#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ysp h ASP 2 N 0.00 1.01 -0.38 3.17 3.32 -2.00 -2.44 116.42 119.10 1ysp h ASP 2 Ca 0.00 -0.38 0.04 0.00 0.02 0.00 0.00 57.03 56.71 1ysp h ASP 2 Cb 0.00 -0.28 -0.04 0.00 0.22 0.00 0.00 39.33 39.23 1ysp h ASP 2 CO 0.00 1.18 0.14 0.25 -1.72 0.00 0.00 179.24 179.08 1ysp h LEU 3 N 0.86 0.15 -0.46 1.55 5.85 -1.95 -1.64 115.31 119.66 1ysp h LEU 3 Ca 0.11 0.04 -0.15 0.00 0.84 0.00 0.00 57.88 58.72 1ysp h LEU 3 Cb 0.79 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.83 1ysp h LEU 3 CO 0.07 0.12 -0.37 0.40 -0.34 0.00 0.00 178.44 178.32 1ysp h ILE 4 N 0.30 1.28 -0.60 4.05 2.04 -1.97 -0.22 117.51 122.39 1ysp h ILE 4 Ca 0.17 -1.54 -0.02 0.00 1.00 0.00 0.00 64.86 64.47 1ysp h ILE 4 Cb 0.15 1.38 -0.03 0.00 -0.74 0.00 0.00 36.82 37.58 1ysp h ILE 4 CO -0.17 0.51 0.31 -0.09 0.00 0.00 0.00 178.15 178.71 1ysp h ARG 5 N 0.72 0.84 -0.24 2.37 2.43 -1.20 0.33 114.38 119.63 1ysp h ARG 5 Ca 0.06 -0.11 -0.18 0.00 -0.81 0.00 0.00 59.98 58.95 1ysp h ARG 5 Cb 0.95 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 30.34 1ysp h ARG 5 CO 0.09 0.65 -0.53 0.77 -1.51 0.00 0.00 179.97 179.44 1ysp h SER 6 N 0.81 0.89 -0.61 -3.80 0.02 -1.22 -3.07 113.55 106.57 1ysp h SER 6 Ca 0.21 -0.55 -0.03 0.00 -0.84 0.00 0.00 61.79 60.57 1ysp h SER 6 Cb 0.07 -0.26 -0.03 0.00 0.14 0.00 0.00 62.40 62.33 1ysp h SER 6 CO -0.03 1.28 0.25 0.00 -1.14 0.00 0.00 176.83 177.19 1ysp h ALA 7 N 0.63 0.78 -0.69 3.77 0.00 -0.85 -2.90 119.26 120.01 1ysp h ALA 7 Ca 0.00 -0.16 0.10 0.00 0.00 0.00 0.00 54.91 54.85 1ysp h ALA 7 Cb 1.15 -0.24 -0.07 0.00 0.00 0.00 0.00 17.79 18.62 1ysp h ALA 7 CO 0.12 0.39 0.31 0.22 0.00 0.00 0.00 179.25 180.29 1ysp h ASP 8 N 0.84 0.37 -0.32 0.00 3.58 -0.25 0.23 116.42 120.87 1ysp h ASP 8 Ca 0.20 0.07 -0.01 0.00 0.42 0.00 0.00 57.03 57.72 1ysp h ASP 8 Cb 0.18 0.02 -0.01 0.00 1.72 0.00 0.00 39.33 41.24 1ysp h ASP 8 CO -0.02 0.20 0.16 0.40 -2.88 0.00 0.00 179.24 177.11 1ysp h ILE 9 N 0.53 1.15 -0.00 2.25 2.04 -1.48 -1.12 117.51 120.87 1ysp h ILE 9 Ca 0.35 -0.41 -0.16 0.00 1.00 0.00 0.00 64.86 65.64 1ysp h ILE 9 Cb 0.41 0.83 -0.02 0.00 -0.74 0.00 0.00 36.82 37.30 1ysp h ILE 9 CO -0.30 0.15 -0.74 1.56 0.00 0.00 0.00 178.15 178.82 1ysp h GLN 10 N 0.39 0.04 -0.32 2.37 1.08 -1.16 -2.20 115.11 115.31 1ysp h GLN 10 Ca 0.11 -0.04 -0.14 0.00 -1.45 0.00 0.00 58.65 57.14 1ysp h GLN 10 Cb 0.09 0.01 -0.00 0.00 -0.05 0.00 0.00 27.48 27.53 1ysp h GLN 10 CO -0.02 0.76 -0.33 0.52 -0.95 0.00 0.00 178.83 178.82 1ysp h MET 11 N 0.03 0.79 -0.82 1.46 2.86 -0.52 -0.92 114.93 117.80 1ysp h MET 11 Ca -0.01 -0.42 -0.01 0.00 -2.06 0.00 0.00 59.70 57.20 1ysp h MET 11 Cb 1.31 0.02 -0.04 0.00 0.06 0.00 0.00 31.60 32.95 1ysp h MET 11 CO 0.10 1.05 0.46 0.00 1.06 0.00 0.00 176.91 179.57 1ysp h ARG 12 N 0.56 1.13 -0.44 1.72 3.08 -1.14 -0.50 114.38 118.79 1ysp h ARG 12 Ca 0.05 -0.12 0.01 0.00 0.07 0.00 0.00 59.98 59.98 1ysp h ARG 12 Cb 0.91 -0.23 -0.02 0.00 0.08 0.00 0.00 29.97 30.71 1ysp h ARG 12 CO 0.08 0.82 0.28 1.49 -1.07 0.00 0.00 179.97 181.58 1ysp h GLU 13 N 1.14 0.56 -0.85 0.04 4.57 -1.21 -0.08 114.58 118.75 1ysp h GLU 13 Ca 0.29 -0.03 -0.03 0.00 -1.18 0.00 0.00 59.36 58.40 1ysp h GLU 13 Cb 0.01 -0.13 -0.04 0.00 -0.16 0.00 0.00 28.75 28.44 1ysp h GLU 13 CO -0.05 0.37 0.40 -0.07 -1.18 0.00 0.00 179.01 178.48 1ysp h LEU 14 N 0.57 1.12 -0.22 1.64 3.38 -0.86 0.25 115.31 121.18 1ysp h LEU 14 Ca 