#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x5f n SER 2 N 0.00 -3.02 -3.67 1.61 7.64 -1.26 -5.02 113.62 109.90 1x5f n SER 2 Ca 0.00 0.34 -0.10 0.00 1.01 0.00 0.00 58.87 60.12 1x5f n SER 2 Cb 0.00 -1.08 -0.10 0.00 -1.01 0.00 0.00 64.21 62.01 1x5f n SER 2 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1x5f s SER 3 N -1.65 -0.32 0.00 6.43 0.01 -1.26 -5.16 113.70 111.76 1x5f s SER 3 Ca 0.54 0.93 0.00 0.00 1.31 0.00 0.00 55.95 58.73 1x5f s SER 3 Cb -0.23 1.08 0.00 0.00 0.21 0.00 0.00 66.02 67.08 1x5f s SER 3 CO 0.70 -0.22 0.00 0.61 0.41 0.00 0.00 173.24 174.74 1x5f n GLY 4 N 4.95 0.59 0.23 3.44 0.00 -1.26 -4.93 105.19 108.22 1x5f n GLY 4 Ca -0.14 -0.55 -0.15 0.00 0.00 0.00 0.00 46.02 45.18 1x5f n GLY 4 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1x5f h SER 5 N 0.00 -0.43 -6.92 1.61 4.64 -2.07 -3.46 113.55 106.92 1x5f h SER 5 Ca 0.00 -0.08 -0.58 0.00 -0.47 0.00 0.00 61.79 60.67 1x5f h SER 5 Cb 0.00 0.11 -0.27 0.00 -0.31 0.00 0.00 62.40 61.93 1x5f h SER 5 CO 0.00 -0.18 -0.87 -1.20 -0.87 0.00 0.00 176.83 173.71 1x5f n SER 6 N -5.24 -0.33 -1.23 4.97 7.64 -1.26 -4.90 113.62 113.26 1x5f n SER 6 Ca -0.10 -1.17 0.00 0.00 1.01 0.00 0.00 58.87 58.60 1x5f n SER 6 Cb 0.26 -1.48 0.00 0.00 -1.01 0.00 0.00 64.21 61.98 1x5f n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1x5f n GLY 7 N -1.79 1.44 3.23 0.23 0.00 -1.26 -5.02 105.19 102.02 1x5f n GLY 7 Ca -0.11 -2.01 -0.44 0.00 0.00 0.00 0.00 46.02 43.46 1x5f n GLY 7 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1x5f n GLU 8 N -0.49 3.81 -2.49 1.61 -0.58 -1.26 -4.96 120.64 116.28 1x5f n GLU 8 Ca 0.00 -4.40 -0.40 0.00 -0.42 0.00 0.00 57.16 51.94 1x5f n GLU 8 Cb 0.00 -2.60 -0.01 0.00 -0.57 0.00 0.00 31.44 28.26 1x5f n GLU 8 CO 0.00 0.00 0.00 -3.38 -0.48 0.00 0.00 177.13 173.27 1x5f s HIS 9 N -1.42 2.60 -0.72 -0.32 -3.43 -1.26 -4.86 115.29 105.88 1x5f s HIS 9 Ca 0.32 -1.14 0.03 0.00 -0.80 0.00 0.00 55.06 53.47 1x5f s HIS 9 Cb -0.04 -4.62 0.18 0.00 -1.43 0.00 0.00 32.58 26.66 1x5f s HIS 9 CO -0.01 -1.74 0.53 0.00 -2.00 0.00 0.00 174.74 171.51 1x5f s ALA 10 N 5.48 3.85 -2.00 -1.38 0.00 -1.26 -4.91 121.76 121.55 1x5f s ALA 10 Ca 0.55 -3.77 0.12 0.00 0.00 0.00 0.00 51.96 48.86 1x5f s ALA 10 Cb 0.02 -2.31 0.72 0.00 0.00 0.00 0.00 23.12 21.55 1x5f s ALA 10 CO 0.06 -2.10 1.15 -0.35 0.00 0.00 0.00 175.76 174.52 1x5f n PRO 11 N 2.19 0.49 -1.54 0.00 -0.04 -1.26 -4.74 135.00 130.09 1x5f n PRO 11 Ca 0.18 0.00 -0.32 0.00 -0.04 0.00 0.00 63.50 63.32 1x5f n PRO 11 Cb 0.35 -1.39 -0.06 0.00 -0.04 0.00 0.00 33.50 32.37 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 -0.89 0.65 -3.52 0.55 0.00 -1.26 -4.87 120.51 111.18 1x5f n ALA 12 Ca 0.09 -0.95 -0.17 0.00 0.00 0.00 0.00 53.44 52.41 1x5f n ALA 12 Cb 0.04 -3.09 -0.13 0.00 0.00 0.00 0.00 19.45 16.27 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 11.99 -0.35 -0.03 0.00 2.01 -1.26 -5.02 115.64 122.98 1x5f s THR 13 Ca 1.03 -0.03 0.07 0.00 0.31 0.00 0.00 61.69 63.07 1x5f s THR 13 Cb -0.31 -0.63 -0.02 0.00 0.01 0.00 0.00 72.50 71.55 1x5f s THR 13 CO 0.27 -0.14 -0.25 0.42 -0.69 0.00 0.00 174.62 174.23 1x5f s THR 14 N 2.35 2.02 0.00 -0.82 -4.23 -1.26 -5.06 115.64 108.64 1x5f s THR 14 Ca 0.06 -1.08 0.00 0.00 -1.18 0.00 0.00 61.69 59.49 1x5f s THR 14 Cb -0.15 -1.68 0.00 0.00 1.34 0.00 0.00 72.50 72.01 1x5f s THR 14 CO -0.11 0.57 0.00 0.61 -0.54 0.00 0.00 174.62 175.15 1x5f n GLY 15 N 2.56 -1.29 2.17 3.99 0.00 -1.26 -4.90 105.19 106.46 1x5f n GLY 15 Ca -0.16 -1.60 -0.18 0.00 0.00 0.00 0.00 46.02 44.07 1x5f n GLY 15 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1x5f n PRO 16 N -1.60 -2.34 -4.41 1.61 -0.04 -1.26 -5.08 135.00 121.88 1x5f n PRO 16 Ca 0.00 -1.08 -0.26 0.00 -0.04 0.00 0.00 63.50 62.12 1x5f n PRO 16 Cb 0.00 -1.01 -0.12 0.00 -0.04 0.00 0.00 33.50 32.33 1x5f n PRO 16 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1x5f s LEU 17 N 0.00 2.44 