#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uuy s PRO 4 N 0.00 2.26 0.20 1.61 0.04 -1.26 -4.97 135.00 132.87 1uuy s PRO 4 Ca 0.00 0.42 -0.11 0.00 0.04 0.00 0.00 61.00 61.35 1uuy s PRO 4 Cb 0.00 -1.96 0.13 0.00 0.04 0.00 0.00 34.50 32.72 1uuy s PRO 4 CO 0.00 -1.45 1.85 1.49 0.04 0.00 0.00 177.00 178.92 1uuy h GLU 5 N -0.96 0.96 -4.63 4.56 4.57 -1.63 -3.41 114.58 114.03 1uuy h GLU 5 Ca -0.46 -0.08 -0.58 0.00 -1.18 0.00 0.00 59.36 57.05 1uuy h GLU 5 Cb 1.28 -0.20 -0.35 0.00 -0.16 0.00 0.00 28.75 29.31 1uuy h GLU 5 CO 0.63 0.67 -0.83 0.71 -1.18 0.00 0.00 179.01 179.01 1uuy s TYR 6 N -6.01 1.99 -0.26 0.92 1.51 -0.64 -5.02 117.35 109.84 1uuy s TYR 6 Ca -0.13 -1.03 -0.20 0.00 -1.01 0.00 0.00 57.07 54.69 1uuy s TYR 6 Cb 0.14 -1.47 -0.02 0.00 -0.11 0.00 0.00 41.96 40.50 1uuy s TYR 6 CO 0.78 -0.57 0.64 0.15 -1.11 0.00 0.00 175.55 175.44 1uuy s LYS 7 N 1.32 4.09 -0.09 -0.62 1.02 -1.26 -1.80 119.74 122.40 1uuy s LYS 7 Ca 0.00 0.54 -0.01 0.00 0.02 0.00 0.00 55.97 56.53 1uuy s LYS 7 Cb -0.14 -3.66 -0.03 0.00 -0.52 0.00 0.00 37.83 33.49 1uuy s LYS 7 CO -0.07 -0.43 -0.05 0.08 -0.92 0.00 0.00 175.35 173.96 1uuy s VAL 8 N 2.53 3.80 0.01 3.17 1.01 -0.32 -0.71 120.40 129.90 1uuy s VAL 8 Ca 0.26 -0.43 0.06 0.00 0.00 0.00 0.00 61.98 61.88 1uuy s VAL 8 Cb -0.15 -2.59 -0.02 0.00 0.00 0.00 0.00 36.38 33.62 1uuy s VAL 8 CO 0.09 0.57 -0.19 0.00 0.00 0.00 0.00 175.10 175.57 1uuy s ALA 9 N -0.53 1.58 -0.16 5.51 0.00 -0.06 -0.82 121.76 127.28 1uuy s ALA 9 Ca 0.08 -0.88 -0.00 0.00 0.00 0.00 0.00 51.96 51.16 1uuy s ALA 9 Cb -0.12 -0.36 0.00 0.00 0.00 0.00 0.00 23.12 22.64 1uuy s ALA 9 CO 0.02 0.37 -0.15 0.42 0.00 0.00 0.00 175.76 176.43 1uuy s ILE 10 N -0.58 2.66 -0.31 0.00 -1.09 -0.54 -1.59 121.20 119.75 1uuy s ILE 10 Ca 0.07 -0.76 -0.06 0.00 -2.23 0.00 0.00 60.65 57.67 1uuy s ILE 10 Cb -0.08 -2.13 0.03 0.00 -1.58 0.00 0.00 42.46 38.70 1uuy s ILE 10 CO 0.00 0.51 0.08 -0.22 -1.23 0.00 0.00 174.94 174.08 1uuy s LEU 11 N 0.94 4.03 -0.11 2.97 2.96 -0.11 -1.69 118.68 127.68 1uuy s LEU 11 Ca -0.03 -0.96 -0.25 0.00 -0.22 0.00 0.00 54.13 52.67 1uuy s LEU 11 Cb -0.15 -1.85 -0.03 0.00 0.50 0.00 0.00 46.19 44.67 1uuy s LEU 11 CO -0.02 -0.26 0.78 -0.89 -1.32 0.00 0.00 176.35 174.65 1uuy s THR 12 N 1.43 4.96 -0.31 3.68 2.01 -0.07 -0.65 115.64 126.68 1uuy s THR 12 Ca -0.00 1.58 -0.04 0.00 0.31 0.00 0.00 61.69 63.54 1uuy s THR 12 Cb -0.18 -4.11 0.04 0.00 0.01 0.00 0.00 72.50 68.26 1uuy s THR 12 CO 0.02 0.14 0.05 -0.69 -0.69 0.00 0.00 174.62 173.45 1uuy s VAL 13 N 1.42 3.43 -0.30 3.82 1.01 0.08 -1.38 120.40 128.47 1uuy s VAL 13 Ca 0.39 -1.15 -0.12 0.00 0.00 0.00 0.00 61.98 61.10 1uuy s VAL 13 Cb -0.18 -2.91 0.16 0.00 0.00 0.00 0.00 36.38 33.46 1uuy s VAL 13 CO 0.17 -0.08 0.88 -0.55 0.00 0.00 0.00 175.10 175.52 1uuy s SER 14 N 1.35 -0.77 0.24 3.32 0.15 -0.12 -4.11 113.70 113.76 1uuy s SER 14 Ca -0.02 0.88 -0.04 0.00 0.70 0.00 0.00 55.95 57.46 1uuy s SER 14 Cb -0.19 1.81 0.44 0.00 -1.71 0.00 0.00 66.02 66.37 1uuy s SER 14 CO 0.01 -0.15 1.75 0.44 1.20 0.00 0.00 173.24 176.49 1uuy h ASP 15 N 7.74 0.40 0.10 5.45 3.32 -1.86 -0.65 116.42 130.90 1uuy h ASP 15 Ca -0.17 0.09 -0.00 0.00 0.02 0.00 0.00 57.03 56.97 1uuy h ASP 15 Cb 1.13 0.04 0.00 0.00 0.22 0.00 0.00 39.33 40.71 1uuy h ASP 15 CO 0.08 0.18 -0.05 0.74 -1.72 0.00 0.00 179.24 178.48 1uuy h THR 16 N 0.54 0.99 -0.42 0.35 2.02 -1.95 -0.42 112.91 114.01 1uuy h THR 16 Ca 0.41 -0.30 -0.11 0.00 0.77 0.00 0.00 66.41 67.17 1uuy h THR 16 Cb 0.55 1.18 -0.01 0.00 -1.74 0.00 0.00 68.15 68.14 1uuy h THR 16 CO -0.35 0.07 -0.17 0.58 0.37 0.00 0.00 175.52 176.02 1uuy h VAL 17 N -0.27 1.28 -0.56 3.16 2.07 -1.72 -0.99 116.25 119.22 1uuy h VAL 17 Ca -0.01 -1.31 -0.03 0.00 0.82 0.00 0.00 66.70 66.17 1uuy h VAL 17 Cb 0.22 1.23 -0.03 0.00 -1.52 0.00 0.00 31.29 31.19 1uuy h VAL 17 CO 0.02 0.44 0.24 -1.28 0.02 0.00 0.00 177.57 177.01 1uuy h SER 18 N 0.69 0.72 0.49 0.57 0.87 -0.98 -2.03 113.55 113.89 1uuy h SER 18 Ca 0.10 -0.08 0.00 0.00 -1.23 0.00 0.00 61.79 60.57 1uuy h SER 18 Cb 0.73 -0.19 0.00 0.00 -0.44 0.00 0.00 62.40 62.50 1uuy h SER 18 CO 0.06 0.64 -0.02 0.00 -0.53 0.00 0.00 176.83 176.98 1uuy n ALA 19 N -2.45 2.56 -1.07 6.23 0.00 -0.18 -4.91 120.51 120.68 1uuy n ALA 19 Ca 0.05 -0.17 -0.02 0.00 0.00 0.00 0.00 53.44 53.29 1uuy n ALA 19 Cb 0.15 -1.46 -0.01 0.00 0.00 0.00 0.00 19.45 18.13 1uuy n ALA 19 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1uuy n GLY 20 N 1.26 0.58 0.16 0.00 0.00 -0.76 -4.92 105.19 101.51 1uuy n GLY 20 Ca 0.15 -0.90 0.13 0.00 0.00 0.00 0.00 46.02 45.40 1uuy n GLY 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1uuy n ALA 21 N 1.05 3.05 -3.63 4.61 0.00 -0.40 -4.94 120.51 120.25 1uuy n ALA 21 Ca -0.02 -0.35 -0.04 0.00 0.00 0.00 0.00 53.44 53.03 1uuy n ALA 21 Cb 0.09 -1.19 -0.01 0.00 0.00 0.00 0.00 19.45 18.33 1uuy n ALA 21 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1uuy s GLY 22 N -2.60 -0.35 0.70 0.00 0.00 -1.20 -4.96 107.32 98.92 1uuy s GLY 22 Ca 0.23 0.72 -0.10 0.00 0.00 0.00 0.00 44.72 45.56 1uuy s GLY 22 CO 0.54 0.20 1.08 2.56 0.00 0.00 0.00 173.10 177.48 1uuy s PRO 23 N -2.93 2.70 -0.41 2.90 0.04 -1.26 -4.29 135.00 131.74 1uuy s PRO 23 Ca 0.10 0.30 -0.25 0.00 0.04 0.00 0.00 61.00 61.19 1uuy s PRO 23 Cb 0.00 -2.06 0.02 0.00 0.04 0.00 0.00 34.50 32.51 1uuy s PRO 23 CO -0.03 -1.08 0.90 0.34 0.04 0.00 0.00 177.00 177.17 1uuy s ASP 24 N -4.39 6.57 -0.02 6.66 3.68 -1.26 -4.84 116.67 123.06 1uuy s ASP 24 Ca 0.58 0.31 0.22 0.00 2.13 0.00 0.00 52.55 55.79 1uuy s ASP 24 Cb -0.11 -2.45 -0.31 0.00 -1.45 0.00 0.00 42.92 38.61 1uuy s ASP 24 CO 0.50 -0.93 0.58 0.54 0.13 0.00 0.00 175.17 175.99 1uuy n ARG 25 N 6.90 0.51 -0.03 4.34 1.74 -1.26 -4.51 116.66 124.36 1uuy n ARG 25 Ca 0.06 -0.15 -0.20 0.00 -0.77 0.00 0.00 57.85 56.78 1uuy n ARG 25 Cb 0.48 -1.52 -0.13 0.00 -1.02 0.00 0.00 32.46 30.27 1uuy n ARG 25 CO 0.00 0.00 0.00 0.77 -1.52 0.00 0.00 177.63 176.88 1uuy h SER 26 N 0.00 0.23 -0.51 0.55 0.02 -1.90 -3.34 113.55 108.60 1uuy h SER 26 Ca 0.00 -0.80 0.09 0.00 -0.84 0.00 0.00 61.79 60.24 1uuy h SER 26 Cb 0.89 -0.08 -0.10 0.00 0.14 0.00 0.00 62.40 63.25 1uuy h SER 26 CO 0.00 1.48 -0.35 1.23 -1.14 0.00 0.00 176.83 178.05 1uuy h GLY 27 N -0.36 -0.23 1.76 -3.77 0.00 -1.95 -1.06 103.07 97.46 1uuy h GLY 27 Ca -0.26 0.45 -0.04 0.00 0.00 0.00 0.00 47.33 47.48 1uuy h GLY 27 CO -0.01 -0.20 -0.03 -0.56 0.00 0.00 0.00 176.54 175.74 1uuy h PRO 28 N -0.21 0.31 -0.39 4.80 0.13 -1.79 -1.43 132.00 133.41 1uuy h PRO 28 Ca 0.20 -0.05 -0.12 0.00 -0.87 0.00 0.00 66.00 65.15 1uuy h PRO 28 Cb 0.55 -0.05 -0.01 0.00 0.13 0.00 0.00 31.00 31.62 1uuy h PRO 28 CO -0.63 0.36 -0.26 0.00 -0.23 0.00 0.00 178.00 177.24 1uuy h ARG 29 N 0.30 0.81 -0.43 0.86 2.47 -1.48 -1.21 114.38 115.70 1uuy h ARG 29 Ca 0.07 -0.35 -0.04 0.00 -1.26 0.00 0.00 59.98 58.40 1uuy h ARG 29 Cb 0.25 -0.03 -0.02 0.00 -1.65 0.00 0.00 29.97 28.53 1uuy h ARG 29 CO 0.01 0.98 0.12 0.00 0.56 0.00 0.00 179.97 181.63 1uuy h ALA 30 N 1.01 0.57 -0.52 0.04 0.00 -0.71 -0.81 119.26 118.83 1uuy h ALA 30 Ca 0.09 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 1uuy h ALA 30 Cb 0.79 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 1uuy h ALA 30 CO 0.07 0.23 0.31 0.28 0.00 0.00 0.00 179.25 180.14 1uuy h VAL 31 N 0.56 1.16 -0.76 0.00 2.07 -1.15 -1.66 116.25 116.47 1uuy h VAL 31 Ca 0.14 -0.37 -0.03 0.00 0.82 0.00 0.00 66.70 67.26 1uuy h VAL 31 Cb 0.29 0.47 -0.03 0.00 -1.52 0.00 0.00 31.29 30.49 1uuy h VAL 31 CO -0.00 0.16 0.36 0.28 0.02 0.00 0.00 177.57 178.39 1uuy h SER 32 N 0.70 1.00 -0.37 0.57 0.02 -0.99 -0.45 113.55 114.02 1uuy h SER 32 Ca 0.19 -0.14 -0.15 0.00 -0.84 0.00 0.00 61.79 60.85 1uuy h SER 32 Cb -0.00 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.27 1uuy h SER 32 CO -0.03 0.86 -0.33 -0.37 -1.14 0.00 0.00 176.83 175.81 1uuy h VAL 33 N 1.07 1.27 -0.03 2.27 -1.51 -0.91 -1.70 116.25 116.71 1uuy h VAL 33 Ca 0.26 -1.50 -0.00 0.00 -1.23 0.00 0.00 66.70 64.22 1uuy h VAL 33 Cb 0.13 1.31 -0.00 0.00 -2.13 0.00 0.00 31.29 30.60 1uuy h VAL 33 CO -0.03 0.50 -0.00 0.58 -1.23 0.00 0.00 177.57 177.39 1uuy h VAL 34 N 0.76 1.25 -0.36 7.19 2.07 -1.09 -2.51 116.25 123.57 1uuy h VAL 34 Ca 0.08 -0.77 0.06 0.00 0.82 0.00 0.00 66.70 66.89 1uuy h VAL 34 Cb 0.91 1.72 -0.06 0.00 -1.52 0.00 0.00 31.29 32.34 1uuy h VAL 34 CO 0.08 0.20 0.00 -0.78 0.02 0.00 0.00 177.57 177.10 1uuy h ASP 35 N -0.26 -0.14 0.94 0.57 1.82 -1.06 -1.51 116.42 116.79 1uuy h ASP 35 Ca 0.01 0.08 0.00 0.00 -0.39 0.00 0.00 57.03 56.73 1uuy h ASP 35 Cb 0.33 0.14 0.00 0.00 0.68 0.00 0.00 39.33 40.48 1uuy h ASP 35 CO 0.00 -0.03 0.00 -1.54 -1.61 0.00 0.00 179.24 176.06 1uuy n SER 36 N -5.18 0.71 -1.14 2.28 3.41 -0.64 -2.09 113.62 110.96 1uuy n SER 36 Ca 0.02 0.64 0.08 0.00 -0.26 0.00 0.00 58.87 59.35 1uuy n SER 36 Cb 0.18 -0.80 0.29 0.00 -0.26 0.00 0.00 64.21 63.62 1uuy n SER 36 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1uuy n SER 37 N -2.25 4.26 -0.34 4.04 7.64 -0.65 -4.81 113.62 121.52 1uuy n SER 37 Ca 0.03 -2.83 -0.03 0.00 1.01 0.00 0.00 58.87 57.05 1uuy n SER 37 Cb 0.29 -0.54 0.09 0.00 -1.01 0.00 0.00 64.21 63.04 1uuy n SER 37 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 1uuy h SER 38 N 2.52 1.03 -0.25 6.43 4.64 -0.77 -0.85 113.55 126.31 1uuy h SER 38 Ca 0.00 -0.03 -0.13 0.00 -0.47 0.00 0.00 61.79 61.16 1uuy h SER 38 Cb 1.48 -0.26 -0.00 0.00 -0.31 0.00 0.00 62.40 63.31 1uuy h SER 38 CO 0.26 0.75 -0.35 -0.08 -0.87 0.00 0.00 176.83 176.53 1uuy h GLU 39 N 1.22 0.68 0.00 4.77 4.81 -1.87 0.62 114.58 124.81 1uuy h GLU 39 Ca 0.33 -0.40 -0.01 0.00 -0.13 0.00 0.00 59.36 59.16 1uuy h GLU 39 Cb -0.13 0.03 -0.00 0.00 0.63 0.00 0.00 28.75 29.28 1uuy h GLU 39 CO -0.07 1.01 -0.04 0.87 -0.73 0.00 0.00 179.01 180.05 1uuy h LYS 40 N 0.39 0.00 -0.02 1.92 1.57 -1.75 -1.84 116.57 116.86 1uuy h LYS 40 Ca 0.03 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.81 1uuy h LYS 40 Cb 0.94 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.25 1uuy h LYS 40 CO 0.08 0.04 -0.07 1.28 -0.57 0.00 0.00 179.45 180.21 1uuy n LEU 41 N -3.62 1.62 0.00 2.94 4.77 -0.39 -4.45 117.00 117.87 1uuy n LEU 41 Ca -0.02 -0.53 0.00 0.00 -0.03 0.00 0.00 56.01 55.43 1uuy n LEU 41 Cb 0.14 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.20 1uuy n LEU 41 CO 0.27 0.28 0.00 0.61 -1.33 0.00 0.00 177.39 177.22 1uuy n GLY 42 N 1.24 0.83 0.00 -0.72 0.00 -0.69 -4.43 105.19 101.42 1uuy n GLY 42 Ca 0.17 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 46.09 1uuy n GLY 42 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1uuy n GLY 43 N -2.32 0.72 3.84 -0.02 0.00 0.17 -4.77 105.19 102.82 1uuy n GLY 43 Ca 0.00 -0.49 -0.33 0.00 0.00 0.00 0.00 46.02 45.21 1uuy n GLY 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1uuy s ALA 44 N -1.37 3.77 -0.05 4.61 0.00 -0.96 -1.62 121.76 126.13 1uuy s ALA 44 