0.16 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 1ysp h LEU 14 Cb -0.05 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 40.41 1ysp h LEU 14 CO -0.05 0.95 0.10 -1.28 0.09 0.00 0.00 178.44 178.25 1ysp h SER 15 N 1.21 0.29 -0.47 -0.43 0.87 -0.82 0.95 113.55 115.15 1ysp h SER 15 Ca 0.29 -0.13 0.09 0.00 -1.23 0.00 0.00 61.79 60.81 1ysp h SER 15 Cb 0.13 -0.07 -0.07 0.00 -0.44 0.00 0.00 62.40 61.95 1ysp h SER 15 CO -0.03 0.34 0.05 -0.09 -0.53 0.00 0.00 176.83 176.56 1ysp h ARG 16 N 0.22 0.16 0.00 2.24 2.43 -0.83 0.45 114.38 119.06 1ysp h ARG 16 Ca 0.07 -0.01 -0.12 0.00 -0.81 0.00 0.00 59.98 59.11 1ysp h ARG 16 Cb 0.13 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 29.62 1ysp h ARG 16 CO -0.01 0.11 -0.59 -0.07 -1.51 0.00 0.00 179.97 177.90 1ysp h LEU 17 N 0.17 0.00 0.00 3.80 3.38 -0.59 -3.39 115.31 118.68 1ysp h LEU 17 Ca 0.24 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.21 1ysp h LEU 17 Cb 0.33 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.08 1ysp h LEU 17 CO -0.35 0.59 -0.87 0.35 0.09 0.00 0.00 178.44 178.25 1ysp n THR 18 N -3.57 0.00 -1.33 0.22 -2.24 0.30 -5.00 114.28 102.65 1ysp n THR 18 Ca -0.00 -0.02 -0.11 0.00 -2.27 0.00 0.00 64.05 61.64 1ysp n THR 18 Cb 0.65 0.49 -0.05 0.00 -2.10 0.00 0.00 70.33 69.32 1ysp n THR 18 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1ysp n LYS 19 N -1.36 -1.63 -2.72 -0.78 4.76 0.16 -4.99 118.16 111.60 1ysp n LYS 19 Ca 0.00 0.89 -0.22 0.00 -2.87 0.00 0.00 58.31 56.12 1ysp n LYS 19 Cb 0.00 -5.29 0.03 0.00 -1.84 0.00 0.00 35.03 27.93 1ysp n LYS 19 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 1ysp s GLU 20 N -2.94 2.69 0.01 1.97 0.41 -1.26 -4.69 118.70 114.89 1ysp s GLU 20 Ca 0.00 -0.66 -0.30 0.00 -0.41 0.00 0.00 54.97 53.60 1ysp s GLU 20 Cb 0.00 -2.49 -0.04 0.00 -1.78 0.00 0.00 34.13 29.82 1ysp s GLU 20 CO 0.00 -0.60 1.06 0.99 -0.49 0.00 0.00 175.26 176.21 1ysp s THR 21 N -2.72 4.58 -0.11 3.63 2.01 -1.26 -4.27 115.64 117.50 1ysp s THR 21 Ca 0.55 1.86 0.02 0.00 0.31 0.00 0.00 61.69 64.43 1ysp s THR 21 Cb -0.10 -4.19 -0.01 0.00 0.01 0.00 0.00 72.50 68.21 1ysp s THR 21 CO 0.39 0.13 -0.19 -0.63 -0.69 0.00 0.00 174.62 173.63 1ysp s ILE 22 N 1.10 2.49 0.15 1.82 -1.09 -0.07 -1.58 121.20 124.02 1ysp s ILE 22 Ca 0.54 -0.87 0.11 0.00 -2.23 0.00 0.00 60.65 58.20 1ysp s ILE 22 Cb -0.24 -1.99 -0.04 0.00 -1.58 0.00 0.00 42.46 38.61 1ysp s ILE 22 CO 0.28 0.55 -0.26 -1.00 -1.23 0.00 0.00 174.94 173.28 1ysp s HIS 23 N 0.31 2.32 -0.11 3.97 3.76 -0.77 -0.62 115.29 124.15 1ysp s HIS 23 Ca -0.15 -0.37 0.02 0.00 -0.15 0.00 0.00 55.06 54.42 1ysp s HIS 23 Cb -0.17 -1.23 0.01 0.00 1.11 0.00 0.00 32.58 32.31 1ysp s HIS 23 CO 0.07 0.38 -0.17 -1.17 -0.85 0.00 0.00 174.74 173.01 1ysp s LEU 24 N -2.22 1.82 0.13 0.89 2.96 -0.49 -0.87 118.68 120.89 1ysp s LEU 24 Ca 0.16 -0.47 0.08 0.00 -0.22 0.00 0.00 54.13 53.68 1ysp s LEU 24 Cb -0.09 -1.17 -0.04 0.00 0.50 0.00 0.00 46.19 45.39 1ysp s LEU 24 CO 0.07 0.04 -0.18 -0.83 -1.32 0.00 0.00 176.35 174.13 1ysp s GLY 25 N 0.89 1.26 0.16 7.98 0.00 -0.39 -0.46 107.32 116.76 1ysp s GLY 25 Ca -0.08 -1.35 0.01 0.00 0.00 0.00 0.00 44.72 43.30 1ysp s GLY 25 CO -0.01 -1.38 0.02 0.00 0.00 0.00 0.00 173.10 171.73 1ysp s ALA 26 N -1.71 1.21 0.02 3.20 0.00 0.05 -1.68 121.76 122.85 1ysp s ALA 26 Ca 0.10 -1.56 -0.30 0.00 0.00 0.00 0.00 51.96 50.20 1ysp s ALA 26 Cb -0.07 0.66 -0.04 0.00 0.00 0.00 0.00 23.12 