0.00 1.53 1.43 -1.26 -4.96 118.68 117.85 1x5f s LEU 17 Ca 0.44 -0.87 -0.06 0.00 -1.03 0.00 0.00 54.13 52.61 1x5f s LEU 17 Cb -0.04 -1.10 0.09 0.00 0.03 0.00 0.00 46.19 45.16 1x5f s LEU 17 CO 0.34 0.09 0.31 -0.81 0.23 0.00 0.00 176.35 176.51 1x5f n PRO 18 N 0.27 -1.65 -4.67 1.29 -0.04 -1.26 -4.92 135.00 124.01 1x5f n PRO 18 Ca -0.13 -0.50 -0.28 0.00 -0.04 0.00 0.00 63.50 62.55 1x5f n PRO 18 Cb 0.56 -0.47 -0.14 0.00 -0.04 0.00 0.00 33.50 33.41 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 -2.36 2.95 0.64 3.54 0.15 -1.26 -3.47 113.70 113.89 1x5f s SER 19 Ca 0.20 -0.61 -0.17 0.00 0.70 0.00 0.00 55.95 56.07 1x5f s SER 19 Cb -0.02 -0.24 -0.04 0.00 -1.71 0.00 0.00 66.02 64.02 1x5f s SER 19 CO 0.16 0.20 0.90 0.00 1.20 0.00 0.00 173.24 175.70 1x5f n ALA 20 N 1.55 -0.11 -1.24 5.45 0.00 -1.15 -4.66 120.51 120.34 1x5f n ALA 20 Ca -0.17 -0.06 -0.31 0.00 0.00 0.00 0.00 53.44 52.90 1x5f n ALA 20 Cb 0.53 -2.08 0.10 0.00 0.00 0.00 0.00 19.45 18.00 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 -2.86 2.13 0.35 0.00 0.04 -1.26 -4.60 135.00 128.80 1x5f s PRO 21 Ca 0.75 1.14 0.03 0.00 0.04 0.00 0.00 61.00 62.96 1x5f s PRO 21 Cb -0.40 -1.88 0.03 0.00 0.04 0.00 0.00 34.50 32.29 1x5f s PRO 21 CO 0.48 -1.72 0.27 0.54 0.04 0.00 0.00 177.00 176.61 1x5f n ARG 22 N -3.57 0.97 -3.30 4.56 1.74 -1.23 -4.67 116.66 111.16 1x5f n ARG 22 Ca 0.09 -2.18 -0.23 0.00 -0.77 0.00 0.00 57.85 54.76 1x5f n ARG 22 Cb 0.53 0.22 0.00 0.00 -1.02 0.00 0.00 32.46 32.19 1x5f n ARG 22 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1x5f n ASP 23 N -1.93 -4.07 -4.56 0.55 2.03 -1.26 -0.29 116.55 107.02 1x5f n ASP 23 Ca -0.01 -0.37 -0.39 0.00 0.52 0.00 0.00 54.79 54.54 1x5f n ASP 23 Cb 0.40 -3.36 -0.03 0.00 -0.72 0.00 0.00 41.12 37.41 1x5f n ASP 23 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1x5f s VAL 24 N -2.96 3.38 0.26 5.18 1.01 -1.26 -3.96 120.40 122.04 1x5f s VAL 24 Ca 0.38 0.26 0.02 0.00 0.00 0.00 0.00 61.98 62.63 1x5f s VAL 24 Cb -0.20 -3.87 -0.03 0.00 0.00 0.00 0.00 36.38 32.28 1x5f s VAL 24 CO 0.47 -0.80 0.22 0.68 0.00 0.00 0.00 175.10 175.67 1x5f s VAL 25 N 8.77 0.00 -0.43 2.92 -7.23 -0.40 -4.99 120.40 119.04 1x5f s VAL 25 Ca 0.70 -1.96 -0.09 0.00 -1.81 0.00 0.00 61.98 58.82 1x5f s VAL 25 Cb -0.14 -2.50 0.09 0.00 0.56 0.00 0.00 36.38 34.39 1x5f s VAL 25 CO 0.23 0.00 0.28 0.00 -0.31 0.00 0.00 175.10 175.30 1x5f s ALA 26 N -3.83 3.31 0.47 1.32 0.00 -1.26 0.04 121.76 121.81 1x5f s ALA 26 Ca 0.39 -2.27 0.20 0.00 0.00 0.00 0.00 51.96 50.28 1x5f s ALA 26 Cb 0.05 -2.68 1.20 0.00 0.00 0.00 0.00 23.12 21.68 1x5f s ALA 26 CO 0.18 -1.72 1.94 1.03 0.00 0.00 0.00 175.76 177.19 1x5f h SER 27 N 8.40 0.24 -5.01 0.00 0.87 -1.11 -3.43 113.55 113.50 1x5f h SER 27 Ca -0.22 0.01 -0.08 0.00 -1.23 0.00 0.00 61.79 60.27 1x5f h SER 27 Cb 1.08 -0.03 -0.18 0.00 -0.44 0.00 0.00 62.40 62.83 1x5f h SER 27 CO 0.78 0.12 -0.07 -0.22 -0.53 0.00 0.00 176.83 176.91 1x5f s LEU 28 N -9.11 0.24 -0.34 2.23 0.20 -1.09 -4.98 118.68 105.83 1x5f s LEU 28 Ca -0.07 0.20 0.02 0.00 0.69 0.00 0.00 54.13 54.97 1x5f s LEU 28 Cb 0.21 1.83 0.10 0.00 -0.43 0.00 0.00 46.19 47.90 1x5f s LEU 28 CO 0.76 -0.60 0.09 -0.69 -0.29 0.00 0.00 176.35 175.62 1x5f s VAL 29 N -1.88 1.65 0.51 1.68 1.01 -1.26 0.97 120.40 123.08 1x5f s VAL 29 Ca -0.09 -2.00 -0.06 0.00 0.00 0.00 0.00 61.98 59.84 1x5f s VAL 29 Cb -0.02 -2.22 -0.03 0.00 0.00 0.00 0.00 36.38 34.11 1x5f s VAL 29 CO 0.02 -0.66 0.83 -0.55 0.00 0.00 0.00 175.10 174.75 1x5f s SER 30 N 1.13 6.19 0.46 3.32 0.15 0.30 -4.61 113.70 120.64 1x5f s SER 30 Ca 0.11 0.98 0.26 0.00 0.70 0.00 0.00 55.95 58.00 1x5f s SER 30 Cb -0.19 -2.23 0.90 0.00 -1.71 0.00 0.00 66.02 62.80 1x5f s SER 30 CO -0.15 -0.67 1.81 0.71 1.20 0.00 0.00 173.24 176.15 1x5f h THR 31 N 0.10 0.38 -0.00 6.45 1.35 -1.96 -3.15 112.91 116.08 1x5f h THR 31 Ca -0.46 -1.04 0.00 0.00 -0.55 0.00 0.00 66.41 64.35 1x5f h THR 31 Cb 1.21 1.78 