Ca 0.00 -0.84 -0.05 0.00 0.00 0.00 0.00 51.96 51.07 1uuy s ALA 44 Cb 0.00 -1.71 0.02 0.00 0.00 0.00 0.00 23.12 21.43 1uuy s ALA 44 CO 0.00 0.73 0.14 0.21 0.00 0.00 0.00 175.76 176.84 1uuy s LYS 45 N -1.97 0.15 -0.33 0.00 2.20 -0.74 -4.59 119.74 114.46 1uuy s LYS 45 Ca 0.27 0.21 -0.29 0.00 -0.36 0.00 0.00 55.97 55.79 1uuy s LYS 45 Cb -0.12 0.05 0.01 0.00 -1.51 0.00 0.00 37.83 36.26 1uuy s LYS 45 CO 0.18 -0.03 1.24 0.08 -0.36 0.00 0.00 175.35 176.46 1uuy s VAL 46 N 0.18 4.22 -0.54 4.02 1.01 -1.26 -1.18 120.40 126.85 1uuy s VAL 46 Ca -0.01 1.36 0.21 0.00 0.00 0.00 0.00 61.98 63.54 1uuy s VAL 46 Cb -0.02 -4.26 -0.27 0.00 0.00 0.00 0.00 36.38 31.83 1uuy s VAL 46 CO -0.00 -0.54 0.69 1.33 0.00 0.00 0.00 175.10 176.57 1uuy n VAL 47 N 6.24 0.00 -3.63 2.92 0.24 -0.00 -4.93 118.33 119.16 1uuy n VAL 47 Ca 0.14 -0.23 -0.15 0.00 -2.04 0.00 0.00 64.34 62.06 1uuy n VAL 47 Cb 0.47 0.55 -0.07 0.00 -1.47 0.00 0.00 33.84 33.32 1uuy n VAL 47 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1uuy s ALA 48 N -3.18 -1.62 0.13 2.33 0.00 -1.23 -5.06 121.76 113.12 1uuy s ALA 48 Ca 0.01 1.70 0.04 0.00 0.00 0.00 0.00 51.96 53.71 1uuy s ALA 48 Cb 0.15 -0.84 -0.04 0.00 0.00 0.00 0.00 23.12 22.39 1uuy s ALA 48 CO 0.86 -0.32 -0.10 0.95 0.00 0.00 0.00 175.76 177.15 1uuy s THR 49 N 0.00 1.09 0.18 0.00 -4.23 -1.26 -1.47 115.64 109.96 1uuy s THR 49 Ca -0.03 -1.91 -0.16 0.00 -1.18 0.00 0.00 61.69 58.42 1uuy s THR 49 Cb -0.04 -1.68 0.02 0.00 1.34 0.00 0.00 72.50 72.15 1uuy s THR 49 CO 0.03 -0.67 0.48 0.00 -0.54 0.00 0.00 174.62 173.91 1uuy s ALA 50 N -2.99 -0.82 -0.04 3.99 0.00 -0.68 -4.96 121.76 116.25 1uuy s ALA 50 Ca 0.13 -0.29 0.04 0.00 0.00 0.00 0.00 51.96 51.84 1uuy s ALA 50 Cb 0.01 0.84 -0.00 0.00 0.00 0.00 0.00 23.12 23.96 1uuy s ALA 50 CO 0.00 -0.77 -0.16 0.08 0.00 0.00 0.00 175.76 174.91 1uuy s VAL 51 N -3.88 1.37 0.11 0.00 1.01 -1.26 -0.90 120.40 116.86 1uuy s VAL 51 Ca 0.10 -0.68 0.04 0.00 0.00 0.00 0.00 61.98 61.44 1uuy s VAL 51 Cb -0.00 -1.18 -0.04 0.00 0.00 0.00 0.00 36.38 35.16 1uuy s VAL 51 CO -0.03 0.40 -0.11 0.68 0.00 0.00 0.00 175.10 176.04 1uuy s VAL 52 N 0.06 1.05 1.01 2.92 -7.23 -0.48 -4.94 120.40 112.79 1uuy s VAL 52 Ca -0.04 -1.75 -0.14 0.00 -1.81 0.00 0.00 61.98 58.24 1uuy s VAL 52 Cb -0.11 -1.50 0.20 0.00 0.56 0.00 0.00 36.38 35.53 1uuy s VAL 52 CO 0.02 -0.58 1.14 -2.16 -0.31 0.00 0.00 175.10 173.21 1uuy s PRO 53 N -2.99 0.30 -1.29 4.82 0.04 -1.26 -0.94 135.00 133.68 1uuy s PRO 53 Ca 0.08 0.19 -0.17 0.00 0.04 0.00 0.00 61.00 61.14 1uuy s PRO 53 Cb -0.02 -1.75 0.00 0.00 0.04 0.00 0.00 34.50 32.77 1uuy s PRO 53 CO 0.01 -2.75 2.05 -0.25 0.04 0.00 0.00 177.00 176.10 1uuy n ASP 54 N -4.13 3.83 -3.67 6.66 8.00 -1.26 -4.54 116.55 121.44 1uuy n ASP 54 Ca 0.09 -2.82 -0.19 0.00 0.71 0.00 0.00 54.79 52.57 1uuy n ASP 54 Cb 0.59 -1.59 -0.17 0.00 -0.02 0.00 0.00 41.12 39.92 1uuy n ASP 54 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1uuy s GLU 55 N 3.95 -0.05 0.19 -1.24 2.02 -1.26 -4.89 118.70 117.42 1uuy s GLU 55 Ca 0.52 0.41 -0.12 0.00 0.02 0.00 0.00 54.97 55.80 1uuy s GLU 55 Cb 0.11 -0.45 0.20 0.00 0.10 0.00 0.00 34.13 34.09 1uuy s GLU 55 CO -0.00 -0.32 1.76 0.28 0.02 0.00 0.00 175.26 177.01 1uuy h VAL 56 N 6.42 0.87 -0.46 2.63 2.07 -1.88 -1.94 116.25 123.95 1uuy h VAL 56 Ca -0.14 -0.15 -0.08 0.00 0.82 0.00 0.00 66.70 67.15 1uuy h VAL 56 Cb 1.12 0.38 -0.02 0.00 -1.52 0.00 0.00 31.29 31.25 1uuy h VAL 56 CO 0.16 0.08 -0.04 -0.08 0.02 0.00 0.00 177.57 177.72 1uuy h GLU 57 N 0.44 0.78 -0.38 1.57 4.81 -1.97 -0.04 114.58 119.79 1uuy h GLU 57 Ca 0.26 -0.22 -0.07 0.00 -0.13 0.00 0.00 59.36 59.20 1uuy h GLU 57 Cb 0.24 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.53 1uuy h GLU 57 CO -0.23 0.81 -0.02 0.00 -0.73 0.00 0.00 179.01 178.85 1uuy h ARG 58 N 0.72 0.69 -0.01 1.92 2.47 -1.76 -0.97 114.38 117.44 1uuy h ARG 58 Ca 0.13 -0.23 -0.00 0.00 -1.26 0.00 0.00 59.98 58.63 1uuy h ARG 58 Cb 0.50 -0.06 -0.00 0.00 -1.65 0.00 0.00 29.97 28.76 1uuy h ARG 58 CO 0.03 0.79 0.00 0.82 0.56 0.00 0.00 179.97 182.17 1uuy h ILE 59 N 0.51 1.16 -0.56 2.04 2.04 -1.13 -2.59 117.51 118.97 1uuy h ILE 59 Ca 0.11 -0.47 0.08 0.00 1.00 0.00 0.00 64.86 65.58 1uuy h ILE 59 Cb 0.49 1.45 -0.07 0.00 -0.74 0.00 0.00 36.82 37.96 1uuy h ILE 59 CO 0.02 0.12 0.21 0.11 0.00 0.00 0.00 178.15 178.62 1uuy h LYS 60 N -0.17 0.38 -0.66 2.37 1.57 -0.95 -1.56 116.57 117.55 1uuy h LYS 60 Ca 0.00 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.74 1uuy h LYS 60 Cb 0.20 -0.09 -0.03 0.00 0.08 0.00 0.00 32.23 32.39 1uuy h LYS 60 CO -0.00 0.25 0.32 -0.44 -0.57 0.00 0.00 179.45 179.01 1uuy h ASP 61 N 0.39 0.86 -0.27 0.86 3.32 -1.03 -0.35 116.42 120.21 1uuy h ASP 61 Ca 0.28 -0.13 -0.19 0.00 0.02 0.00 0.00 57.03 57.01 1uuy h ASP 61 Cb 0.32 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 39.65 1uuy h ASP 61 CO -0.28 0.75 -0.57 -0.29 -1.72 0.00 0.00 179.24 177.13 1uuy h ILE 62 N 0.91 1.28 -0.83 0.35 2.10 -1.21 -0.92 117.51 119.19 1uuy h ILE 62 Ca 0.23 -1.75 -0.03 0.00 1.08 0.00 0.00 64.86 64.38 1uuy h ILE 62 Cb 0.11 1.69 -0.04 0.00 -1.09 0.00 0.00 36.82 37.50 1uuy h ILE 62 CO -0.03 0.57 0.39 -0.07 -1.08 0.00 0.00 178.15 177.93 1uuy h LEU 63 N 0.63 1.09 -0.24 2.19 3.38 -1.00 -0.32 115.31 121.04 1uuy h LEU 63 Ca 0.00 -0.13 -0.06 0.00 0.09 0.00 0.00 57.88 57.79 1uuy h LEU 63 Cb 1.18 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.64 1uuy h LEU 63 CO 0.13 0.92 -0.06 1.56 0.09 0.00 0.00 178.44 181.07 1uuy h GLN 64 N 1.19 0.47 -0.29 1.13 4.20 -0.98 -2.12 115.11 118.70 1uuy h GLN 64 Ca 0.28 -0.18 -0.01 0.00 0.06 0.00 0.00 58.65 58.80 1uuy h GLN 64 Cb 0.12 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 27.87 1uuy h GLN 64 CO -0.03 0.70 0.15 -0.22 -0.67 0.00 0.00 178.83 178.76 1uuy h LYS 65 N 0.21 0.42 -0.38 1.46 3.64 -0.86 0.11 116.57 121.17 1uuy h LYS 65 Ca 0.06 -0.06 -0.04 0.00 -1.27 0.00 0.00 60.65 59.35 1uuy h LYS 65 Cb 0.53 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 32.26 1uuy h LYS 65 CO 0.03 0.38 0.07 -1.49 -2.27 0.00 0.00 179.45 176.17 1uuy h TRP 66 N 0.35 0.58 0.10 1.91 6.55 -1.07 0.81 115.95 125.18 1uuy h TRP 66 Ca 0.10 -0.04 -0.14 0.00 0.95 0.00 0.00 58.89 59.76 1uuy h TRP 66 Cb 0.10 -0.17 0.02 0.00 -0.86 0.00 0.00 29.16 28.24 1uuy h TRP 66 CO -0.02 0.52 -0.62 0.77 -1.05 0.00 0.00 178.44 178.04 1uuy h SER 67 N 0.56 0.34 0.45 -3.49 0.02 -1.22 -1.37 113.55 108.85 1uuy h SER 67 Ca 0.13 -0.96 -0.30 0.00 -0.84 0.00 0.00 61.79 59.81 1uuy h SER 67 Cb 0.25 -0.11 -0.04 0.00 0.14 0.00 0.00 62.40 62.64 1uuy h SER 67 CO 0.00 1.30 -1.70 0.44 -1.14 0.00 0.00 176.83 175.73 1uuy h ASP 68 N -0.54 0.12 0.00 3.07 3.32 -0.71 -3.36 116.42 118.32 1uuy h ASP 68 Ca -0.11 -0.24 -0.23 0.00 0.02 0.00 0.00 57.03 56.47 1uuy h ASP 68 Cb 1.48 -0.04 -0.03 0.00 0.22 0.00 0.00 39.33 40.96 1uuy h ASP 68 CO 0.11 1.21 -1.72 0.52 -1.72 0.00 0.00 179.24 177.64 1uuy n VAL 69 N -3.19 0.96 1.26 -1.35 0.31 0.18 -4.72 118.33 111.77 1uuy n VAL 69 Ca -0.19 -0.16 0.14 0.00 -0.01 0.00 0.00 64.34 64.12 1uuy n VAL 69 Cb 1.04 -1.76 0.55 0.00 -0.91 0.00 0.00 33.84 32.76 1uuy n VAL 69 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 1uuy n ASP 70 N -3.77 0.38 -1.94 4.52 8.00 -0.59 -4.93 116.55 118.23 1uuy n ASP 70 Ca -0.28 -0.31 -0.15 0.00 0.71 0.00 0.00 54.79 54.76 1uuy n ASP 70 Cb 0.67 -0.10 0.01 0.00 -0.02 0.00 0.00 41.12 41.67 1uuy n ASP 70 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1uuy n GLU 71 N -1.15 -2.51 -1.81 -1.24 1.02 -0.98 -4.98 120.64 108.99 1uuy n GLU 71 Ca 0.12 0.65 -0.35 0.00 -0.02 0.00 0.00 57.16 57.55 1uuy n GLU 71 Cb 0.30 -4.93 0.05 0.00 -0.02 0.00 0.00 31.44 26.85 1uuy n GLU 71 CO 0.00 0.00 0.00 -1.64 1.18 0.00 0.00 177.13 176.67 1uuy s MET 72 N -5.09 2.69 -0.19 3.49 -1.94 -0.55 -4.85 119.30 112.86 1uuy s MET 72 Ca 0.13 1.81 0.10 0.00 -1.71 0.00 0.00 55.69 56.02 1uuy s MET 72 Cb -0.06 -1.90 -0.19 0.00 2.01 0.00 0.00 34.83 34.70 1uuy s MET 72 CO 0.16 -1.42 -0.03 -0.25 -0.01 0.00 0.00 175.02 173.47 1uuy n ASP 73 N -1.98 1.29 -3.82 3.03 8.00 0.12 -4.41 116.55 118.78 1uuy n ASP 73 Ca 0.14 -0.04 -0.19 0.00 0.71 0.00 0.00 54.79 55.40 1uuy n ASP 73 Cb 0.50 0.47 -0.17 0.00 -0.02 0.00 0.00 41.12 41.90 1uuy n ASP 73 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1uuy s LEU 74 N -5.63 1.04 -0.18 0.64 2.96 -0.85 -1.05 118.68 115.60 1uuy s LEU 74 Ca -0.16 -0.07 -0.00 0.00 -0.22 0.00 0.00 54.13 53.68 1uuy s LEU 74 Cb 0.06 -0.34 0.01 0.00 0.50 0.00 0.00 46.19 46.42 1uuy s LEU 74 CO 0.64 -0.11 -0.16 -0.63 -1.32 0.00 0.00 176.35 174.76 1uuy s ILE 75 N 1.25 2.45 -0.20 6.68 1.01 0.42 -0.88 121.20 131.93 1uuy s ILE 75 Ca -0.06 -0.82 -0.08 0.00 0.00 0.00 0.00 60.65 59.69 1uuy s ILE 75 Cb -0.13 -2.05 -0.04 0.00 0.01 0.00 0.00 42.46 40.24 1uuy s ILE 75 CO -0.02 0.51 0.09 -0.76 0.00 0.00 0.00 174.94 174.76 1uuy s LEU 76 N 1.22 3.90 0.06 2.97 1.43 -0.62 -1.24 118.68 126.39 1uuy s LEU 76 Ca 0.03 0.08 0.01 0.00 -1.03 0.00 0.00 54.13 53.21 1uuy s LEU 76 Cb -0.14 -2.01 -0.04 0.00 0.03 0.00 0.00 46.19 44.03 1uuy s LEU 76 CO -0.08 0.13 0.15 0.42 0.23 0.00 0.00 176.35 177.20 1uuy s THR 77 N 0.66 5.02 -0.13 5.49 -4.23 -0.67 -0.93 115.64 120.85 1uuy s THR 77 Ca 0.05 -0.51 -0.00 0.00 -1.18 0.00 0.00 61.69 60.05 1uuy s THR 77 Cb -0.13 -3.42 0.03 0.00 1.34 0.00 0.00 72.50 70.32 1uuy s THR 77 CO 0.01 0.17 -0.10 -0.76 -0.54 0.00 0.00 174.62 173.40 1uuy s LEU 78 N -2.36 1.40 0.00 4.79 1.43 0.17 -0.52 118.68 123.59 1uuy s LEU 78 Ca 0.31 -0.39 0.00 0.00 -1.03 0.00 0.00 54.13 53.02 1uuy s LEU 78 Cb -0.13 -0.97 0.00 0.00 0.03 0.00 0.00 46.19 45.13 1uuy s LEU 78 CO 0.24 -0.10 0.00 0.61 0.23 0.00 0.00 176.35 177.33 1uuy n GLY 79 N 4.88 1.32 2.15 -3.19 0.00 -0.50 -0.75 105.19 109.11 1uuy n GLY 79 Ca -0.14 -1.91 -0.06 0.00 0.00 0.00 0.00 46.02 43.91 1uuy n GLY 79 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1uuy n GLY 80 N 1.56 0.56 0.47 -0.02 0.00 -1.26 -4.70 105.19 101.80 1uuy n GLY 80 Ca 0.00 -0.72 0.10 0.00 0.00 0.00 0.00 46.02 45.40 1uuy n GLY 80 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1uuy n THR 81 N -3.30 0.00 -0.48 2.61 -2.24 -1.26 -1.82 114.28 107.79 1uuy n THR 81 Ca -0.07 -0.29 0.00 0.00 -2.27 0.00 0.00 64.05 61.42 1uuy n THR 81 Cb 0.34 1.24 0.00 0.00 -2.10 0.00 0.00 70.33 69.82 1uuy n THR 81 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1uuy n GLY 82 N 1.33 0.20 0.73 3.38 0.00 -1.26 -0.43 105.19 109.14 1uuy n GLY 82 Ca 0.08 -1.71 0.12 0.00 0.00 0.00 0.00 46.02 44.51 1uuy n GLY 82 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1uuy n PHE 83 N 0.00 0.00 -1.81 1.61 3.01 -1.26 -4.71 117.46 114.31 1uuy n PHE 83 Ca 0.00 0.00 -0.31 0.00 1.01 0.00 0.00 57.45 58.15 1uuy n PHE 83 Cb 0.00 -0.01 0.03 0.00 -0.01 0.00 0.00 39.48 39.49 1uuy n PHE 83 CO 0.00 0.00 0.00 0.95 1.01 0.00 0.00 176.76 178.72 1uuy s THR 84 N -2.18 4.17 0.54 4.37 -4.23 -1.26 -4.92 