23.67 1ysp s ALA 26 CO 0.05 -0.38 1.10 -1.17 0.00 0.00 0.00 175.76 175.37 1ysp s LEU 27 N -3.14 4.35 -0.50 0.00 2.96 -1.26 -0.12 118.68 120.97 1ysp s LEU 27 Ca 0.24 1.83 0.03 0.00 -0.22 0.00 0.00 54.13 56.01 1ysp s LEU 27 Cb 0.07 -3.57 0.15 0.00 0.50 0.00 0.00 46.19 43.33 1ysp s LEU 27 CO 0.04 -0.40 0.31 -0.62 -1.32 0.00 0.00 176.35 174.36 1ysp s ASP 28 N 1.09 3.72 0.00 3.68 2.15 0.02 -4.85 116.67 122.48 1ysp s ASP 28 Ca 0.55 -3.00 0.00 0.00 0.43 0.00 0.00 52.55 50.53 1ysp s ASP 28 Cb -0.25 -1.18 0.00 0.00 -0.30 0.00 0.00 42.92 41.19 1ysp s ASP 28 CO 0.27 -0.21 0.00 -0.62 -0.17 0.00 0.00 175.17 174.44 1ysp n GLU 29 N 3.05 0.00 -1.11 4.34 1.02 -1.26 -2.30 120.64 124.38 1ysp n GLU 29 Ca 0.13 0.00 0.04 0.00 -0.02 0.00 0.00 57.16 57.32 1ysp n GLU 29 Cb 0.36 0.00 0.08 0.00 -0.02 0.00 0.00 31.44 31.85 1ysp n GLU 29 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 1ysp n ASP 30 N 3.69 1.16 -3.99 1.62 5.75 -1.26 -4.93 116.55 118.60 1ysp n ASP 30 Ca 0.00 -2.57 -0.09 0.00 -0.01 0.00 0.00 54.79 52.12 1ysp n ASP 30 Cb 0.00 -0.36 -0.05 0.00 -1.03 0.00 0.00 41.12 39.68 1ysp n ASP 30 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 1ysp s SER 31 N -2.29 -0.10 0.16 -1.12 1.04 -0.97 -4.41 113.70 106.01 1ysp s SER 31 Ca 0.32 -0.90 -0.03 0.00 0.48 0.00 0.00 55.95 55.82 1ysp s SER 31 Cb 0.35 0.59 -0.05 0.00 0.10 0.00 0.00 66.02 67.01 1ysp s SER 31 CO -0.12 -1.14 0.38 0.27 0.98 0.00 0.00 173.24 173.60 1ysp s ILE 32 N -4.01 5.19 -0.09 -1.02 -4.36 0.08 -0.80 121.20 116.20 1ysp s ILE 32 Ca 0.22 -0.14 0.03 0.00 -0.26 0.00 0.00 60.65 60.50 1ysp s ILE 32 Cb -0.01 -3.67 0.01 0.00 1.25 0.00 0.00 42.46 40.04 1ysp s ILE 32 CO 0.08 -0.04 -0.18 0.54 0.24 0.00 0.00 174.94 175.58 1ysp s VAL 33 N -1.74 1.62 -0.28 8.37 0.11 0.83 -1.97 120.40 127.34 1ysp s VAL 33 Ca 0.40 -0.76 -0.29 0.00 -2.93 0.00 0.00 61.98 58.40 1ysp s VAL 33 Cb -0.12 -1.43 0.00 0.00 -1.53 0.00 0.00 36.38 33.30 1ysp s VAL 33 CO 0.27 0.46 1.27 -0.31 -3.33 0.00 0.00 175.10 173.46 1ysp s TYR 34 N 0.53 2.75 -0.12 1.54 2.02 -0.29 -0.77 117.35 123.00 1ysp s TYR 34 Ca -0.16 0.92 0.19 0.00 -0.37 0.00 0.00 57.07 57.65 1ysp s TYR 34 Cb -0.17 -3.83 -0.21 0.00 -0.40 0.00 0.00 41.96 37.35 1ysp s TYR 34 CO 0.06 -1.61 0.56 0.44 -1.57 0.00 0.00 175.55 173.43 1ysp n ILE 35 N 6.07 0.80 -3.95 2.71 -5.35 0.39 0.54 119.36 120.57 1ysp n ILE 35 Ca 0.14 -0.66 -0.09 0.00 -0.27 0.00 0.00 62.75 61.88 1ysp n ILE 35 Cb 0.46 -0.40 -0.09 0.00 -1.74 0.00 0.00 39.64 37.87 1ysp n ILE 35 CO 0.00 0.00 0.00 -2.28 -1.76 0.00 0.00 176.55 172.51 1ysp s HIS 36 N -3.05 0.25 -0.10 4.28 5.04 -1.06 -3.06 115.29 117.60 1ysp s HIS 36 Ca -0.06 -0.61 -0.13 0.00 -1.54 0.00 0.00 55.06 52.72 1ysp s HIS 36 Cb 0.10 -0.18 0.03 0.00 0.04 0.00 0.00 32.58 32.57 1ysp s HIS 36 CO 0.84 -0.38 0.33 0.21 -2.34 0.00 0.00 174.74 173.41 1ysp s LYS 37 N -2.89 0.47 -0.19 2.88 2.20 -1.26 -1.40 119.74 119.54 1ysp s LYS 37 Ca -0.03 0.31 0.01 0.00 -0.36 0.00 0.00 55.97 55.90 1ysp s LYS 37 Cb 0.01 0.22 0.03 0.00 -1.51 0.00 0.00 37.83 36.58 1ysp s LYS 37 CO -0.06 -0.08 -0.14 0.42 -0.36 0.00 0.00 175.35 175.13 1ysp s ILE 38 N -0.20 1.80 0.48 5.43 -1.09 0.21 -5.01 121.20 122.82 1ysp s ILE 38 Ca -0.03 -0.96 -0.19 0.00 -2.23 0.00 0.00 60.65 57.23 1ysp s ILE 38 Cb -0.03 -1.76 -0.09 0.00 -1.58 0.00 0.00 42.46 39.01 1ysp s ILE 38 CO 0.01 0.32 1.00 -1.81 -1.23 0.00 0.00 174.94 173.24 1ysp s ASP 39 N 1.36 6.51 0.05 3.58 1.11 -1.26 -0.89 116.67 127.12 1ysp s ASP 39 Ca 0.01 1.79 -0.33 0.00 0.18 0.00 0.00 52.55 54.20 1ysp s ASP 39 Cb -0.15 -2.54 -0.18 0.00 1.07 0.00 0.00 42.92 41.12 1ysp s ASP 39 CO -0.10 -0.66 1.48 -1.28 1.18 0.00 0.00 175.17 175.79 1ysp h SER 40 N 1.45 -1.00 -0.39 0.27 0.87 -1.84 -3.45 113.55 109.46 1ysp h SER 40 Ca -0.49 0.03 -0.25 0.00 -1.23 0.00 0.00 61.79 59.86 1ysp h SER 40 Cb 1.20 0.26 -0.30 0.00 -0.44 0.00 0.00 62.40 63.12 1ysp h SER 40 CO 0.60 -0.71 -0.80 1.15 -0.53 0.00 0.00 176.83 176.53 1ysp n MET 41 N -5.19 1.41 0.00 2.24 -0.00 -1.26 -4.90 117.12 109.41 1ysp n MET 41 Ca -0.15 -2.60 0.00 0.00 -0.00 0.00 0.00 57.70 54.96 1ysp n MET 41 Cb 0.47 -0.75 0.00 0.00 -0.00 0.00 0.00 33.22 32.93 1ysp n MET 41 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 175.97 175.08 1ysp n ILE 50 N -0.70 0.00 -0.13 3.17 -0.00 -0.92 -5.20 119.36 115.58 1ysp n ILE 50 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 62.75 62.75 1ysp n ILE 50 Cb 0.83 0.00 0.00 0.00 -0.00 0.00 0.00 39.64 40.47 1ysp n ILE 50 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 1ysp n GLY 51 N 0.00 2.42 3.76 7.39 0.00 0.19 -4.95 105.19 113.98 1ysp n GLY 51 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 1ysp n GLY 51 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ysp s ARG 52 N -0.11 3.35 -0.05 1.61 0.52 -1.26 -4.76 118.95 118.25 1ysp s ARG 52 Ca 0.00 2.26 0.06 0.00 -0.52 0.00 0.00 55.73 57.53 1ysp s ARG 52 Cb 0.00 -2.39 -0.01 0.00 0.52 0.00 0.00 34.95 33.07 1ysp s ARG 52 CO 0.00 -1.03 -0.23 0.50 0.02 0.00 0.00 175.30 174.56 1ysp s ARG 53 N -2.75 2.31 0.06 3.54 3.52 -1.26 -1.14 118.95 123.22 1ysp s ARG 53 Ca 0.68 -0.83 -0.06 0.00 -0.13 0.00 0.00 55.73 55.39 1ysp s ARG 53 Cb -0.41 -1.99 -0.01 0.00 -1.56 0.00 0.00 34.95 30.98 1ysp s ARG 53 CO 0.49 0.36 0.10 -0.80 -0.81 0.00 0.00 175.30 174.65 1ysp s ASN 54 N -0.16 0.24 0.65 -2.12 0.02 -0.83 -4.97 114.94 107.76 1ysp s ASN 54 Ca -0.02 -0.71 -0.18 0.00 -1.02 0.00 0.00 52.86 50.93 1ysp s ASN 54 Cb -0.13 0.27 -0.01 0.00 0.02 0.00 0.00 41.25 41.40 1ysp s ASN 54 CO 0.03 -0.63 1.26 -2.84 0.02 0.00 0.00 177.10 174.94 1ysp s PRO 55 N -3.52 2.58 0.26 -0.60 0.02 -1.26 -0.74 135.00 131.74 1ysp s PRO 55 Ca 0.03 1.96 0.09 0.00 0.02 0.00 0.00 61.00 63.10 1ysp s PRO 55 Cb 0.04 -1.86 0.30 0.00 0.02 0.00 0.00 34.50 33.00 1ysp s PRO 55 CO -0.09 -1.55 1.58 -0.07 -0.33 0.00 0.00 177.00 176.55 1ysp h LEU 56 N 0.49 0.06 0.00 -5.54 3.38 -1.90 -3.30 115.31 108.49 1ysp h LEU 56 Ca -0.50 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.43 1ysp h LEU 56 Cb 1.32 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 42.05 1ysp h LEU 56 CO 0.53 0.68 -0.62 0.00 0.09 0.00 0.00 178.44 179.12 1ysp n TYR 57 N -3.80 0.22 0.04 1.13 0.18 -1.26 -3.12 117.16 110.56 1ysp n TYR 57 Ca -0.01 0.06 0.01 0.00 1.88 0.00 0.00 57.90 59.84 1ysp n TYR 57 Cb 0.63 -0.41 0.01 0.00 -0.38 0.00 0.00 39.34 39.20 1ysp n TYR 57 CO 0.00 0.00 0.00 -1.13 -2.08 0.00 0.00 176.86 173.65 1ysp n SER 58 N -1.77 1.46 -4.61 9.48 3.41 -1.26 -4.57 113.62 115.76 1ysp n SER 58 Ca 0.04 -1.36 -0.31 0.00 -0.26 0.00 0.00 58.87 56.98 1ysp n SER 58 Cb 0.38 -0.01 -0.10 0.00 -0.26 0.00 0.00 64.21 64.23 1ysp n SER 58 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1ysp s THR 59 N -0.41 3.65 0.20 6.66 -4.23 -1.24 -4.03 115.64 116.23 1ysp s THR 59 Ca 0.03 -0.93 -0.08 0.00 -1.18 0.00 0.00 61.69 59.52 1ysp s THR 59 Cb 0.02 -2.64 