0.00 0.00 -1.73 0.00 0.00 68.15 69.41 1x5f h THR 31 CO 0.62 0.16 -0.03 0.54 -0.25 0.00 0.00 175.52 176.55 1x5f n ARG 32 N -3.27 1.24 -3.82 4.72 1.74 -1.26 -1.81 116.66 114.20 1x5f n ARG 32 Ca 0.01 -0.50 -0.08 0.00 -0.77 0.00 0.00 57.85 56.52 1x5f n ARG 32 Cb 0.43 -0.94 0.02 0.00 -1.02 0.00 0.00 32.46 30.95 1x5f n ARG 32 CO 0.00 0.00 0.00 -0.59 -1.52 0.00 0.00 177.63 175.52 1x5f s PHE 33 N -0.52 0.09 -0.14 -1.55 -0.12 -1.19 -1.49 117.98 113.06 1x5f s PHE 33 Ca 0.03 -0.71 -0.07 0.00 -0.05 0.00 0.00 56.93 56.13 1x5f s PHE 33 Cb 0.02 0.81 0.06 0.00 -0.63 0.00 0.00 43.02 43.28 1x5f s PHE 33 CO 0.06 -1.44 0.32 0.42 -0.05 0.00 0.00 175.22 174.52 1x5f s ILE 34 N -2.37 -0.17 -0.09 -4.49 1.01 -1.14 0.11 121.20 114.06 1x5f s ILE 34 Ca 0.16 0.16 -0.26 0.00 0.00 0.00 0.00 60.65 60.71 1x5f s ILE 34 Cb -0.05 -0.49 -0.03 0.00 0.01 0.00 0.00 42.46 41.91 1x5f s ILE 34 CO 0.10 0.07 0.83 -0.75 0.00 0.00 0.00 174.94 175.19 1x5f s LYS 35 N 1.66 4.42 0.12 2.79 2.47 0.27 -2.38 119.74 129.09 1x5f s LYS 35 Ca -0.07 1.09 0.06 0.00 -1.56 0.00 0.00 55.97 55.50 1x5f s LYS 35 Cb -0.10 -3.50 -0.04 0.00 -1.46 0.00 0.00 37.83 32.73 1x5f s LYS 35 CO -0.10 -0.13 -0.02 -0.51 0.16 0.00 0.00 175.35 174.75 1x5f s LEU 36 N 1.40 3.33 -0.20 5.43 2.01 0.79 -0.59 118.68 130.85 1x5f s LEU 36 Ca 0.42 -0.29 -0.11 0.00 0.01 0.00 0.00 54.13 54.16 1x5f s LEU 36 Cb -0.18 -2.05 0.07 0.00 0.01 0.00 0.00 46.19 44.03 1x5f s LEU 36 CO 0.18 0.15 0.49 0.42 1.01 0.00 0.00 176.35 178.60 1x5f s THR 37 N -1.41 -0.08 0.18 5.49 -4.23 0.11 -1.69 115.64 114.00 1x5f s THR 37 Ca 0.25 0.07 -0.02 0.00 -1.18 0.00 0.00 61.69 60.81 1x5f s THR 37 Cb -0.11 -0.73 -0.04 0.00 1.34 0.00 0.00 72.50 72.97 1x5f s THR 37 CO 0.17 0.03 0.14 -1.66 -0.54 0.00 0.00 174.62 172.77 1x5f s TRP 38 N 1.59 0.95 0.59 3.99 -2.14 -0.07 -1.28 118.94 122.58 1x5f s TRP 38 Ca -0.09 -1.24 0.08 0.00 2.66 0.00 0.00 56.10 57.51 1x5f s TRP 38 Cb -0.08 -0.44 0.09 0.00 -3.10 0.00 0.00 33.47 29.94 1x5f s TRP 38 CO -0.15 -0.63 0.82 1.03 -2.66 0.00 0.00 176.95 175.36 1x5f s ARG 39 N -4.10 2.22 0.37 3.25 1.81 0.60 -4.69 118.95 118.41 1x5f s ARG 39 Ca 0.31 -1.54 -0.26 0.00 -1.72 0.00 0.00 55.73 52.53 1x5f s ARG 39 Cb 0.06 -2.60 -0.09 0.00 -0.45 0.00 0.00 34.95 31.87 1x5f s ARG 39 CO 0.08 -0.94 1.10 0.95 -0.68 0.00 0.00 175.30 175.81 1x5f s THR 40 N -2.74 3.47 0.47 0.02 -4.23 -1.26 -3.47 115.64 107.90 1x5f s THR 40 Ca 0.62 1.25 -0.23 0.00 -1.18 0.00 0.00 61.69 62.16 1x5f s THR 40 Cb -0.06 -3.71 -0.07 0.00 1.34 0.00 0.00 72.50 70.00 1x5f s THR 40 CO 0.40 0.13 1.16 -2.16 -0.54 0.00 0.00 174.62 173.61 1x5f s PRO 41 N -2.15 3.72 0.34 3.99 0.04 -1.14 -4.38 135.00 135.42 1x5f s PRO 41 Ca 0.54 1.76 0.11 0.00 0.04 0.00 0.00 61.00 63.45 1x5f s PRO 41 Cb -0.28 -2.37 0.88 0.00 0.04 0.00 0.00 34.50 32.78 1x5f s PRO 41 CO 0.35 -0.58 1.78 0.00 0.04 0.00 0.00 177.00 178.59 1x5f h ALA 42 N 1.98 1.88 -0.32 8.56 0.00 -1.84 -0.17 119.26 129.34 1x5f h ALA 42 Ca -0.49 0.07 -0.05 0.00 0.00 0.00 0.00 54.91 54.44 1x5f h ALA 42 Cb 1.25 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 1x5f h ALA 42 CO 0.60 -0.26 -0.00 0.66 0.00 0.00 0.00 179.25 180.24 1x5f h SER 43 N 0.61 0.56 -3.88 0.00 4.64 -1.91 -3.38 113.55 110.19 1x5f h SER 43 Ca 0.58 -0.31 -0.64 0.00 -0.47 0.00 0.00 61.79 60.95 1x5f h SER 43 Cb 1.11 -0.15 -0.40 0.00 -0.31 0.00 0.00 62.40 62.65 1x5f h SER 43 CO -0.35 0.73 -0.69 -1.81 -0.87 0.00 0.00 176.83 173.84 1x5f s ASP 44 N -6.07 4.39 0.00 4.97 1.11 -0.09 -4.95 116.67 116.03 1x5f s ASP 44 Ca -0.13 -2.49 0.15 0.00 0.18 0.00 0.00 52.55 50.25 1x5f s ASP 44 Cb 0.09 -1.49 0.75 0.00 1.07 0.00 0.00 42.92 43.34 1x5f s ASP 44 CO 0.77 -0.31 1.41 -0.81 1.18 0.00 0.00 175.17 177.40 1x5f n PRO 45 N 3.79 0.22 -0.01 8.23 -0.04 -1.12 -2.77 135.00 143.30 1x5f n PRO 45 Ca 0.04 0.14 -0.00 0.00 -0.04 0.00 0.00 63.50 63.64 1x5f n PRO 45 Cb 0.37 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.32 