3.23 0.00 0.00 0.04 0.00 0.00 34.50 31.24 1x5f s PRO 72 CO 0.01 -0.34 0.00 0.41 0.04 0.00 0.00 177.00 177.12 1x5f n GLY 73 N 2.98 0.70 3.61 0.56 0.00 -1.19 -4.90 105.19 106.95 1x5f n GLY 73 Ca 0.09 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.65 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 -2.00 1.99 0.00 1.61 2.13 -1.11 -4.81 120.64 118.45 1x5f n GLU 74 Ca 0.00 0.65 0.07 0.00 0.66 0.00 0.00 57.16 58.54 1x5f n GLU 74 Cb 0.00 -2.85 0.42 0.00 0.27 0.00 0.00 31.44 29.29 1x5f n GLU 74 CO 0.00 0.00 0.00 -1.33 -0.41 0.00 0.00 177.13 175.39 1x5f n MET 75 N 7.75 0.96 -3.79 5.31 2.81 -1.26 -4.75 117.12 124.15 1x5f n MET 75 Ca 0.28 0.00 -0.13 0.00 -1.81 0.00 0.00 57.70 56.05 1x5f n MET 75 Cb 0.34 -1.23 -0.11 0.00 -0.71 0.00 0.00 33.22 31.52 1x5f n MET 75 CO 0.00 0.00 0.00 -0.65 1.51 0.00 0.00 175.97 176.83 1x5f s GLN 76 N -2.00 0.39 0.06 0.03 1.11 -1.26 -1.13 119.66 116.86 1x5f s GLN 76 Ca 0.21 0.18 -0.06 0.00 0.01 0.00 0.00 55.36 55.70 1x5f s GLN 76 Cb 0.10 0.18 -0.01 0.00 -1.01 0.00 0.00 33.01 32.27 1x5f s GLN 76 CO 0.16 -0.07 0.12 0.54 0.01 0.00 0.00 175.29 176.05 1x5f s VAL 77 N -0.30 0.15 -0.12 1.09 0.11 -1.07 -4.96 120.40 115.30 1x5f s VAL 77 Ca -0.04 -1.24 0.01 0.00 -2.93 0.00 0.00 61.98 57.77 1x5f s VAL 77 Cb -0.03 -1.19 -0.01 0.00 -1.53 0.00 0.00 36.38 33.62 1x5f s VAL 77 CO 0.01 -0.69 -0.16 -0.89 -3.33 0.00 0.00 175.10 170.04 1x5f s THR 78 N -3.34 2.72 -0.57 5.04 2.01 -1.26 -1.02 115.64 119.22 1x5f s THR 78 Ca 0.01 -0.78 -0.05 0.00 0.31 0.00 0.00 61.69 61.18 1x5f s THR 78 Cb 0.03 -2.12 0.15 0.00 0.01 0.00 0.00 72.50 70.57 1x5f s THR 78 CO -0.08 0.53 0.40 -0.63 -0.69 0.00 0.00 174.62 174.15 1x5f s ILE 79 N 0.40 3.86 0.75 1.82 -1.09 -1.06 -4.97 121.20 120.91 1x5f s ILE 79 Ca -0.13 -2.52 -0.04 0.00 -2.23 0.00 0.00 60.65 55.73 1x5f s ILE 79 Cb -0.16 -3.53 0.13 0.00 -1.58 0.00 0.00 42.46 37.31 1x5f s ILE 79 CO 0.06 -0.83 1.05 -1.10 -1.23 0.00 0.00 174.94 172.88 1x5f s GLN 80 N 0.47 1.61 -0.50 2.79 -0.21 -1.26 -2.48 119.66 120.08 1x5f s GLN 80 Ca 0.13 -0.83 -0.03 0.00 0.02 0.00 0.00 55.36 54.65 1x5f s GLN 80 Cb -0.21 -2.23 0.00 0.00 1.00 0.00 0.00 33.01 31.58 1x5f s GLN 80 CO -0.04 -1.56 0.43 0.09 -2.12 0.00 0.00 175.29 172.10 1x5f n ASN 81 N -2.99 -3.48 -4.71 5.90 3.02 -0.90 -4.93 115.26 107.17 1x5f n ASN 81 Ca 0.14 -0.20 -0.24 0.00 -0.03 0.00 0.00 54.58 54.25 1x5f n ASN 81 Cb 0.60 -2.17 -0.07 0.00 -0.61 0.00 0.00 39.78 37.53 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 -3.35 3.15 -0.12 3.41 1.43 -0.40 -5.04 118.68 117.76 