0.11 0.00 1.34 0.00 0.00 72.50 71.32 1ysp s THR 59 CO 0.02 0.27 1.70 0.00 -0.54 0.00 0.00 174.62 176.08 1ysp h ALA 60 N 4.10 0.92 -0.49 3.99 0.00 -1.87 -2.41 119.26 123.50 1ysp h ALA 60 Ca -0.48 -0.27 -0.08 0.00 0.00 0.00 0.00 54.91 54.08 1ysp h ALA 60 Cb 1.17 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.68 1ysp h ALA 60 CO 0.54 0.67 -0.02 0.82 0.00 0.00 0.00 179.25 181.27 1ysp h ILE 61 N 1.06 1.26 -0.38 0.00 2.04 -1.92 -2.37 117.51 117.20 1ysp h ILE 61 Ca 0.21 -1.10 0.05 0.00 1.00 0.00 0.00 64.86 65.02 1ysp h ILE 61 Cb 0.42 0.99 -0.05 0.00 -0.74 0.00 0.00 36.82 37.45 1ysp h ILE 61 CO 0.01 0.39 0.10 1.23 0.00 0.00 0.00 178.15 179.88 1ysp h GLY 62 N 0.74 0.47 0.82 5.37 0.00 -1.72 -0.60 103.07 108.15 1ysp h GLY 62 Ca 0.14 -0.05 0.04 0.00 0.00 0.00 0.00 47.33 47.46 1ysp h GLY 62 CO 0.03 -0.01 0.47 0.50 0.00 0.00 0.00 176.54 177.54 1ysp h LYS 63 N 0.24 0.88 0.00 4.80 1.57 -1.21 -2.53 116.57 120.32 1ysp h LYS 63 Ca 0.18 -0.05 -0.08 0.00 -1.87 0.00 0.00 60.65 58.83 1ysp h LYS 63 Cb 0.19 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.29 1ysp h LYS 63 CO -0.22 0.58 -0.37 -0.39 -0.57 0.00 0.00 179.45 178.49 1ysp h VAL 64 N 0.91 0.76 0.00 0.50 -1.51 -0.99 -0.31 116.25 115.61 1ysp h VAL 64 Ca 0.31 -1.65 -0.03 0.00 -1.23 0.00 0.00 66.70 64.11 1ysp h VAL 64 Cb 0.06 2.06 -0.00 0.00 -2.13 0.00 0.00 31.29 31.28 1ysp h VAL 64 CO -0.13 0.36 -0.12 -0.07 -1.23 0.00 0.00 177.57 176.38 1ysp h LEU 65 N 0.00 0.00 0.01 4.19 3.38 -0.72 -3.27 115.31 118.89 1ysp h LEU 65 Ca -0.00 0.00 -0.36 0.00 0.09 0.00 0.00 57.88 57.61 1ysp h LEU 65 Cb 1.03 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.72 1ysp h LEU 65 CO 0.05 0.12 -2.27 0.18 0.09 0.00 0.00 178.44 176.61 1ysp n LEU 66 N -3.25 0.87 0.12 1.67 4.77 -0.99 -4.72 117.00 115.48 1ysp n LEU 66 Ca 0.01 0.05 0.05 0.00 -0.03 0.00 0.00 56.01 56.09 1ysp n LEU 66 Cb 0.39 0.08 0.49 0.00 -2.33 0.00 0.00 43.42 42.05 1ysp n LEU 66 CO 0.31 0.59 1.05 0.00 -1.33 0.00 0.00 177.39 178.01 1ysp h ALA 67 N 0.75 1.75 -0.18 -1.18 0.00 -1.10 -2.22 119.26 117.08 1ysp h ALA 67 Ca -0.50 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.34 1ysp h ALA 67 Cb 2.13 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.84 1ysp h ALA 67 CO 0.02 0.20 0.00 0.91 0.00 0.00 0.00 179.25 180.38 1ysp n TRP 68 N -4.44 0.22 -2.52 0.00 8.01 -1.26 -4.70 117.44 112.75 1ysp n TRP 68 Ca -0.00 -0.11 -0.30 0.00 -1.31 0.00 0.00 57.50 55.78 1ysp n TRP 68 Cb 0.13 0.00 -0.02 0.00 -2.01 0.00 0.00 31.31 29.41 1ysp n TRP 68 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.69 177.71 1ysp s ARG 69 N -1.78 3.72 0.09 -0.99 0.52 -0.84 -4.99 118.95 114.68 1ysp s ARG 69 Ca 0.34 0.55 -0.34 0.00 -0.52 0.00 0.00 55.73 55.76 1ysp s ARG 69 Cb 0.20 -2.28 -0.14 0.00 0.52 0.00 0.00 34.95 33.26 1ysp s ARG 69 CO 0.30 -0.23 1.62 -3.47 0.02 0.00 0.00 175.30 173.54 1ysp n ASP 70 N -1.87 2.98 0.05 0.23 2.03 -1.26 -4.83 116.55 113.88 1ysp n ASP 70 Ca 0.03 1.06 0.07 0.00 0.52 0.00 0.00 54.79 56.48 1ysp n ASP 70 Cb 0.54 -1.38 0.31 0.00 -0.72 0.00 0.00 41.12 39.87 1ysp n ASP 70 CO 0.00 0.00 0.00 -1.14 -1.92 0.00 0.00 177.20 174.14 1ysp n ARG 71 N 4.02 0.06 0.04 -0.67 3.00 -1.26 -1.10 116.66 120.74 1ysp n ARG 71 Ca 0.19 0.40 -0.22 0.00 -0.00 0.00 0.00 57.85 58.22 1ysp n ARG 71 Cb 0.27 -1.64 -0.14 0.00 0.00 0.00 0.00 32.46 30.95 1ysp n ARG 71 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.63 177.19 1ysp h ASP 