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 -1.28 0.00 -3.43 0.54 8.25 -1.26 -4.84 115.22 113.21 1x5f n HIS 46 Ca 0.07 0.00 -0.25 0.00 -0.26 0.00 0.00 57.72 57.28 1x5f n HIS 46 Cb 0.12 -0.06 -0.05 0.00 1.12 0.00 0.00 29.99 31.11 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 2.73 -0.21 0.04 -1.41 0.00 -1.12 -4.71 105.19 100.51 1x5f n GLY 47 Ca -0.02 0.06 0.11 0.00 0.00 0.00 0.00 46.02 46.17 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 -1.30 0.61 -0.58 1.61 2.03 -1.26 -3.53 116.55 114.13 1x5f n ASP 48 Ca 0.02 -0.17 0.08 0.00 0.52 0.00 0.00 54.79 55.24 1x5f n ASP 48 Cb 0.31 0.81 0.20 0.00 -0.72 0.00 0.00 41.12 41.71 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 -2.01 3.24 -3.77 1.67 0.23 -1.26 -4.73 115.26 108.62 1x5f n ASN 49 Ca 0.02 -2.88 -0.14 0.00 -0.53 0.00 0.00 54.58 51.04 1x5f n ASN 49 Cb 0.45 -0.45 -0.15 0.00 -2.08 0.00 0.00 39.78 37.54 1x5f n ASN 49 CO 0.00 0.00 0.00 -1.48 -0.93 0.00 0.00 177.26 174.85 1x5f s LEU 50 N -2.56 1.06 0.95 -4.53 0.05 -1.26 -4.22 118.68 108.18 1x5f s LEU 50 Ca 0.35 0.13 -0.16 0.00 0.05 0.00 0.00 54.13 54.50 1x5f s LEU 50 Cb 0.28 0.10 0.19 0.00 -2.05 0.00 0.00 46.19 44.71 1x5f s LEU 50 CO 0.07 -0.12 1.29 -0.89 -0.55 0.00 0.00 176.35 176.15 1x5f s THR 51 N 0.96 1.98 -0.06 5.48 2.01 0.34 -2.43 115.64 123.93 1x5f s THR 51 Ca -0.08 0.00 0.00 0.00 0.31 0.00 0.00 61.69 61.93 1x5f s THR 51 Cb -0.11 -2.97 0.02 0.00 0.01 0.00 0.00 72.50 69.46 1x5f s THR 51 CO -0.04 0.00 -0.04 -0.31 -0.69 0.00 0.00 174.62 173.55 1x5f s TYR 52 N -3.79 0.79 -0.11 4.92 2.02 -1.26 -0.22 117.35 119.70 1x5f s TYR 52 Ca 0.72 -0.24 -0.04 0.00 -0.37 0.00 0.00 57.07 57.14 1x5f s TYR 52 Cb -0.05 -0.74 -0.04 0.00 -0.40 0.00 0.00 41.96 40.73 1x5f s TYR 52 CO 0.53 -0.25 0.05 -1.12 -1.57 0.00 0.00 175.55 173.19 1x5f s SER 53 N 1.22 5.60 -0.22 2.29 0.01 0.12 -2.51 113.70 120.20 1x5f s SER 53 Ca -0.06 0.22 0.02 0.00 1.31 0.00 0.00 55.95 57.44 1x5f s SER 53 Cb -0.14 -1.72 0.04 0.00 0.21 0.00 0.00 66.02 64.42 1x5f s SER 53 CO -0.02 0.35 -0.14 -0.69 0.41 0.00 0.00 173.24 173.16 1x5f s VAL 54 N -0.72 2.01 -0.31 3.43 1.01 -1.05 -0.58 120.40 124.20 1x5f s VAL 54 Ca 0.12 -1.28 -0.11 0.00 0.00 0.00 0.00 61.98 60.71 1x5f s VAL 54 Cb -0.12 -2.02 -0.03 0.00 0.00 0.00 0.00 36.38 34.22 1x5f s VAL 54 CO 0.02 0.19 0.20 -0.36 0.00 0.00 0.00 175.10 175.15 1x5f s PHE 55 N 1.23 3.21 0.10 5.22 0.40 -0.11 -0.35 117.98 127.67 1x5f s PHE 55 Ca -0.03 -0.18 0.07 0.00 -0.60 0.00 0.00 56.93 56.19 1x5f s PHE 55 Cb -0.17 -2.41 -0.04 0.00 0.51 0.00 0.00 43.02 40.91 1x5f s PHE 55 CO -0.08 -0.31 -0.11 1.52 0.70 0.00 0.00 175.22 176.93 1x5f s TYR 56 N 1.71 2.71 -0.23 0.36 1.13 -0.44 -0.95 117.35 121.64 1x5f s TYR 56 Ca 0.06 -0.17 -0.27 0.00 -1.41 0.00 0.00 57.07 55.28 1x5f s TYR 56 Cb -0.17 -1.43 0.13 0.00 -1.10 0.00 0.00 41.96 39.39 1x5f s TYR 56 CO 0.09 0.41 1.05 -0.08 -2.51 0.00 0.00 175.55 174.51 1x5f s THR 57 N -1.18 0.00 0.39 -3.49 -1.32 -1.14 -1.55 115.64 107.36 1x5f s THR 57 Ca 0.20 0.00 -0.25 0.00 -1.21 0.00 0.00 61.69 60.44 1x5f s THR 57 Cb -0.11 -1.00 -0.09 0.00 -1.51 0.00 0.00 72.50 69.79 1x5f s THR 57 CO 0.12 0.00 1.08 -0.75 -2.21 0.00 0.00 174.62 172.86 1x5f s LYS 58 N -0.39 4.15 0.04 7.08 2.20 -1.26 -0.15 119.74 131.41 1x5f s LYS 58 Ca 0.01 1.61 -0.36 0.00 -0.36 0.00 0.00 55.97 56.87 1x5f s LYS 58 Cb -0.03 -2.61 -0.18 0.00 -1.51 0.00 0.00 37.83 33.50 1x5f s LYS 58 CO -0.03 -0.17 0.91 -1.91 -0.36 0.00 0.00 175.35 173.78 1x5f n GLU 59 N 0.02 0.00 0.00 4.03 0.00 -1.25 -0.26 120.64 123.18 1x5f n GLU 59 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.21 1x5f n GLU 59 Cb 0.49 -1.32 0.00 0.00 0.00 0.00 0.00 31.44 30.60 1x5f n GLU 59 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1x5f n GLY 60 N 1.52 1.87 3.52 8.31 0.00 -1.26 -4.94 105.19 114.22 1x5f n GLY 60 Ca 0.19 -0.23 -0.38 0.00 0.00 0.00 0.00 46.02 45.60 1x5f n GLY 60 