1x5f s LEU 82 Ca 0.20 -0.92 -0.06 0.00 -1.03 0.00 0.00 54.13 52.32 1x5f s LEU 82 Cb -0.09 -1.55 -0.04 0.00 0.03 0.00 0.00 46.19 44.54 1x5f s LEU 82 CO 0.27 -0.36 0.09 -0.32 0.23 0.00 0.00 176.35 176.25 1x5f s MET 83 N -3.84 3.41 0.63 1.70 -2.45 -1.26 -4.49 119.30 113.01 1x5f s MET 83 Ca 0.38 -0.25 -0.16 0.00 -1.25 0.00 0.00 55.69 54.41 1x5f s MET 83 Cb 0.00 -3.09 -0.02 0.00 1.25 0.00 0.00 34.83 32.98 1x5f s MET 83 CO 0.22 0.66 1.11 -1.25 1.05 0.00 0.00 175.02 176.82 1x5f s PRO 84 N -0.73 2.94 -1.52 4.11 0.04 -0.97 -3.56 135.00 135.32 1x5f s PRO 84 Ca 0.13 1.44 -0.12 0.00 0.04 0.00 0.00 61.00 62.48 1x5f s PRO 84 Cb -0.12 -1.97 0.08 0.00 0.04 0.00 0.00 34.50 32.54 1x5f s PRO 84 CO 0.03 -1.14 0.93 0.00 0.04 0.00 0.00 177.00 176.85 1x5f n ALA 85 N -2.14 -1.38 -3.73 8.56 0.00 -1.15 -4.85 120.51 115.83 1x5f n ALA 85 Ca 0.11 0.13 -0.17 0.00 0.00 0.00 0.00 53.44 53.51 1x5f n ALA 85 Cb 0.52 -4.08 -0.16 0.00 0.00 0.00 0.00 19.45 15.72 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 -3.36 0.09 0.37 0.00 2.01 -1.23 -4.90 115.64 108.62 1x5f s THR 86 Ca 0.58 0.16 -0.25 0.00 0.31 0.00 0.00 61.69 62.49 1x5f s THR 86 Cb -0.29 -0.21 -0.09 0.00 0.01 0.00 0.00 72.50 71.91 1x5f s THR 86 CO 0.84 0.14 1.07 -0.69 -0.69 0.00 0.00 174.62 175.28 1x5f s VAL 87 N 1.19 3.62 -0.04 3.82 1.01 -1.26 -2.77 120.40 125.98 1x5f s VAL 87 Ca -0.08 1.34 -0.02 0.00 0.00 0.00 0.00 61.98 63.22 1x5f s VAL 87 Cb -0.13 -3.74 0.02 0.00 0.00 0.00 0.00 36.38 32.53 1x5f s VAL 87 CO -0.02 0.10 0.09 -0.31 0.00 0.00 0.00 175.10 174.95 1x5f s TYR 88 N -1.52 -0.09 -0.55 5.22 2.02 0.14 -3.76 117.35 118.80 1x5f s TYR 88 Ca 0.55 0.26 -0.18 0.00 -0.37 0.00 0.00 57.07 57.33 1x5f s TYR 88 Cb -0.25 -0.03 0.09 0.00 -0.40 0.00 0.00 41.96 41.38 1x5f s TYR 88 CO 0.31 -0.07 0.63 0.42 -1.57 0.00 0.00 175.55 175.27 1x5f s ILE 89 N 0.41 4.91 0.10 2.71 -1.09 0.15 -1.39 121.20 127.00 1x5f s ILE 89 Ca -0.03 -0.93 -0.18 0.00 -2.23 0.00 0.00 60.65 57.28 1x5f s ILE 89 Cb -0.04 -4.39 -0.07 0.00 -1.58 0.00 0.00 42.46 36.38 1x5f s ILE 89 CO -0.02 -0.97 0.57 -0.36 -1.23 0.00 0.00 174.94 172.93 1x5f s PHE 90 N 2.45 3.75 -0.07 3.97 0.40 -0.21 -3.04 117.98 125.23 1x5f s PHE 90 Ca 0.11 1.22 -0.01 0.00 -0.60 0.00 0.00 56.93 57.65 1x5f s PHE 90 Cb -0.24 -2.47 0.03 0.00 0.51 0.00 0.00 43.02 40.85 1x5f s PHE 90 CO 0.07 0.54 -0.02 1.03 0.70 0.00 0.00 175.22 177.54 1x5f s ARG 91 N -1.37 0.75 -0.07 0.44 0.52 0.39 -0.80 118.95 118.81 1x5f s ARG 91 Ca 0.32 0.03 -0.10 0.00 -0.52 0.00 0.00 55.73 55.46 1x5f s ARG 91 Cb -0.18 -1.01 -0.05 0.00 0.52 0.00 0.00 34.95 34.23 1x5f s ARG 91 CO 0.19 -0.26 0.24 0.08 0.02 0.00 0.00 175.30 175.58 1x5f s VAL 92 N 1.74 5.32 -0.03 3.52 1.01 -1.26 -0.68 120.40 130.03 1x5f s VAL 92 Ca 0.02 0.42 -0.10 0.00 0.00 0.00 0.00 61.98 62.33 1x5f s VAL 92 Cb -0.13 -3.52 0.01 0.00 0.00 0.00 0.00 36.38 32.74 1x5f s VAL 92 CO -0.05 0.58 0.21 -0.32 0.00 0.00 0.00 175.10 175.53 1x5f s MET 93 N -1.11 0.47 0.12 2.72 0.00 -0.16 0.30 119.30 121.64 1x5f s MET 93 Ca 0.19 -0.14 -0.03 0.00 0.00 0.00 0.00 55.69 55.71 1x5f s MET 93 Cb -0.14 0.21 -0.05 0.00 0.00 0.00 0.00 34.83 34.85 1x5f s MET 93 CO 0.08 -0.11 0.33 0.00 0.00 0.00 0.00 175.02 175.33 1x5f s ALA 94 N -0.94 3.85 -0.03 4.11 0.00 -1.26 -0.02 121.76 127.47 1x5f s ALA 94 Ca -0.10 -0.65 -0.01 0.00 0.00 0.00 0.00 51.96 51.20 1x5f s ALA 94 Cb -0.05 -2.04 0.03 0.00 0.00 0.00 0.00 23.12 21.06 1x5f s ALA 94 CO 0.02 0.70 0.03 -0.65 0.00 0.00 0.00 175.76 175.86 1x5f s GLN 95 N -2.66 0.09 0.24 0.00 -0.21 0.21 -2.91 119.66 114.42 1x5f s GLN 95 Ca 0.39 0.21 0.01 0.00 0.02 0.00 0.00 55.36 55.99 1x5f s GLN 95 Cb -0.12 -0.45 -0.00 0.00 1.00 0.00 0.00 33.01 33.43 1x5f s GLN 95 CO 0.26 -0.22 0.02 0.27 -2.12 0.00 0.00 175.29 173.50 1x5f n ASN 96 N 4.61 2.18 0.20 5.90 0.23 -1.05 0.17 115.26 127.51 1x5f n ASN 96 Ca -0.18 -2.13 0.11 0.00 -0.53 0.00 0.00 54.58 51.85 1x5f n ASN 96 Cb 0.50 0.30 0.37 0.00 -2.08 0.00 0.00 39.78 38.87 1x5f n ASN 96 CO 0.00 0.00 0.00 0.07 -0.93 0.00 0.00 177.26 176.40 1x5f h LYS 97 N 0.00 0.00 0.00 -3.83 2.10 -2.02 -0.63 116.57 112.19 1x5f h LYS 97 Ca -0.20 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.45 1x5f h LYS 97 Cb 0.64 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.97 1x5f h LYS 97 CO 0.33 0.00 -0.07 0.45 -2.00 0.00 0.00 179.45 178.16 1x5f h HIS 98 N 0.00 0.00 0.00 0.07 3.86 -1.94 -3.51 115.15 113.63 1x5f h HIS 98 Ca 0.12 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.33 1x5f h HIS 98 Cb 1.75 0.00 0.00 0.00 1.06 0.00 0.00 27.41 30.22 1x5f h HIS 98 CO 0.00 0.00 0.00 0.41 0.86 0.00 0.00 177.93 179.20 1x5f n GLY 99 N 1.80 -0.44 3.61 2.45 0.00 -0.24 -5.08 105.19 107.29 1x5f n GLY 99 Ca -0.01 -0.75 -0.42 0.00 0.00 0.00 0.00 46.02 44.84 1x5f n GLY 99 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1x5f s SER 100 N -4.00 6.65 0.00 1.61 1.04 -1.26 -2.53 113.70 115.21 1x5f s SER 100 Ca 0.00 0.59 0.00 0.00 0.48 0.00 0.00 55.95 57.02 1x5f s SER 100 Cb 0.00 -2.42 0.00 0.00 0.10 0.00 0.00 66.02 63.70 1x5f s SER 100 CO 0.00 -0.70 0.00 0.61 0.98 0.00 0.00 173.24 174.13 1x5f n GLY 