72 N 0.00 0.50 -0.73 6.15 3.32 -1.99 -2.54 116.42 121.12 1ysp h ASP 72 Ca 0.00 -0.91 0.11 0.00 0.02 0.00 0.00 57.03 56.24 1ysp h ASP 72 Cb 0.18 -0.16 -0.08 0.00 0.22 0.00 0.00 39.33 39.49 1ysp h ASP 72 CO 0.00 1.76 0.36 -0.33 -1.72 0.00 0.00 179.24 179.31 1ysp h GLU 73 N -0.02 0.56 0.65 3.56 5.08 -1.76 -1.37 114.58 121.27 1ysp h GLU 73 Ca -0.35 -0.03 -0.03 0.00 -1.00 0.00 0.00 59.36 57.95 1ysp h GLU 73 Cb 1.99 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 31.10 1ysp h GLU 73 CO 0.12 0.37 -0.44 0.28 -1.00 0.00 0.00 179.01 178.35 1ysp h VAL 74 N 0.58 0.12 -0.56 3.13 2.07 -1.19 0.93 116.25 121.33 1ysp h VAL 74 Ca 0.37 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.93 1ysp h VAL 74 Cb 0.44 0.12 -0.03 0.00 -1.52 0.00 0.00 31.29 30.30 1ysp h VAL 74 CO -0.30 0.00 0.37 0.11 0.02 0.00 0.00 177.57 177.77 1ysp h LYS 75 N -1.03 0.61 0.49 1.57 1.57 -1.39 -0.50 116.57 117.89 1ysp h LYS 75 Ca -0.08 -0.04 -0.02 0.00 -1.87 0.00 0.00 60.65 58.64 1ysp h LYS 75 Cb 0.85 -0.14 -0.00 0.00 0.08 0.00 0.00 32.23 33.02 1ysp h LYS 75 CO 0.06 0.41 -0.28 0.37 -0.57 0.00 0.00 179.45 179.44 1ysp h GLN 76 N 0.63 -0.69 -0.60 3.15 4.15 -0.98 -1.71 115.11 119.06 1ysp h GLN 76 Ca 0.23 0.05 0.10 0.00 0.77 0.00 0.00 58.65 59.80 1ysp h GLN 76 Cb 0.12 0.16 -0.08 0.00 0.21 0.00 0.00 27.48 27.89 1ysp h GLN 76 CO -0.06 -0.46 0.18 0.82 -1.93 0.00 0.00 178.83 177.37 1ysp h ILE 77 N -0.72 0.70 0.00 2.39 2.04 -0.13 -2.62 117.51 119.18 1ysp h ILE 77 Ca -0.06 -0.11 0.00 0.00 1.00 0.00 0.00 64.86 65.69 1ysp h ILE 77 Cb 0.58 0.34 0.00 0.00 -0.74 0.00 0.00 36.82 37.00 1ysp h ILE 77 CO 0.08 0.06 0.00 0.18 0.00 0.00 0.00 178.15 178.47 1ysp n LEU 78 N -5.06 0.00 -0.28 1.44 4.77 -0.26 -3.95 117.00 113.66 1ysp n LEU 78 Ca 0.09 0.41 0.06 0.00 -0.03 0.00 0.00 56.01 56.54 1ysp n LEU 78 Cb 0.30 -0.41 0.21 0.00 -2.33 0.00 0.00 43.42 41.19 1ysp n LEU 78 CO 0.20 -0.01 1.07 -0.33 -1.33 0.00 0.00 177.39 176.99 1ysp h GLU 79 N 0.00 0.55 0.00 3.23 4.39 -0.91 -2.34 114.58 119.50 1ysp h GLU 79 Ca 0.00 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.67 1ysp h GLU 79 Cb 0.40 -0.13 0.00 0.00 -0.10 0.00 0.00 28.75 28.92 1ysp h GLU 79 CO 0.00 0.37 0.00 0.78 -1.16 0.00 0.00 179.01 179.00 1ysp h GLY 80 N 0.57 0.00 -4.52 -3.84 0.00 -1.78 -3.47 103.07 90.04 1ysp h GLY 80 Ca 0.44 0.00 -0.53 0.00 0.00 0.00 0.00 47.33 47.24 1ysp h GLY 80 CO -0.36 0.00 0.85 0.14 0.00 0.00 0.00 176.54 177.16 1ysp s VAL 81 N -3.19 2.66 -0.47 4.60 1.01 -0.88 -4.99 120.40 119.13 1ysp s VAL 81 Ca 0.08 0.49 -0.17 0.00 0.00 0.00 0.00 61.98 62.37 1ysp s VAL 81 Cb 0.07 -3.31 0.05 0.00 0.00 0.00 0.00 36.38 33.19 1ysp s VAL 81 CO 0.64 0.05 0.50 -0.70 0.00 0.00 0.00 175.10 175.59 1ysp s GLU 82 N 0.80 3.07 0.29 2.72 2.12 -1.26 -5.07 118.70 121.37 1ysp s GLU 82 Ca 0.67 -0.97 -0.29 0.00 0.36 0.00 0.00 54.97 54.74 1ysp s GLU 82 Cb -0.43 -4.06 -0.10 0.00 0.26 0.00 0.00 34.13 29.80 1ysp s GLU 82 CO 0.34 -1.04 1.27 0.71 -0.54 0.00 0.00 175.26 175.99 1ysp s TYR 83 N 2.19 3.22 -0.05 5.30 2.02 -1.26 -5.03 117.35 123.73 1ysp s TYR 83 Ca 0.11 1.42 0.03 0.00 -0.37 0.00 0.00 57.07 58.26 1ysp s TYR 83 Cb -0.20 -3.58 0.00 0.00 -0.40 0.00 0.00 41.96 37.79 1ysp s TYR 83 CO 0.11 -1.60 -0.15 0.15 -1.57 0.00 0.00 175.55 172.49 1ysp s LYS 84 N -1.26 1.78 -0.63 -0.62 1.02 -1.26 -5.08 119.74 113.69 1ysp s LYS 84 Ca 0.50 -0.54 -0.25 0.00 0.02 0.00 0.00 55.97 55.71 1ysp s LYS 84 Cb -0.37 -1.50 0.05 