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1x5f n ILE 61 N 0.00 -0.04 0.30 -0.61 2.08 0.64 -4.74 119.36 116.99 1x5f n ILE 61 Ca 0.00 -0.38 0.18 0.00 0.56 0.00 0.00 62.75 63.10 1x5f n ILE 61 Cb 0.00 -1.57 0.97 0.00 -0.75 0.00 0.00 39.64 38.29 1x5f n ILE 61 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1x5f h ALA 62 N 15.52 1.24 -2.74 -1.39 0.00 -1.92 -3.42 119.26 126.55 1x5f h ALA 62 Ca -0.14 -0.02 -0.56 0.00 0.00 0.00 0.00 54.91 54.19 1x5f h ALA 62 Cb 1.29 -0.00 -0.06 0.00 0.00 0.00 0.00 17.79 19.01 1x5f h ALA 62 CO 1.28 0.03 0.03 -0.98 0.00 0.00 0.00 179.25 179.62 1x5f s ARG 63 N -4.28 4.40 0.04 0.00 1.70 -1.26 -5.07 118.95 114.49 1x5f s ARG 63 Ca -0.04 0.79 0.03 0.00 -0.47 0.00 0.00 55.73 56.04 1x5f s ARG 63 Cb 0.13 -3.42 -0.02 0.00 -0.57 0.00 0.00 34.95 31.07 1x5f s ARG 63 CO 0.51 0.16 -0.09 -1.83 -1.08 0.00 0.00 175.30 172.96 1x5f s GLU 64 N 0.52 0.60 -0.12 3.89 1.03 -1.26 -4.69 118.70 118.67 1x5f s GLU 64 Ca 0.34 -0.74 -0.04 0.00 0.03 0.00 0.00 54.97 54.56 1x5f s GLU 64 Cb -0.18 -0.44 -0.04 0.00 -0.80 0.00 0.00 34.13 32.67 1x5f s GLU 64 CO 0.17 0.09 0.04 1.03 -1.33 0.00 0.00 175.26 175.26 1x5f s ARG 65 N -1.45 3.34 0.10 -4.83 1.81 -0.59 -4.86 118.95 112.47 1x5f s ARG 65 Ca -0.07 -0.34 -0.07 0.00 -1.72 0.00 0.00 55.73 53.53 1x5f s ARG 65 Cb -0.09 -2.98 -0.06 0.00 -0.45 0.00 0.00 34.95 31.38 1x5f s ARG 65 CO 0.01 0.60 0.38 0.54 -0.68 0.00 0.00 175.30 176.14 1x5f s VAL 66 N -0.56 5.14 -0.24 3.52 0.11 -1.26 -1.33 120.40 125.79 1x5f s VAL 66 Ca 0.10 0.25 -0.02 0.00 -2.93 0.00 0.00 61.98 59.39 1x5f s VAL 66 Cb -0.12 -3.63 0.07 0.00 -1.53 0.00 0.00 36.38 31.18 1x5f s VAL 66 CO 0.02 0.18 0.04 -0.70 -3.33 0.00 0.00 175.10 171.32 1x5f s GLU 67 N -2.22 0.83 -0.04 1.54 -6.30 0.52 -4.90 118.70 108.13 1x5f s GLU 67 Ca 0.36 -0.74 -0.30 0.00 -2.50 0.00 0.00 54.97 51.79 1x5f s GLU 67 Cb -0.13 -2.14 -0.04 0.00 0.00 0.00 0.00 34.13 31.82 1x5f s GLU 67 CO 0.21 -0.76 1.22 -0.80 0.02 0.00 0.00 175.26 175.15 1x5f s ASN 68 N 1.70 7.03 0.00 -1.70 0.01 -1.26 -2.51 114.94 118.21 1x5f s ASN 68 Ca 0.02 1.86 -0.35 0.00 -0.71 0.00 0.00 52.86 53.68 1x5f s ASN 68 Cb -0.17 -2.56 -0.13 0.00 0.41 0.00 0.00 41.25 38.80 1x5f s ASN 68 CO -0.14 -0.59 1.73 0.35 -1.51 0.00 0.00 177.10 176.94 1x5f n THR 69 N 4.57 0.32 -0.29 1.60 -2.24 -1.04 -4.78 114.28 112.41 1x5f n THR 69 Ca 0.11 -0.06 0.27 0.00 -2.27 0.00 0.00 64.05 62.10 1x5f n THR 69 Cb 0.46 -1.65 0.46 0.00 -2.10 0.00 0.00 70.33 67.50 1x5f n THR 69 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1x5f n SER 70 N 5.13 0.20 -4.14 3.42 3.41 -1.26 -4.18 113.62 116.20 1x5f n SER 70 Ca 0.21 1.10 -0.19 0.00 -0.26 0.00 0.00 58.87 59.72 1x5f n SER 70 Cb 0.28 -0.54 -0.13 0.00 -0.26 0.00 0.00 64.21 63.56 1x5f n SER 70 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 1x5f s HIS 71 N -4.94 1.19 0.14 7.33 3.76 -1.26 -5.13 115.29 116.38 1x5f s HIS 71 Ca -0.06 -0.37 -0.31 0.00 -0.15 0.00 0.00 55.06 54.17 1x5f s HIS 71 Cb 0.24 -0.70 -0.08 0.00 1.11 0.00 0.00 32.58 33.15 1x5f s HIS 71 CO 0.58 0.03 1.34 -1.25 -0.85 0.00 0.00 174.74 174.60 1x5f s PRO 72 N -1.25 4.36 0.00 8.40 0.04 -1.26 -2.98 135.00 142.32 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 -0.08 -3.24 0.00 0.00 0.04 0.00 0.00 34.50 31.22 1x5f s PRO 72 CO 0.01 -0.35 0.00 0.41 0.04 0.00 0.00 177.00 177.11 1x5f n GLY 73 N 3.06 2.96 2.62 0.56 0.00 -1.02 -4.86 105.19 108.51 1x5f n GLY 73 Ca 0.09 -0.04 -0.46 0.00 0.00 0.00 0.00 46.02 45.61 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 0.00 0.00 -0.12 1.61 4.07 -1.16 -4.79 120.64 120.25 1x5f n GLU 74 Ca 0.00 0.00 0.09 0.00 -0.06 0.00 0.00 57.16 57.19 1x5f n GLU 74 Cb 0.00 -1.08 0.30 0.00 -0.06 0.00 0.00 31.44 30.60 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 1.99 1.80 -3.82 5.31 2.81 -1.26 -4.84 117.12 119.11 1x5f n MET 75 Ca 0.18 -1.22 -0.12 0.00 -1.81 0.00 0.00 57.70 54.73 1x5f n MET 75 Cb 0.01 -1.37 -0.12 0.00 -0.71 0.00 