115.64 112.14 1uuy s THR 84 Ca 0.26 0.80 0.23 0.00 -1.18 0.00 0.00 61.69 61.79 1uuy s THR 84 Cb 0.19 -3.52 0.34 0.00 1.34 0.00 0.00 72.50 70.85 1uuy s THR 84 CO 0.40 -0.83 2.09 -0.65 -0.54 0.00 0.00 174.62 175.09 1uuy h PRO 85 N -0.25 0.00 -0.01 3.99 0.11 -2.04 -1.30 132.00 132.50 1uuy h PRO 85 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1uuy h PRO 85 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1uuy h PRO 85 CO 0.58 0.00 -0.02 0.54 -0.21 0.00 0.00 178.00 178.89 1uuy n ARG 86 N -4.29 1.58 -2.66 1.05 5.12 -1.26 -4.71 116.66 111.50 1uuy n ARG 86 Ca 0.03 -0.91 -0.42 0.00 -1.93 0.00 0.00 57.85 54.62 1uuy n ARG 86 Cb 0.33 -1.48 -0.03 0.00 -1.16 0.00 0.00 32.46 30.11 1uuy n ARG 86 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 1uuy s ASP 87 N -2.04 6.32 0.00 0.55 1.01 -0.49 -4.78 116.67 117.24 1uuy s ASP 87 Ca 0.37 -1.06 0.00 0.00 0.71 0.00 0.00 52.55 52.57 1uuy s ASP 87 Cb 0.21 -2.51 0.00 0.00 1.01 0.00 0.00 42.92 41.62 1uuy s ASP 87 CO 0.35 -1.56 0.90 1.33 0.21 0.00 0.00 175.17 176.40 1uuy n VAL 88 N 6.33 0.80 -0.23 -1.27 0.24 -1.12 -4.78 118.33 118.31 1uuy n VAL 88 Ca 0.13 -0.81 -0.04 0.00 -2.04 0.00 0.00 64.34 61.58 1uuy n VAL 88 Cb 0.49 0.60 0.06 0.00 -1.47 0.00 0.00 33.84 33.52 1uuy n VAL 88 CO 0.00 0.00 0.00 0.74 -2.14 0.00 0.00 176.83 175.43 1uuy h THR 89 N 0.53 1.10 -0.48 3.34 2.02 -1.64 -2.18 112.91 115.59 1uuy h THR 89 Ca 0.00 -0.27 -0.05 0.00 0.77 0.00 0.00 66.41 66.86 1uuy h THR 89 Cb 0.58 0.23 -0.02 0.00 -1.74 0.00 0.00 68.15 67.19 1uuy h THR 89 CO 0.00 0.15 0.09 -0.65 0.37 0.00 0.00 175.52 175.48 1uuy h PRO 90 N 0.80 0.74 -0.47 6.66 0.11 -1.85 -0.96 132.00 137.04 1uuy h PRO 90 Ca 0.26 -0.15 -0.13 0.00 0.11 0.00 0.00 66.00 66.08 1uuy h PRO 90 Cb 0.00 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 30.99 1uuy h PRO 90 CO -0.10 0.69 -0.21 0.93 -0.21 0.00 0.00 178.00 179.10 1uuy h GLU 91 N 0.72 0.97 -0.61 1.05 3.07 -1.82 0.23 114.58 118.20 1uuy h GLU 91 Ca 0.16 -0.42 -0.04 0.00 -0.50 0.00 0.00 59.36 58.56 1uuy h GLU 91 Cb 0.30 -0.03 -0.03 0.00 -0.84 0.00 0.00 28.75 28.16 1uuy h GLU 91 CO 0.00 1.09 0.24 0.00 -1.40 0.00 0.00 179.01 178.94 1uuy h ALA 92 N 0.86 0.79 -0.41 3.43 0.00 -1.13 -2.91 119.26 119.88 1uuy h ALA 92 Ca 0.11 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 1uuy h ALA 92 Cb 0.79 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 1uuy h ALA 92 CO 0.07 0.41 0.16 1.15 0.00 0.00 0.00 179.25 181.03 1uuy h THR 93 N 0.84 1.20 -0.18 0.00 2.02 -0.86 -2.75 112.91 113.19 1uuy h THR 93 Ca 0.20 -0.63 -0.00 0.00 0.77 0.00 0.00 66.41 66.75 1uuy h THR 93 Cb 0.21 0.85 -0.01 0.00 -1.74 0.00 0.00 68.15 67.46 1uuy h THR 93 CO -0.02 0.23 0.10 0.11 0.37 0.00 0.00 175.52 176.31 1uuy h LYS 94 N 0.52 0.24 -0.41 6.66 1.57 -0.88 -1.40 116.57 122.87 1uuy h LYS 94 Ca 0.14 -0.02 -0.07 0.00 -1.87 0.00 0.00 60.65 58.83 1uuy h LYS 94 Cb 0.20 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.44 1uuy h LYS 94 CO -0.01 0.17 -0.04 0.87 -0.57 0.00 0.00 179.45 179.87 1uuy h LYS 95 N 0.24 0.68 0.00 3.15 1.57 -1.29 -3.32 116.57 117.60 1uuy h LYS 95 Ca 0.06 -0.18 -0.26 0.00 -1.87 0.00 0.00 60.65 58.40 1uuy h LYS 95 Cb 0.00 -0.08 -0.05 0.00 0.08 0.00 0.00 32.23 32.19 1uuy h LYS 95 CO -0.01 0.72 -1.78 1.33 -0.57 0.00 0.00 179.45 179.14 1uuy n VAL 96 N -4.22 1.39 -2.48 0.50 0.24 -0.63 -4.91 118.33 108.23 1uuy n VAL 96 Ca 0.02 -0.77 -0.35 0.00 -2.04 0.00 0.00 64.34 61.20 1uuy n VAL 96 Cb 0.30 -0.80 -0.03 0.00 -1.47 0.00 0.00 33.84 31.84 1uuy n VAL 96 CO 0.00 0.00 0.00 0.27 -2.14 0.00 0.00 176.83 174.96 1uuy s ILE 97 N -2.70 3.63 -0.21 1.34 -4.36 -0.63 -4.76 121.20 113.52 1uuy s ILE 97 Ca -0.05 1.07 0.07 0.00 -0.26 0.00 0.00 60.65 61.48 1uuy s ILE 97 Cb 0.08 -3.46 -0.18 0.00 1.25 0.00 0.00 42.46 40.15 1uuy s ILE 97 CO 0.83 -0.17 -0.11 -0.62 0.24 0.00 0.00 174.94 175.11 1uuy n GLU 98 N -0.82 0.74 -3.81 0.37 1.02 0.27 -4.95 120.64 113.47 1uuy n GLU 98 Ca 0.09 0.08 -0.25 0.00 -0.02 0.00 0.00 57.16 57.06 1uuy n GLU 98 Cb 0.51 -1.47 -0.17 0.00 -0.02 0.00 0.00 31.44 30.30 1uuy n GLU 98 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1uuy s ARG 99 N -2.46 0.92 0.48 3.49 0.52 -0.85 -4.98 118.95 116.07 1uuy s ARG 99 Ca -0.23 -0.15 -0.21 0.00 -0.52 0.00 0.00 55.73 54.62 1uuy s ARG 99 Cb 0.07 -1.45 -0.08 0.00 0.52 0.00 0.00 34.95 34.01 1uuy s ARG 99 CO 0.61 -0.37 1.06 -1.21 0.02 0.00 0.00 175.30 175.41 1uuy s GLU 100 N 1.85 3.77 -0.59 3.54 2.02 -1.26 -0.52 118.70 127.51 1uuy s GLU 100 Ca 0.03 1.45 0.06 0.00 0.02 0.00 0.00 54.97 56.54 1uuy s GLU 100 Cb -0.14 -2.16 0.24 0.00 0.10 0.00 0.00 34.13 32.18 1uuy s GLU 100 CO -0.07 -0.47 0.68 0.25 0.02 0.00 0.00 175.26 175.68 1uuy n THR 101 N -0.87 1.66 0.25 3.63 -2.24 -0.80 -4.88 114.28 111.04 1uuy n THR 101 Ca 0.09 -4.94 0.11 0.00 -2.27 0.00 0.00 64.05 57.04 1uuy n THR 101 Cb 0.52 -2.07 0.67 0.00 -2.10 0.00 0.00 70.33 67.34 1uuy n THR 101 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 1uuy h PRO 102 N 4.22 0.00 -0.13 -0.78 0.13 -1.95 -2.53 132.00 130.96 1uuy h PRO 102 Ca 0.17 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.27 1uuy h PRO 102 Cb 0.71 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.83 1uuy h PRO 102 CO 0.75 0.14 -0.07 0.78 -0.23 0.00 0.00 178.00 179.37 1uuy h GLY 103 N 0.87 0.21 1.07 1.56 0.00 -1.98 -0.62 103.07 104.19 1uuy h GLY 103 Ca -0.00 -0.11 -0.11 0.00 0.00 0.00 0.00 47.33 47.11 1uuy h GLY 103 CO 0.02 0.10 -0.10 