0.00 -0.52 0.00 0.00 37.83 35.48 1ysp s LYS 84 CO 0.46 0.15 1.04 0.50 -0.92 0.00 0.00 175.35 176.59 1ysp s ARG 85 N 0.28 3.24 0.01 1.68 3.52 -1.26 -4.86 118.95 121.56 1ysp s ARG 85 Ca -0.09 -0.41 -0.18 0.00 -0.13 0.00 0.00 55.73 54.93 1ysp s ARG 85 Cb -0.13 -4.14 -0.34 0.00 -1.56 0.00 0.00 34.95 28.78 1ysp s ARG 85 CO 0.03 -1.76 0.97 0.77 -0.81 0.00 0.00 175.30 174.51 1ysp h SER 86 N 9.57 0.73 -5.76 -2.12 0.02 -1.90 -3.48 113.55 110.62 1ysp h SER 86 Ca -0.27 -0.92 -0.36 0.00 -0.84 0.00 0.00 61.79 59.39 1ysp h SER 86 Cb 1.07 -0.24 -0.14 0.00 0.14 0.00 0.00 62.40 63.23 1ysp h SER 86 CO 1.17 1.60 -0.54 0.42 -1.14 0.00 0.00 176.83 178.34 1ysp s THR 87 N -2.57 0.00 0.41 -2.27 -4.23 -1.26 -4.94 115.64 100.78 1ysp s THR 87 Ca -0.11 -1.99 0.17 0.00 -1.18 0.00 0.00 61.69 58.59 1ysp s THR 87 Cb 0.03 -2.50 0.38 0.00 1.34 0.00 0.00 72.50 71.75 1ysp s THR 87 CO 0.91 0.00 1.85 -0.08 -0.54 0.00 0.00 174.62 176.76 1ysp h GLU 88 N 2.35 0.41 -0.01 3.99 4.81 -1.93 -2.65 114.58 121.55 1ysp h GLU 88 Ca -0.30 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.91 1ysp h GLU 88 Cb 1.24 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 30.53 1ysp h GLU 88 CO 0.44 0.27 -0.51 0.54 -0.73 0.00 0.00 179.01 179.02 1ysp n ARG 89 N -4.52 0.62 -1.72 1.92 1.74 -1.26 -4.96 116.66 108.47 1ysp n ARG 89 Ca 0.20 -0.44 -0.43 0.00 -0.77 0.00 0.00 57.85 56.41 1ysp n ARG 89 Cb 0.70 -1.49 -0.02 0.00 -1.02 0.00 0.00 32.46 30.63 1ysp n ARG 89 CO 0.00 0.00 0.00 2.41 -1.52 0.00 0.00 177.63 178.52 1ysp n THR 90 N -0.80 0.96 -2.92 0.55 -1.04 -1.00 -4.81 114.28 105.21 1ysp n THR 90 Ca 0.08 -0.24 -0.41 0.00 -2.04 0.00 0.00 64.05 61.44 1ysp n THR 90 Cb 0.38 -1.83 -0.04 0.00 -1.82 0.00 0.00 70.33 67.01 1ysp n THR 90 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 1ysp s ILE 91 N 0.03 4.91 -0.11 12.58 1.01 -1.26 -4.96 121.20 133.41 1ysp s ILE 91 Ca 0.66 1.58 0.17 0.00 0.00 0.00 0.00 60.65 63.05 1ysp s ILE 91 Cb -0.54 -4.11 0.40 0.00 0.01 0.00 0.00 42.46 38.22 1ysp s ILE 91 CO 0.48 0.06 1.19 0.35 0.00 0.00 0.00 174.94 177.02 1ysp n THR 92 N 4.60 1.20 -3.76 2.92 -2.24 -1.26 -4.81 114.28 110.94 1ysp n THR 92 Ca 0.03 -2.13 -0.10 0.00 -2.27 0.00 0.00 64.05 59.58 1ysp n THR 92 Cb 0.49 0.29 -0.06 0.00 -2.10 0.00 0.00 70.33 68.96 1ysp n THR 92 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1ysp s SER 93 N -2.61 -0.04 0.28 3.42 1.04 -1.26 -4.77 113.70 109.75 1ysp s SER 93 Ca 0.34 -0.50 -0.03 0.00 0.48 0.00 0.00 55.95 56.24 1ysp s SER 93 Cb 0.36 0.40 0.39 0.00 0.10 0.00 0.00 66.02 67.27 1ysp s SER 93 CO -0.10 -0.79 1.89 0.74 0.98 0.00 0.00 173.24 175.96 1ysp h THR 94 N 2.57 1.22 -0.71 2.02 2.02 -1.95 -1.03 112.91 117.05 1ysp h THR 94 Ca -0.34 -0.60 -0.04 0.00 0.77 0.00 0.00 66.41 66.19 1ysp h THR 94 Cb 1.23 0.29 -0.03 0.00 -1.74 0.00 0.00 68.15 67.90 1ysp h THR 94 CO 0.52 0.26 0.27 -0.33 0.37 0.00 0.00 175.52 176.61 1ysp h GLU 95 N 1.01 1.07 0.00 6.66 3.07 -2.02 -1.35 114.58 123.02 1ysp h GLU 95 Ca 0.25 -0.20 -0.09 0.00 -0.50 0.00 0.00 59.36 58.81 1ysp h GLU 95 Cb 0.08 -0.17 -0.01 0.00 -0.84 0.00 0.00 28.75 27.81 1ysp h GLU 95 CO -0.03 0.89 -0.44 0.00 -1.40 0.00 0.00 179.01 178.02 1ysp h ALA 96 N 1.13 1.22 0.08 3.43 0.00 -1.90 -3.34 119.26 119.89 1ysp h ALA 96 Ca 0.23 -0.40 -0.26 0.00 0.00 0.00 0.00 54.91 54.48 1ysp h ALA 96 Cb 0.23 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 17.96 1ysp h ALA 96 CO -0.02 0.56 -1.13 1.25 