0.00 33.22 31.03 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 -1.69 0.23 0.02 0.03 -0.21 -1.26 -0.89 119.66 115.89 1x5f s GLN 76 Ca 0.30 0.15 -0.10 0.00 0.02 0.00 0.00 55.36 55.73 1x5f s GLN 76 Cb 0.16 0.11 0.01 0.00 1.00 0.00 0.00 33.01 34.29 1x5f s GLN 76 CO 0.24 -0.04 0.21 0.54 -2.12 0.00 0.00 175.29 174.13 1x5f s VAL 77 N -0.10 0.09 -0.07 1.09 0.11 -0.68 -4.96 120.40 115.88 1x5f s VAL 77 Ca -0.02 -0.75 0.03 0.00 -2.93 0.00 0.00 61.98 58.31 1x5f s VAL 77 Cb -0.02 -0.75 -0.02 0.00 -1.53 0.00 0.00 36.38 34.06 1x5f s VAL 77 CO 0.00 -0.41 -0.14 -0.89 -3.33 0.00 0.00 175.10 170.33 1x5f s THR 78 N -2.05 3.04 -0.52 5.04 2.01 -1.26 -0.15 115.64 121.75 1x5f s THR 78 Ca -0.09 -0.72 -0.01 0.00 0.31 0.00 0.00 61.69 61.18 1x5f s THR 78 Cb -0.03 -2.21 0.14 0.00 0.01 0.00 0.00 72.50 70.41 1x5f s THR 78 CO -0.01 0.58 0.31 -0.63 -0.69 0.00 0.00 174.62 174.18 1x5f s ILE 79 N -0.49 3.28 0.28 1.82 -1.09 -1.00 -4.98 121.20 119.03 1x5f s ILE 79 Ca 0.06 -2.71 -0.05 0.00 -2.23 0.00 0.00 60.65 55.73 1x5f s ILE 79 Cb -0.12 -3.21 0.06 0.00 -1.58 0.00 0.00 42.46 37.62 1x5f s ILE 79 CO 0.02 -0.79 0.39 0.00 -1.23 0.00 0.00 174.94 173.32 1x5f n GLN 80 N 3.80 -0.34 -3.60 2.79 3.00 -1.26 -2.89 117.38 118.89 1x5f n GLN 80 Ca 0.04 -0.62 -0.20 0.00 -0.01 0.00 0.00 57.00 56.21 1x5f n GLN 80 Cb 0.38 -0.39 0.06 0.00 0.00 0.00 0.00 30.24 30.29 1x5f n GLN 80 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.06 177.15 1x5f n ASN 81 N -3.24 -2.22 -4.55 1.08 3.02 -1.18 -4.91 115.26 103.27 1x5f n ASN 81 Ca 0.05 -0.71 -0.25 0.00 -0.03 0.00 0.00 54.58 53.64 1x5f n ASN 81 Cb 0.17 -4.57 -0.10 0.00 -0.61 0.00 0.00 39.78 34.67 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 -6.64 2.76 -0.13 3.41 1.43 -0.56 -5.04 118.68 113.90 1x5f s LEU 82 Ca 0.10 -1.11 -0.05 0.00 -1.03 0.00 0.00 54.13 52.04 1x5f s LEU 82 Cb -0.05 -1.10 -0.04 0.00 0.03 0.00 0.00 46.19 45.03 1x5f s LEU 82 CO 0.77 -0.15 0.06 -0.32 0.23 0.00 0.00 176.35 176.94 1x5f s MET 83 N -3.61 3.47 0.72 1.70 -2.45 -1.26 -4.49 119.30 113.38 1x5f s MET 83 Ca 0.32 -0.31 -0.12 0.00 -1.25 0.00 0.00 55.69 54.33 1x5f s MET 83 Cb 0.00 -3.05 0.03 0.00 1.25 0.00 0.00 34.83 33.06 1x5f s MET 83 CO 0.17 0.57 1.10 -1.25 1.05 0.00 0.00 175.02 176.65 1x5f s PRO 84 N -0.46 2.49 -1.64 4.11 0.04 -0.75 -3.57 135.00 135.21 1x5f s PRO 84 Ca 0.10 1.26 -0.17 0.00 0.04 0.00 0.00 61.00 62.23 1x5f s PRO 84 Cb -0.12 -1.92 0.13 0.00 0.04 0.00 0.00 34.50 32.63 1x5f s PRO 84 CO 0.02 -1.48 0.87 0.00 0.04 0.00 0.00 177.00 176.46 1x5f n ALA 85 N -3.05 -1.26 -3.70 8.56 0.00 -1.11 -4.85 120.51 115.10 1x5f n ALA 85 Ca 0.10 0.08 -0.19 0.00 0.00 0.00 0.00 53.44 53.43 1x5f n ALA 85 Cb 0.53 -3.93 -0.17 0.00 0.00 0.00 0.00 19.45 15.88 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 -3.28 -0.08 0.51 0.00 2.01 -1.23 -4.91 115.64 108.65 1x5f s THR 86 Ca 0.72 0.36 -0.22 0.00 0.31 0.00 0.00 61.69 62.86 1x5f s THR 86 Cb -0.38 -0.14 -0.06 0.00 0.01 0.00 0.00 72.50 71.93 1x5f s THR 86 CO 0.89 0.15 1.26 -0.69 -0.69 0.00 0.00 174.62 175.54 1x5f s VAL 87 N 1.83 2.58 -0.08 3.82 1.01 -1.26 -3.30 120.40 125.00 1x5f s VAL 87 Ca 0.01 0.43 -0.04 0.00 0.00 0.00 0.00 61.98 62.38 1x5f s VAL 87 Cb -0.12 -3.21 0.04 0.00 0.00 0.00 0.00 36.38 33.08 1x5f s VAL 87 CO -0.03 -0.01 0.19 -0.31 0.00 0.00 0.00 175.10 174.93 1x5f s TYR 88 N -1.43 -0.23 -0.56 5.22 2.02 0.18 -3.90 117.35 118.65 1x5f s TYR 88 Ca 0.68 0.60 -0.20 0.00 -0.37 0.00 0.00 57.07 57.78 1x5f s TYR 88 Cb -0.34 -0.03 0.07 0.00 -0.40 0.00 0.00 41.96 41.26 1x5f s TYR 88 CO 0.41 -0.19 0.75 0.42 -1.57 0.00 0.00 175.55 175.37 1x5f s ILE 89 N 1.18 4.69 0.09 2.71 -1.09 0.79 -1.31 121.20 128.26 1x5f s ILE 89 Ca -0.09 -0.49 -0.10 0.00 -2.23 0.00 0.00 60.65 57.74 1x5f s ILE 89 Cb -0.11 -4.45 -0.06 0.00 -1.58 0.00 0.00 42.46 36.26 1x5f s ILE 89 CO -0.07 -1.05 0.41 -0.36 -1.23 0.00 0.00 174.94 172.64 1x5f s PHE 90 N 3.09 3.57 -0.04 3.97 0.40 