101 N 4.30 1.38 3.87 7.32 0.00 -1.14 -4.97 105.19 115.94 1x5f n GLY 101 Ca 0.05 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.72 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 0.01 3.36 -0.22 1.61 2.56 -1.20 -4.98 118.70 119.84 1x5f s GLU 102 Ca 0.00 -0.28 -0.21 0.00 0.00 0.00 0.00 54.97 54.48 1x5f s GLU 102 Cb 0.00 -3.08 -0.02 0.00 2.00 0.00 0.00 34.13 33.03 1x5f s GLU 102 CO 0.00 0.71 0.67 -1.54 -0.56 0.00 0.00 175.26 174.54 1x5f s SER 103 N -1.50 6.69 1.12 -1.70 1.04 -1.26 -2.89 113.70 115.20 1x5f s SER 103 Ca 0.21 0.85 -0.18 0.00 0.48 0.00 0.00 55.95 57.31 1x5f s SER 103 Cb -0.12 -2.36 0.11 0.00 0.10 0.00 0.00 66.02 63.75 1x5f s SER 103 CO 0.11 -0.34 0.07 -1.54 0.98 0.00 0.00 173.24 172.53 1x5f n SER 104 N 5.37 -2.33 -4.76 7.02 3.41 0.15 -4.90 113.62 117.58 1x5f n SER 104 Ca 0.00 -0.12 -0.37 0.00 -0.26 0.00 0.00 58.87 58.13 1x5f n SER 104 Cb 0.49 -0.98 0.02 0.00 -0.26 0.00 0.00 64.21 63.48 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 -2.25 2.76 -0.20 7.33 0.00 -1.26 -4.60 121.76 123.54 1x5f s ALA 105 Ca 0.57 1.07 -0.29 0.00 0.00 0.00 0.00 51.96 53.31 1x5f s ALA 105 Cb -0.13 -3.46 -0.03 0.00 0.00 0.00 0.00 23.12 19.50 1x5f s ALA 105 CO 0.66 -1.06 1.59 -1.25 0.00 0.00 0.00 175.76 175.71 1x5f s PRO 106 N -3.01 3.86 -0.18 0.00 0.04 -1.26 -4.63 135.00 129.82 1x5f s PRO 106 Ca 0.71 1.71 -0.16 0.00 0.04 0.00 0.00 61.00 63.31 1x5f s PRO 106 Cb -0.32 -4.01 -0.04 0.00 0.04 0.00 0.00 34.50 30.16 1x5f s PRO 106 CO 0.38 -1.21 0.39 -1.17 0.04 0.00 0.00 177.00 175.42 1x5f s LEU 107 N 4.96 4.19 -0.47 -3.56 2.96 0.02 -4.91 118.68 121.88 1x5f s LEU 107 Ca 0.70 0.56 -0.20 0.00 -0.22 0.00 0.00 54.13 54.97 1x5f s LEU 107 Cb -0.25 -2.51 0.04 0.00 0.50 0.00 0.00 46.19 43.96 1x5f s LEU 107 CO 0.28 -0.03 0.66 -0.60 -1.32 0.00 0.00 176.35 175.35 1x5f s ARG 108 N 1.03 3.23 -0.08 1.98 3.52 -1.26 -1.05 118.95 126.32 1x5f s ARG 108 Ca 0.20 -0.54 0.05 0.00 -0.13 0.00 0.00 55.73 55.31 1x5f s ARG 108 Cb -0.14 -4.01 -0.00 0.00 -1.56 0.00 0.00 34.95 29.23 1x5f s ARG 108 CO 0.07 -1.13 -0.24 0.08 -0.81 0.00 0.00 175.30 173.28 1x5f s VAL 109 N 2.87 2.00 -0.14 7.11 1.01 -0.49 -4.96 120.40 127.80 1x5f s VAL 109 Ca 0.21 -1.01 0.00 0.00 0.00 0.00 0.00 61.98 61.18 1x5f s VAL 109 Cb -0.16 -1.71 -0.01 0.00 0.00 0.00 0.00 36.38 34.50 1x5f s VAL 109 CO 0.17 0.55 -0.15 -0.70 0.00 0.00 0.00 175.10 174.97 1x5f s GLU 110 N 0.12 3.29 1.13 2.72 2.12 -1.26 0.29 118.70 127.10 1x5f s GLU 110 Ca -0.12 -0.73 -0.17 0.00 0.36 0.00 0.00 54.97 54.32 1x5f s GLU 110 Cb -0.16 -2.61 0.25 0.00 0.26 0.00 0.00 34.13 31.87 1x5f s GLU 110 CO 0.06 0.12 1.14 0.95 -0.54 0.00 0.00 175.26 176.99 1x5f s THR 111 N 0.57 1.73 -0.07 -1.70 -4.23 -1.11 -4.92 115.64 105.91 1x5f s THR 111 Ca -0.09 0.00 -0.04 0.00 -1.18 0.00 0.00 61.69 60.38 1x5f s THR 111 Cb -0.16 -2.57 -0.04 0.00 1.34 0.00 0.00 72.50 71.07 1x5f s THR 111 CO 0.03 0.00 0.12 -1.10 -0.54 0.00 0.00 174.62 173.13 1x5f s GLN 112 N -5.40 3.31 -0.47 3.99 -0.21 -1.26 -3.60 119.66 116.03 1x5f s GLN 112 Ca 0.70 -0.27 -0.28 0.00 0.02 0.00 0.00 55.36 55.54 1x5f s GLN 112 Cb -0.11 -3.06 -0.02 0.00 1.00 0.00 0.00 33.01 30.83 1x5f s GLN 112 CO 0.56 0.73 1.78 -1.25 -2.12 0.00 0.00 175.29 174.98 1x5f s PRO 113 N -1.31 3.03 0.95 2.91 0.04 -1.26 -2.94 135.00 136.42 1x5f s PRO 113 Ca 0.19 0.98 -0.13 0.00 0.04 0.00 0.00 61.00 62.08 1x5f s PRO 113 Cb -0.12 -4.27 0.13 0.00 0.04 0.00 0.00 34.50 30.28 1x5f s PRO 113 CO 0.08 -2.23 0.16 0.39 0.04 0.00 0.00 177.00 175.45 1x5f n GLU 114 N 8.74 -1.84 -3.39 4.56 1.02 -1.26 -4.88 120.64 123.59 1x5f n GLU 114 Ca 0.21 -0.54 -0.41 0.00 -0.02 0.00 0.00 57.16 56.39 1x5f n GLU 114 Cb 0.49 -1.40 -0.02 0.00 -0.02 0.00 0.00 31.44 30.49 1x5f n GLU 114 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1x5f n SER 115 N -0.52 5.17 -0.85 1.62 2.88 -1.26 -5.02 113.62 115.63 1x5f n SER 115 Ca 0.04 -3.14 0.00 0.00 -1.33 0.00 0.00 58.87 54.45 1x5f n SER 115 Cb 0.35 -1.24 0.00 0.00 -0.75 0.00 0.00 64.21 62.57 1x5f n SER 115 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1x5f n GLY 116 N 2.30 -0.85 3.77 0.46 0.00 -1.26 -4.77 105.19 104.84 1x5f n GLY 116 Ca 0.24 -1.01 -0.38 0.00 0.00 0.00 0.00 46.02 44.87 1x5f n GLY 116 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1x5f s PRO 117 N 0.00 3.97 -0.39 1.61 0.04 -1.26 -5.01 135.00 133.97 1x5f s PRO 117 Ca 0.00 1.86 -0.17 0.00 0.04 0.00 0.00 61.00 62.74 1x5f s PRO 117 Cb 0.00 -2.62 0.01 0.00 0.04 0.00 0.00 34.50 31.93 1x5f s PRO 117 CO 0.00 -0.40 0.42 -1.12 0.04 0.00 0.00 177.00 175.94 1x5f s SER 118 N -1.14 6.20 0.06 6.66 0.01 -1.26 -5.06 113.70 119.16 1x5f s SER 118 Ca 0.59 -0.45 0.01 0.00 1.31 0.00 0.00 55.95 57.40 1x5f s SER 118 Cb -0.31 -2.22 -0.04 0.00 0.21 0.00 0.00 66.02 63.66 1x5f s SER 118 CO 0.39 -0.48 0.13 -0.55 0.41 0.00 0.00 173.24 173.13 1x5f s SER 119 N 1.78 5.87 0.00 2.44 0.15 -1.26 -5.27 113.70 117.40 1x5f s SER 119 Ca 0.12 0.12 0.13 0.00 0.70 0.00 0.00 55.95 57.02 1x5f s SER 119 Cb -0.17 -1.69 0.10 0.00 -1.71 0.00 0.00 66.02 62.56 1x5f s SER 119 CO 0.13 0.19 0.90 0.61 1.20 0.00 0.00 173.24 176.27