1.41 0.00 0.00 0.00 176.54 177.97 1uuy h LEU 104 N 0.19 0.99 -0.75 3.11 3.38 -1.88 -1.75 115.31 118.61 1uuy h LEU 104 Ca 0.04 -0.35 -0.09 0.00 0.09 0.00 0.00 57.88 57.57 1uuy h LEU 104 Cb 0.25 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 1uuy h LEU 104 CO 0.01 1.11 -0.04 -0.07 0.09 0.00 0.00 178.44 179.55 1uuy h LEU 105 N 0.86 0.90 0.05 1.67 3.38 -1.50 -2.07 115.31 118.60 1uuy h LEU 105 Ca 0.14 -0.25 -0.00 0.00 0.09 0.00 0.00 57.88 57.85 1uuy h LEU 105 Cb 0.67 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 41.17 1uuy h LEU 105 CO 0.05 0.98 -0.03 0.15 0.09 0.00 0.00 178.44 179.67 1uuy h PHE 106 N 0.84 -0.08 -0.35 1.13 3.57 -0.89 -1.25 116.94 119.91 1uuy h PHE 106 Ca 0.15 -0.00 -0.14 0.00 3.53 0.00 0.00 57.97 61.50 1uuy h PHE 106 Cb 0.55 0.03 -0.01 0.00 2.79 0.00 0.00 35.95 39.31 1uuy h PHE 106 CO 0.03 -0.05 -0.36 -0.39 -2.23 0.00 0.00 178.31 175.32 1uuy h VAL 107 N -0.08 1.28 -0.66 1.41 -1.51 -1.22 0.75 116.25 116.21 1uuy h VAL 107 Ca -0.00 -1.52 0.00 0.00 -1.23 0.00 0.00 66.70 63.95 1uuy h VAL 107 Cb 0.07 1.39 -0.03 0.00 -2.13 0.00 0.00 31.29 30.59 1uuy h VAL 107 CO 0.00 0.50 0.42 0.24 -1.23 0.00 0.00 177.57 177.50 1uuy h MET 108 N 0.66 0.89 -0.14 5.19 2.86 -1.27 -1.24 114.93 121.88 1uuy h MET 108 Ca 0.06 -0.07 -0.04 0.00 -2.06 0.00 0.00 59.70 57.59 1uuy h MET 108 Cb 0.91 -0.19 -0.00 0.00 0.06 0.00 0.00 31.60 32.37 1uuy h MET 108 CO 0.08 0.61 -0.07 1.98 1.06 0.00 0.00 176.91 180.57 1uuy h MET 109 N 0.90 0.30 -0.46 1.72 -1.53 -0.95 -0.38 114.93 114.53 1uuy h MET 109 Ca 0.24 -0.13 0.05 0.00 -3.44 0.00 0.00 59.70 56.42 1uuy h MET 109 Cb -0.06 -0.01 -0.05 0.00 -0.55 0.00 0.00 31.60 30.93 1uuy h MET 109 CO -0.05 0.63 0.20 0.37 0.14 0.00 0.00 176.91 178.20 1uuy h GLN 110 N -0.04 0.39 -0.09 0.39 4.15 -0.72 -0.76 115.11 118.42 1uuy h GLN 110 Ca 0.03 -0.02 -0.24 0.00 0.77 0.00 0.00 58.65 59.19 1uuy h GLN 110 Cb 0.54 -0.09 0.01 0.00 0.21 0.00 0.00 27.48 28.16 1uuy h GLN 110 CO 0.02 0.25 -0.88 0.93 -1.93 0.00 0.00 178.83 177.23 1uuy h GLU 111 N 0.40 0.76 -0.53 1.69 4.39 -1.20 -3.24 114.58 116.85 1uuy h GLU 111 Ca 0.21 -0.69 -0.03 0.00 0.34 0.00 0.00 59.36 59.19 1uuy h GLU 111 Cb 0.16 0.16 -0.03 0.00 -0.10 0.00 0.00 28.75 28.95 1uuy h GLU 111 CO -0.18 1.28 0.20 0.77 -1.16 0.00 0.00 179.01 179.92 1uuy h SER 112 N 0.48 0.69 0.56 1.42 0.02 -0.86 -2.30 113.55 113.56 1uuy h SER 112 Ca -0.08 -0.09 -0.02 0.00 -0.84 0.00 0.00 61.79 60.76 1uuy h SER 112 Cb 1.52 -0.18 -0.00 0.00 0.14 0.00 0.00 62.40 63.88 1uuy h SER 112 CO 0.18 0.63 -0.10 -0.07 -1.14 0.00 0.00 176.83 176.33 1uuy h LEU 113 N 0.75 0.00 -1.44 5.07 3.38 -1.16 -0.90 115.31 121.01 1uuy h LEU 113 Ca 0.18 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.10 1uuy h LEU 113 Cb 0.16 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 1uuy h LEU 113 CO -0.02 0.10 -0.24 0.11 0.09 0.00 0.00 178.44 178.48 1uuy h LYS 114 N 0.00 0.00 0.05 1.13 1.57 -1.47 -3.28 116.57 114.58 1uuy h LYS 114 Ca -0.00 0.00 -0.27 0.00 -1.87 0.00 0.00 60.65 58.51 1uuy h LYS 114 Cb 0.40 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.69 1uuy h LYS 114 CO 0.01 0.24 -1.43 0.82 -0.57 0.00 0.00 179.45 178.52 1uuy h ILE 115 N 0.00 0.90 -2.60 1.86 2.04 -1.26 -3.49 117.51 114.96 1uuy h ILE 115 Ca -0.00 -2.27 -0.11 0.00 1.00 0.00 0.00 64.86 63.48 1uuy h ILE 115 Cb 0.58 2.43 -0.23 0.00 -0.74 0.00 0.00 36.82 38.86 1uuy h ILE 115 CO 0.03 0.55 -0.17 0.28 0.00 0.00 0.00 178.15 178.84 1uuy s THR 116 N -2.43 -0.00 0.50 -0.27 -1.32 -0.74 -5.02 115.64 106.36 1uuy s THR 116 Ca -0.25 0.00 0.34 0.00 -1.21 0.00 0.00 61.69 60.57 1uuy s THR 116 Cb 0.05 -0.66 0.37 0.00 -1.51 0.00 0.00 72.50 70.75 1uuy s THR 116 CO 0.67 0.00 2.20 1.55 -2.21 0.00 0.00 174.62 176.83 1uuy h PRO 117 N 5.44 0.00 0.00 7.08 0.13 -1.86 -2.36 132.00 140.44 1uuy h PRO 117 Ca -0.27 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 1uuy h PRO 117 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1uuy h PRO 117 CO 0.21 0.04 0.00 1.19 -0.23 0.00 0.00 178.00 179.21 1uuy n PHE 118 N -3.44 0.05 -0.13 1.56 3.01 -1.26 -2.13 117.46 115.13 1uuy n PHE 118 Ca -0.02 0.02 0.23 0.00 1.01 0.00 0.00 57.45 58.70 1uuy n PHE 118 Cb 0.16 -0.54 0.67 0.00 -0.01 0.00 0.00 39.48 39.76 1uuy n PHE 118 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1uuy h ALA 119 N 2.33 2.59 0.00 4.37 0.00 -1.70 -1.25 119.26 125.60 1uuy h ALA 119 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1uuy h ALA 119 Cb 0.18 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1uuy h ALA 119 CO 0.00 -0.81 0.00 0.00 0.00 0.00 0.00 179.25 178.44 1uuy n MET 120 N -4.36 0.15 0.00 0.00 0.00 -0.90 -1.90 117.12 110.11 1uuy n MET 120 Ca 0.15 0.49 0.13 0.00 0.00 0.00 0.00 57.70 58.48 1uuy n MET 120 Cb 0.77 -1.86 0.49 0.00 0.00 0.00 0.00 33.22 32.62 1uuy n MET 120 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 175.97 177.25 1uuy n LEU 121 N -2.15 0.63 -4.69 3.17 4.77 -0.47 -4.81 117.00 113.45 1uuy n LEU 121 Ca 0.01 -0.05 -0.42 0.00 -0.03 0.00 0.00 56.01 55.51 1uuy n LEU 121 Cb 0.14 -0.19 -0.03 0.00 -2.33 0.00 0.00 43.42 41.01 1uuy n LEU 121 CO 0.14 0.12 0.86 0.00 -1.33 0.00 0.00 177.39 177.19 1uuy s ALA 122 N -2.59 3.43 -0.28 -1.18 0.00 -0.80 -4.22 121.76 116.12 1uuy s ALA 122 Ca 0.24 0.53 0.11 0.00 0.00 0.00 0.00 51.96 52.85 1uuy s ALA 122 Cb 0.19 -3.47 0.64 0.00 0.00 0.00 0.00 23.12 20.49 1uuy s ALA 122 CO 0.52 -0.64 1.64 0.54 0.00 0.00 0.00 175.76 