0.10 -2.87 117.98 126.20 1x5f s PHE 90 Ca 0.18 0.80 -0.01 0.00 -0.60 0.00 0.00 56.93 57.29 1x5f s PHE 90 Cb -0.19 -2.17 0.03 0.00 0.51 0.00 0.00 43.02 41.20 1x5f s PHE 90 CO 0.11 0.50 0.03 1.03 0.70 0.00 0.00 175.22 177.59 1x5f s ARG 91 N -1.98 0.15 -0.07 0.44 0.52 -0.13 -0.15 118.95 117.74 1x5f s ARG 91 Ca 0.34 0.24 -0.11 0.00 -0.52 0.00 0.00 55.73 55.69 1x5f s ARG 91 Cb -0.14 -0.58 -0.05 0.00 0.52 0.00 0.00 34.95 34.70 1x5f s ARG 91 CO 0.19 -0.27 0.27 0.08 0.02 0.00 0.00 175.30 175.58 1x5f s VAL 92 N 1.80 5.29 -0.01 3.52 1.01 -1.26 -0.93 120.40 129.82 1x5f s VAL 92 Ca 0.01 0.50 -0.03 0.00 0.00 0.00 0.00 61.98 62.46 1x5f s VAL 92 Cb -0.12 -3.55 -0.00 0.00 0.00 0.00 0.00 36.38 32.70 1x5f s VAL 92 CO -0.03 0.59 0.06 -0.32 0.00 0.00 0.00 175.10 175.40 1x5f s MET 93 N -0.96 0.25 0.17 2.72 1.75 0.26 0.10 119.30 123.58 1x5f s MET 93 Ca 0.19 -0.22 -0.02 0.00 -1.25 0.00 0.00 55.69 54.39 1x5f s MET 93 Cb -0.14 0.10 -0.05 0.00 2.84 0.00 0.00 34.83 37.58 1x5f s MET 93 CO 0.08 -0.05 0.37 0.00 -0.65 0.00 0.00 175.02 174.78 1x5f s ALA 94 N -0.72 3.83 -0.10 4.11 0.00 -1.26 0.11 121.76 127.73 1x5f s ALA 94 Ca -0.08 -0.72 -0.04 0.00 0.00 0.00 0.00 51.96 51.12 1x5f s ALA 94 Cb -0.05 -2.04 0.05 0.00 0.00 0.00 0.00 23.12 21.08 1x5f s ALA 94 CO 0.00 0.55 0.20 -0.65 0.00 0.00 0.00 175.76 175.86 1x5f s GLN 95 N -3.01 0.11 0.25 0.00 -0.21 0.69 -2.75 119.66 114.74 1x5f s GLN 95 Ca 0.39 0.56 0.00 0.00 0.02 0.00 0.00 55.36 56.33 1x5f s GLN 95 Cb -0.12 -0.16 -0.00 0.00 1.00 0.00 0.00 33.01 33.73 1x5f s GLN 95 CO 0.27 -0.24 0.01 0.27 -2.12 0.00 0.00 175.29 173.49 1x5f n ASN 96 N 4.83 2.48 -0.06 5.90 0.23 -1.12 0.13 115.26 127.64 1x5f n ASN 96 Ca -0.15 -2.10 0.22 0.00 -0.53 0.00 0.00 54.58 52.02 1x5f n ASN 96 Cb 0.51 0.22 0.40 0.00 -2.08 0.00 0.00 39.78 38.83 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 -2.01 -1.43 116.57 111.39 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 0.63 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.96 1x5f h LYS 97 CO 0.33 0.00 0.00 0.72 -2.00 0.00 0.00 179.45 178.50 1x5f n HIS 98 N -3.14 0.00 0.00 0.07 8.25 -1.26 -5.03 115.22 114.11 1x5f n HIS 98 Ca 0.16 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.62 1x5f n HIS 98 Cb 1.30 -0.44 0.00 0.00 1.12 0.00 0.00 29.99 31.97 1x5f n HIS 98 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1x5f n GLY 99 N 1.76 -0.67 3.63 -1.41 0.00 -0.54 -4.91 105.19 103.04 1x5f n GLY 99 Ca 0.00 -0.38 -0.42 0.00 0.00 0.00 0.00 46.02 45.22 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 6.78 0.00 1.61 1.04 -1.26 -2.79 113.70 115.08 1x5f s SER 100 Ca 0.00 0.85 0.00 0.00 0.48 0.00 0.00 55.95 57.28 1x5f s SER 100 Cb 0.00 -2.46 0.00 0.00 0.10 0.00 0.00 66.02 63.66 1x5f s SER 100 CO 0.00 -0.69 0.00 0.61 0.98 0.00 0.00 173.24 174.14 1x5f n GLY 101 N 4.01 0.76 3.85 7.32 0.00 -1.11 -4.97 105.19 115.06 1x5f n GLY 101 Ca 0.07 0.00 -0.37 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 0.79 3.61 -0.06 1.61 2.56 -1.23 -4.99 118.70 121.00 1x5f s GLU 102 Ca 0.00 -0.07 -0.23 0.00 0.00 0.00 0.00 54.97 54.67 1x5f s GLU 102 Cb 0.00 -3.23 -0.04 0.00 2.00 0.00 0.00 34.13 32.86 1x5f s GLU 102 CO 0.00 0.69 0.69 -1.54 -0.56 0.00 0.00 175.26 174.54 1x5f s SER 103 N -0.82 6.98 1.26 -1.70 1.04 -1.26 -2.92 113.70 116.28 1x5f s SER 103 Ca 0.15 1.18 -0.16 0.00 0.48 0.00 0.00 55.95 57.60 1x5f s SER 103 Cb -0.12 -2.41 0.32 0.00 0.10 0.00 0.00 66.02 63.91 1x5f s SER 103 CO 0.04 -0.09 0.99 -0.55 0.98 0.00 0.00 173.24 174.62 1x5f s SER 104 N 0.68 0.20 0.51 7.02 0.15 0.12 -4.89 113.70 117.49 1x5f s SER 104 Ca 0.37 1.27 -0.21 0.00 0.70 0.00 0.00 55.95 58.08 1x5f s SER 104 Cb -0.18 -1.94 -0.06 0.00 -1.71 0.00 0.00 66.02 62.13 1x5f s SER 104 CO 0.18 -4.64 1.17 0.00 1.20 0.00 0.00 173.24 171.14 1x5f s ALA 105 N -2.40 2.81 -0.46 5.45 0.00 -1.26 -4.63 121.76 121.28 1x5f s ALA 105 Ca 0.69 0.93 -0.28 0.00 0.00 0.00 0.00 51.96 53.30 1x5f s ALA 105 Cb -0.21 -3.39 -0.02 0.00 0.00 0.00 0.00 23.12 19.50 1x5f s ALA 105 CO 0.63 -0.80 1.77 -1.25 0.00 0.00 0.00 175.76 176.11 1x5f s PRO 106 N -3.00 3.07 -0.05 0.00 0.04 -1.26 -4.63 135.00 129.16 1x5f s PRO 106 Ca 0.69 1.01 -0.28 0.00 0.04 0.00 0.00 61.00 62.47 1x5f s PRO 106 Cb -0.28 -4.25 -0.03 0.00 0.04 0.00 0.00 34.50 29.98 1x5f s PRO 106 CO 0.32 -2.19 0.89 -1.17 0.04 0.00 0.00 177.00 174.90 1x5f s LEU 107 N 7.62 4.31 -0.54 -3.56 2.96 0.78 -4.85 118.68 125.40 1x5f s LEU 107 Ca 0.72 1.46 -0.19 0.00 -0.22 0.00 0.00 54.13 55.90 1x5f s LEU 107 Cb -0.17 -3.40 0.08 0.00 0.50 0.00 0.00 46.19 43.20 1x5f s LEU 107 CO 0.28 -0.27 0.66 -0.60 -1.32 0.00 0.00 176.35 175.10 1x5f s ARG 108 N 1.25 3.09 -0.10 1.98 3.52 -1.26 -0.72 118.95 126.71 1x5f s ARG 108 Ca 0.46 -1.07 0.01 0.00 -0.13 0.00 0.00 55.73 55.00 1x5f s ARG 108 Cb -0.19 -4.17 -0.02 0.00 -1.56 0.00 0.00 34.95 29.00 1x5f s ARG 108 CO 0.22 -1.36 -0.11 0.08 -0.81 0.00 0.00 175.30 173.31 1x5f s VAL 109 N 2.67 3.28 -0.18 7.11 1.01 -0.43 -4.93 120.40 128.94 1x5f s VAL 109 Ca 0.14 -0.61 -0.00 0.00 0.00 0.00 0.00 61.98 61.50 1x5f s VAL 109 Cb -0.21 -2.35 0.00 0.00 0.00 0.00 0.00 36.38 33.82 1x5f s VAL 109 CO 0.09 0.56 -0.14 -0.70 0.00 0.00 0.00 175.10 174.91 1x5f s GLU 110 N -0.22 3.18 1.16 2.72 2.12 -1.26 0.49 118.70 126.89 1x5f s GLU 110 Ca 0.02 -0.75 -0.19 0.00 0.36 0.00 0.00 54.97 54.41 1x5f s GLU 110 Cb -0.13 -2.70 0.29 0.00 0.26 0.00 0.00 34.13 31.86 1x5f s GLU 110 CO 0.03 -0.10 0.95 0.25 -0.54 0.00 0.00 175.26 175.85 1x5f n THR 111 N 4.40 0.00 -4.31 -1.70 -2.24 -1.21 -4.92 114.28 104.30 1x5f n THR 111 Ca -0.19 -0.35 -0.32 0.00 -2.27 0.00 0.00 64.05 60.91 1x5f n THR 111 Cb 0.51 -1.15 -0.09 0.00 -2.10 0.00 0.00 70.33 67.49 1x5f n THR 111 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1x5f s GLN 112 N -5.18 2.73 -0.39 -0.78 -1.52 -1.26 -3.72 119.66 109.54 1x5f s GLN 112 Ca 0.64 -0.64 -0.28 0.00 -1.95 0.00 0.00 55.36 53.13 1x5f s GLN 112 Cb -0.07 -2.63 -0.01 0.00 -0.22 0.00 0.00 33.01 30.07 1x5f s GLN 112 CO 0.50 0.62 1.72 -1.25 -0.25 0.00 0.00 175.29 176.62 1x5f s PRO 113 N -1.56 3.29 -0.26 2.91 0.04 -1.26 -2.73 135.00 135.44 1x5f s PRO 113 Ca 0.19 1.20 0.03 0.00 0.04 0.00 0.00 61.00 62.46 1x5f s PRO 113 Cb -0.11 -4.18 -0.17 0.00 0.04 0.00 0.00 34.50 30.07 1x5f s PRO 113 CO 0.10 -1.91 -0.22 -0.85 0.04 0.00 0.00 177.00 174.16 1x5f n GLU 114 N 8.46 0.65 -2.18 4.56 -0.00 -1.26 -4.83 120.64 126.04 1x5f n GLU 114 Ca 0.21 0.14 -0.36 0.00 -0.00 0.00 0.00 57.16 57.15 1x5f n GLU 114 Cb 0.48 -1.52 -0.03 0.00 -0.00 0.00 0.00 31.44 30.36 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 -6.46 5.50 0.00 -1.84 0.15 -1.26 -4.79 113.70 104.99 1x5f s SER 115 Ca -0.34 -0.19 0.00 0.00 0.70 0.00 0.00 55.95 56.12 1x5f s SER 115 Cb 0.09 -2.55 0.00 0.00 -1.71 0.00 0.00 66.02 61.85 1x5f s SER 115 CO 0.61 -2.30 0.00 0.61 1.20 0.00 0.00 173.24 173.36 1x5f n GLY 116 N 6.02 -0.83 0.19 9.45 0.00 -1.26 -5.01 105.19 113.76 1x5f n GLY 116 Ca 0.23 -0.94 -0.13 0.00 0.00 0.00 0.00 46.02 45.18 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 0.62 -6.76 1.61 0.13 -1.97 -3.46 132.00 122.17 1x5f h PRO 117 Ca 0.00 -0.33 -0.56 0.00 -0.87 0.00 0.00 66.00 64.24 1x5f h PRO 117 Cb 0.00 0.01 -0.34 0.00 0.13 0.00 0.00 31.00 30.80 1x5f h PRO 117 CO 0.00 0.93 -0.81 0.43 -0.23 0.00 0.00 178.00 178.31 1x5f n SER 118 N -4.33 -1.57 -4.02 1.44 7.64 -1.26 -4.88 113.62 106.64 1x5f n SER 118 Ca -0.04 -1.12 -0.10 0.00 1.01 0.00 0.00 58.87 58.62 1x5f n SER 118 Cb 0.44 -1.43 -0.11 0.00 -1.01 0.00 0.00 64.21 62.10 1x5f n SER 118 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1x5f s SER 119 N -3.04 0.48 0.00 6.43 0.15 -1.26 -5.23 113.70 111.23 1x5f s SER 119 Ca 0.73 -0.55 0.27 0.00 0.70 0.00 0.00 55.95 57.10 1x5f s SER 119 Cb -0.43 0.08 1.63 0.00 -1.71 0.00 0.00 66.02 65.60 1x5f s SER 119 CO 0.92 -0.29 1.97 0.61 1.20 0.00 0.00 173.24 177.66