177.83 1uuy n ARG 123 N 4.94 3.10 -1.53 0.00 1.74 0.43 -5.01 116.66 120.32 1uuy n ARG 123 Ca 0.10 -3.04 -0.46 0.00 -0.77 0.00 0.00 57.85 53.67 1uuy n ARG 123 Cb 0.48 -2.04 -0.02 0.00 -1.02 0.00 0.00 32.46 29.86 1uuy n ARG 123 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 1uuy n SER 124 N -0.48 0.56 -4.77 0.55 7.64 -1.26 -4.73 113.62 111.13 1uuy n SER 124 Ca 0.35 1.16 -0.23 0.00 1.01 0.00 0.00 58.87 61.16 1uuy n SER 124 Cb 1.19 -1.18 -0.06 0.00 -1.01 0.00 0.00 64.21 63.16 1uuy n SER 124 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1uuy s ALA 125 N -0.93 3.62 -0.17 -0.43 0.00 -1.26 -4.98 121.76 117.60 1uuy s ALA 125 Ca 0.62 -1.84 -0.27 0.00 0.00 0.00 0.00 51.96 50.47 1uuy s ALA 125 Cb -0.79 -0.78 0.07 0.00 0.00 0.00 0.00 23.12 21.62 1uuy s ALA 125 CO 0.58 -0.02 0.69 0.00 0.00 0.00 0.00 175.76 177.01 1uuy s ALA 126 N -2.43 -1.74 0.00 0.00 0.00 -1.26 -1.44 121.76 114.88 1uuy s ALA 126 Ca 0.40 1.70 0.00 0.00 0.00 0.00 0.00 51.96 54.05 1uuy s ALA 126 Cb -0.02 -0.68 0.00 0.00 0.00 0.00 0.00 23.12 22.42 1uuy s ALA 126 CO 0.24 -0.35 0.00 0.41 0.00 0.00 0.00 175.76 176.06 1uuy n GLY 127 N 1.96 -1.24 3.44 0.00 0.00 -0.38 -1.90 105.19 107.07 1uuy n GLY 127 Ca -0.16 -0.84 -0.33 0.00 0.00 0.00 0.00 46.02 44.69 1uuy n GLY 127 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1uuy s ILE 128 N -2.89 3.13 -0.16 -0.61 1.01 0.32 -0.54 121.20 121.45 1uuy s ILE 128 Ca 0.00 -0.67 0.00 0.00 0.00 0.00 0.00 60.65 59.98 1uuy s ILE 128 Cb 0.00 -2.27 0.03 0.00 0.01 0.00 0.00 42.46 40.23 1uuy s ILE 128 CO 0.00 0.56 -0.10 -0.60 0.00 0.00 0.00 174.94 174.80 1uuy s ARG 129 N -0.23 1.88 7.97 2.79 3.52 -0.22 -0.56 118.95 134.10 1uuy s ARG 129 Ca 0.01 -0.60 0.00 0.00 -0.13 0.00 0.00 55.73 55.01 1uuy s ARG 129 Cb -0.13 -2.11 0.00 0.00 -1.56 0.00 0.00 34.95 31.15 1uuy s ARG 129 CO 0.03 -0.36 0.00 0.41 -0.81 0.00 0.00 175.30 174.57 1uuy n GLY 130 N 4.79 4.08 2.06 8.12 0.00 -1.26 -1.06 105.19 121.92 1uuy n GLY 130 Ca -0.14 0.08 -0.26 0.00 0.00 0.00 0.00 46.02 45.70 1uuy n GLY 130 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1uuy n SER 131 N 9.04 5.53 -4.05 1.61 3.41 -1.26 -4.99 113.62 122.91 1uuy n SER 131 Ca 0.00 -3.76 -0.29 0.00 -0.26 0.00 0.00 58.87 54.56 1uuy n SER 131 Cb 0.00 -0.52 -0.17 0.00 -0.26 0.00 0.00 64.21 63.27 1uuy n SER 131 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1uuy s THR 132 N -4.60 1.50 -0.12 6.66 2.01 -0.22 -4.58 115.64 116.29 1uuy s THR 132 Ca 0.54 -0.64 -0.17 0.00 0.31 0.00 0.00 61.69 61.73 1uuy s THR 132 Cb 0.44 -1.37 -0.04 0.00 0.01 0.00 0.00 72.50 71.53 1uuy s THR 132 CO 0.02 0.44 0.45 -0.22 -0.69 0.00 0.00 174.62 174.63 1uuy s LEU 133 N 1.00 4.28 -0.12 4.42 2.96 -0.22 -1.06 118.68 129.94 1uuy s LEU 133 Ca -0.06 0.78 0.03 0.00 -0.22 0.00 0.00 54.13 54.66 1uuy s LEU 133 Cb -0.15 -2.65 0.01 0.00 0.50 0.00 0.00 46.19 43.90 1uuy s LEU 133 CO -0.02 0.03 -0.23 -0.63 -1.32 0.00 0.00 176.35 174.18 1uuy s ILE 134 N 0.52 2.05 -0.07 6.68 1.01 0.30 -0.44 121.20 131.26 1uuy s ILE 134 Ca 0.25 -1.00 0.00 0.00 0.00 0.00 0.00 60.65 59.91 1uuy s ILE 134 Cb -0.15 -1.80 0.02 0.00 0.01 0.00 0.00 42.46 40.55 1uuy s ILE 134 CO 0.10 0.55 -0.06 -0.63 0.00 0.00 0.00 174.94 174.90 1uuy s ILE 135 N 0.60 0.75 0.01 2.92 1.01 -0.38 -1.25 121.20 124.86 1uuy s ILE 135 Ca -0.13 -0.19 -0.26 0.00 0.00 0.00 0.00 60.65 60.07 1uuy s ILE 135 Cb -0.17 -0.77 -0.04 0.00 0.01 0.00 0.00 42.46 41.48 1uuy s ILE 135 CO 0.03 0.29 0.82 0.20 0.00 0.00 0.00 174.94 176.29 1uuy s ASN 136 N 1.27 7.22 0.19 3.58 0.01 -0.52 -1.66 114.94 125.03 1uuy s ASN 136 Ca -0.05 1.47 0.10 0.00 -0.71 0.00 0.00 52.86 53.67 1uuy s ASN 136 Cb -0.14 -2.49 -0.04 0.00 0.41 0.00 0.00 41.25 38.99 1uuy s ASN 136 CO -0.02 -0.10 -0.20 -0.04 -1.51 0.00 0.00 177.10 175.23 1uuy s MET 137 N 0.44 1.39 0.80 -0.60 -1.94 0.33 -4.71 119.30 115.01 1uuy s MET 137 Ca 0.43 -1.49 -0.11 0.00 -1.71 0.00 0.00 55.69 52.80 1uuy s MET 137 Cb -0.20 -1.51 0.08 0.00 2.01 0.00 0.00 34.83 35.21 1uuy s MET 137 CO 0.24 0.31 1.11 -2.14 -0.01 0.00 0.00 175.02 174.53 1uuy s PRO 138 N -2.90 1.92 0.42 2.03 0.02 -1.26 -1.41 135.00 133.81 1uuy s PRO 138 Ca 0.19 1.32 0.24 0.00 0.02 0.00 0.00 61.00 62.77 1uuy s PRO 138 Cb -0.06 -1.85 0.42 0.00 0.02 0.00 0.00 34.50 33.03 1uuy s PRO 138 CO 0.08 -1.92 1.64 0.78 -0.33 0.00 0.00 177.00 177.25 1uuy h GLY 139 N -1.23 0.00 -5.45 0.52 0.00 -1.86 -3.32 103.07 91.72 1uuy h GLY 139 Ca -0.44 0.00 -0.60 0.00 0.00 0.00 0.00 47.33 46.30 1uuy h GLY 139 CO 0.48 0.00 1.01 -2.01 0.00 0.00 0.00 176.54 176.03 1uuy n ASN 140 N -3.01 3.41 -0.20 0.19 2.85 -1.26 -4.70 115.26 112.54 1uuy n ASN 140 Ca 0.04 1.00 0.24 0.00 -0.11 0.00 0.00 54.58 55.76 1uuy n ASN 140 Cb 0.51 -1.40 0.63 0.00 1.24 0.00 0.00 39.78 40.76 1uuy n ASN 140 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 1uuy h PRO 141 N 8.22 0.17 0.00 1.20 0.11 -1.87 0.44 132.00 140.26 1uuy h PRO 141 Ca -0.47 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1uuy h PRO 141 Cb 1.26 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1uuy h PRO 141 CO 0.93 0.11 0.00 -0.91 -0.21 0.00 0.00 178.00 177.92 1uuy h ASN 142 N 0.17 0.00 -0.44 -2.05 2.35 -1.94 -3.36 115.58 110.32 1uuy h ASN 142 Ca 0.44 0.00 -0.08 0.00 -0.55 0.00 0.00 56.30 56.11 1uuy h ASN 142 Cb 1.45 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.80 1uuy h ASN 142 CO -0.08 0.00 -0.03 0.00 -1.65 0.00 0.00 177.43 175.66 1uuy h ALA 143 N 2.21 0.59 -0.79 -0.83 0.00 -1.21 -3.09 119.26 116.14 1uuy h ALA 143 Ca 0.00 -0.29 0.02 0.00 0.00 0.00 0.00 54.91 54.65 1uuy h ALA 143 Cb 0.74 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.33 1uuy h ALA 143 CO 0.00 0.41 0.51 -0.24 0.00 0.00 0.00 179.25 179.93 1uuy h VAL 144 N 0.63 1.15 -0.57 0.00 3.04 -1.70 -0.29 116.25 118.51 1uuy h VAL 144 Ca 0.12 -0.35 -0.02 0.00 -1.01 0.00 0.00 66.70 65.44 1uuy h VAL 144 Cb 0.54 0.05 -0.03 0.00 -2.01 0.00 0.00 31.29 29.84 1uuy h VAL 144 CO 0.03 0.18 0.27 0.00 -1.01 0.00 0.00 177.57 177.04 1uuy h ALA 145 N 1.32 0.73 -0.44 3.17 0.00 -1.79 0.26 119.26 122.50 1uuy h ALA 145 Ca 0.31 -0.13 -0.06 0.00 0.00 0.00 0.00 54.91 55.02 1uuy h ALA 145 Cb -0.03 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 1uuy h ALA 145 CO -0.10 0.30 0.04 0.93 0.00 0.00 0.00 179.25 180.43 1uuy h GLU 146 N 0.77 0.75 -0.53 0.00 5.08 -1.36 -1.23 114.58 118.07 1uuy h GLU 146 Ca 0.19 -0.22 -0.10 0.00 -1.00 0.00 0.00 59.36 58.23 1uuy h GLU 146 Cb 0.13 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.28 1uuy h GLU 146 CO -0.02 0.80 -0.08 0.00 -1.00 0.00 0.00 179.01 178.71 1uuy h MET 148 N 0.86 1.07 -0.89 0.00 2.86 -0.85 -2.28 114.93 115.70 1uuy h MET 148 Ca 0.14 -0.36 0.06 0.00 -2.06 0.00 0.00 59.70 57.48 1uuy h MET 148 Cb 0.64 -0.09 -0.06 0.00 0.06 0.00 0.00 31.60 32.15 1uuy h MET 148 CO 0.04 1.06 0.58 1.49 1.06 0.00 0.00 176.91 181.14 1uuy h GLU 149 N 0.97 0.98 -0.66 1.72 4.81 -1.09 0.27 114.58 121.58 1uuy h GLU 149 Ca 0.16 -0.06 -0.05 0.00 -0.13 0.00 0.00 59.36 59.29 1uuy h GLU 149 Cb 0.60 -0.22 -0.03 0.00 0.63 0.00 0.00 28.75 29.73 1uuy h GLU 149 CO 0.04 0.65 0.22 0.00 -0.73 0.00 0.00 179.01 179.19 1uuy h ALA 150 N 1.52 1.15 0.00 2.92 0.00 -1.02 -3.18 119.26 120.65 1uuy h ALA 150 Ca 0.38 -0.20 -0.16 0.00 0.00 0.00 0.00 54.91 54.93 1uuy h ALA 150 Cb 0.19 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 1uuy h ALA 150 CO -0.14 0.60 -1.14 -0.07 0.00 0.00 0.00 179.25 178.49 1uuy h LEU 151 N 0.97 0.00 -1.46 0.00 3.38 -0.84 -3.40 115.31 113.96 1uuy h LEU 151 Ca 0.22 0.00 0.14 0.00 0.09 0.00 0.00 57.88 58.33 1uuy h LEU 151 Cb 0.25 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.94 1uuy h LEU 151 CO -0.01 0.63 0.52 -0.07 0.09 0.00 0.00 178.44 179.60 1uuy h LEU 152 N 0.00 0.51 -2.02 1.67 3.38 -0.94 -1.72 115.31 116.18 1uuy h LEU 152 Ca -0.11 0.03 0.14 0.00 0.09 0.00 0.00 57.88 58.02 1uuy h LEU 152 Cb 1.58 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 42.24 1uuy h LEU 152 CO 0.06 0.27 0.36 -0.65 0.09 0.00 0.00 178.44 178.57 1uuy h PRO 153 N 0.55 0.00 0.00 1.13 0.11 -1.78 -3.26 132.00 128.74 1uuy h PRO 153 Ca 0.39 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.50 1uuy h PRO 153 Cb 0.73 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.84 1uuy h PRO 153 CO -0.15 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 177.64 1uuy n ALA 154 N -2.57 1.69 0.05 -0.75 0.00 -0.75 -4.82 120.51 113.36 1uuy n ALA 154 Ca 0.08 -0.16 -0.00 0.00 0.00 0.00 0.00 53.44 53.36 1uuy n ALA 154 Cb 0.57 0.00 0.30 0.00 0.00 0.00 0.00 19.45 20.32 1uuy n ALA 154 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1uuy h LEU 155 N 0.00 0.38 -0.59 0.00 5.85 -1.39 -1.28 115.31 118.27 1uuy h LEU 155 Ca 0.00 -0.09 -0.01 0.00 0.84 0.00 0.00 57.88 58.62 1uuy h LEU 155 Cb 0.05 -0.10 -0.03 0.00 0.37 0.00 0.00 40.66 40.95 1uuy h LEU 155 CO 0.00 0.55 0.35 0.50 -0.34 0.00 0.00 178.44 179.49 1uuy h LYS 156 N 0.37 0.81 -0.37 1.25 3.64 -1.78 -1.27 116.57 119.23 1uuy h LYS 156 Ca 0.07 -0.08 -0.11 0.00 -1.27 0.00 0.00 60.65 59.26 1uuy h LYS 156 Cb 0.46 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 32.10 1uuy h LYS 156 CO 0.03 0.60 -0.23 1.25 -2.27 0.00 0.00 179.45 178.83 1uuy h HIS 157 N 0.80 0.82 -0.38 1.91 2.76 -1.74 -1.05 115.15 118.27 1uuy h HIS 157 Ca 0.21 -0.18 0.03 0.00 -2.20 0.00 0.00 60.37 58.23 1uuy h HIS 157 Cb 0.00 -0.20 -0.03 0.00 1.55 0.00 0.00 27.41 28.73 1uuy h HIS 157 CO -0.02 0.89 0.19 0.00 -1.30 0.00 0.00 177.93 177.69 1uuy h ALA 158 N 1.11 0.47 -0.39 5.26 0.00 -0.78 -1.32 119.26 123.62 1uuy h ALA 158 Ca 0.09 0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.89 1uuy h ALA 158 Cb 0.72 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 1uuy h ALA 158 CO 0.06 -0.17 -0.25 -0.07 0.00 0.00 0.00 179.25 178.81 1uuy h LEU 159 N 0.39 0.83 -0.66 0.00 3.38 -0.86 -1.92 115.31 116.47 1uuy h LEU 159 Ca 0.16 -0.31 0.00 0.00 0.09 0.00 0.00 57.88 57.82 1uuy h LEU 159 Cb 0.07 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.56 1uuy h LEU 159 CO -0.11 1.04 0.42 0.11 0.09 0.00 0.00 178.44 179.98 1uuy h LYS 160 N 0.70 0.87 -0.49 1.13 1.57 -1.03 -3.15 116.57 116.17 1uuy h LYS 160 Ca 0.09 -0.06 -0.10 0.00 -1.87 0.00 0.00 60.65 58.71 1uuy h LYS 160 Cb 0.78 -0.19 -0.02 0.00 0.08 0.00 0.00 32.23 32.88 1uuy h LYS 160 CO 0.06 0.60 -0.07 1.96 -0.57 0.00 0.00 179.45 181.43 1uuy h GLN 161 N 0.89 0.92 0.00 3.15 4.20 -0.86 -3.00 115.11 120.41 1uuy h GLN 161 Ca 0.24 -0.33 -0.02 0.00 0.06 0.00 0.00 58.65 58.60 1uuy h GLN 161 Cb -0.07 -0.06 -0.00 0.00 0.30 0.00 0.00 27.48 27.64 1uuy h GLN 161 CO -0.05 0.98 -0.11 0.82 -0.67 0.00 0.00 178.83 179.80 1uuy h ILE 162 N 0.77 0.57 0.00 2.54 2.04 -1.32 -3.52 117.51 118.60 1uuy h ILE 162 Ca 0.13 -0.47 0.00 0.00 1.00 0.00 0.00 64.86 65.52 1uuy h ILE 162 Cb 0.61 1.30 0.00 0.00 -0.74 0.00 0.00 36.82 37.99 1uuy h ILE 162 CO 0.04 0.10 0.00 0.29 0.00 0.00 0.00 178.15 178.58