0.00 0.00 0.00 179.25 179.91 1ysp h LEU 97 N 0.00 0.52 -0.59 0.00 5.85 -0.29 -3.32 115.31 117.49 1ysp h LEU 97 Ca -0.00 -0.49 0.03 0.00 0.84 0.00 0.00 57.88 58.25 1ysp h LEU 97 Cb 0.81 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 41.63 1ysp h LEU 97 CO 0.06 1.34 0.36 -0.07 -0.34 0.00 0.00 178.44 179.78 1ysp h LEU 98 N 0.15 0.58 -1.44 2.25 3.38 -1.40 0.83 115.31 119.67 1ysp h LEU 98 Ca -0.12 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.82 1ysp h LEU 98 Cb 1.82 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 42.43 1ysp h LEU 98 CO 0.19 0.41 0.07 -0.65 0.09 0.00 0.00 178.44 178.55 1ysp h PRO 99 N 0.71 0.44 -0.59 1.13 0.11 -1.75 -1.64 132.00 130.40 1ysp h PRO 99 Ca 0.24 -0.06 -0.05 0.00 0.11 0.00 0.00 66.00 66.23 1ysp h PRO 99 Cb 0.02 -0.08 -0.02 0.00 0.11 0.00 0.00 31.00 31.03 1ysp h PRO 99 CO -0.10 0.41 0.16 0.28 -0.21 0.00 0.00 178.00 178.55 1ysp h VAL 100 N 0.43 1.25 -0.38 3.15 2.07 -1.12 -2.61 116.25 119.03 1ysp h VAL 100 Ca 0.10 -0.86 -0.01 0.00 0.82 0.00 0.00 66.70 66.75 1ysp h VAL 100 Cb 0.18 0.69 -0.02 0.00 -1.52 0.00 0.00 31.29 30.62 1ysp h VAL 100 CO -0.00 0.32 0.19 -0.07 0.02 0.00 0.00 177.57 178.03 1ysp h LEU 101 N 0.84 0.47 -0.20 2.57 3.38 -0.31 0.11 115.31 122.16 1ysp h LEU 101 Ca 0.19 -0.03 0.02 0.00 0.09 0.00 0.00 57.88 58.15 1ysp h LEU 101 Cb 0.32 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.93 1ysp h LEU 101 CO -0.00 0.40 0.05 0.44 0.09 0.00 0.00 178.44 179.42 1ysp h ASP 102 N 0.53 0.04 -0.65 -0.43 3.32 -0.97 -1.25 116.42 117.02 1ysp h ASP 102 Ca 0.14 0.03 -0.07 0.00 0.02 0.00 0.00 57.03 57.14 1ysp h ASP 102 Cb 0.05 0.03 -0.03 0.00 0.22 0.00 0.00 39.33 39.60 1ysp h ASP 102 CO -0.02 0.05 0.12 -0.61 -1.72 0.00 0.00 179.24 177.06 1ysp h GLN 103 N 0.14 1.07 0.04 3.56 5.75 -0.98 -1.13 115.11 123.56 1ysp h GLN 103 Ca 0.09 -0.28 0.02 0.00 -0.15 0.00 0.00 58.65 58.33 1ysp h GLN 103 Cb 0.07 -0.13 -0.02 0.00 1.07 0.00 0.00 27.48 28.47 1ysp h GLN 103 CO -0.11 0.98 -0.13 0.28 -2.65 0.00 0.00 178.83 177.20 1ysp h VAL 104 N 0.99 0.67 -0.46 2.39 2.07 -0.77 0.17 116.25 121.31 1ysp h VAL 104 Ca 0.20 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.77 1ysp h VAL 104 Cb 0.42 0.67 -0.05 0.00 -1.52 0.00 0.00 31.29 30.82 1ysp h VAL 104 CO 0.01 0.00 0.20 -0.09 0.02 0.00 0.00 177.57 177.71 1ysp h ARG 105 N -0.25 0.38 -0.65 1.57 2.43 -1.10 0.05 114.38 116.81 1ysp h ARG 105 Ca 0.03 -0.02 0.02 0.00 -0.81 0.00 0.00 59.98 59.20 1ysp h ARG 105 Cb 0.29 -0.09 -0.04 0.00 -0.42 0.00 0.00 29.97 29.71 1ysp h ARG 105 CO -0.11 0.25 0.41 1.49 -1.51 0.00 0.00 179.97 180.51 1ysp h GLU 106 N 0.40 0.80 0.00 0.20 4.81 -0.82 -3.10 114.58 116.86 1ysp h GLU 106 Ca 0.21 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.39 1ysp h GLU 106 Cb 0.17 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 29.37 1ysp h GLU 106 CO -0.19 0.53 -0.94 0.00 -0.73 0.00 0.00 179.01 177.68 1ysp n GLN 107 N -4.68 0.37 -0.74 1.92 10.64 0.01 -4.98 117.38 119.92 1ysp n GLN 107 Ca 0.06 0.04 0.00 0.00 -1.83 0.00 0.00 57.00 55.27 1ysp n GLN 107 Cb 0.06 -1.66 0.00 0.00 -0.86 0.00 0.00 30.24 27.78 1ysp n GLN 107 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1ysp n GLY 108 N 1.32 0.63 3.33 2.61 0.00 -0.02 -5.04 105.19 108.03 1ysp n GLY 108 Ca 0.02 -0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.92 1ysp n GLY 108 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1ysp s TYR 109 N -2.00 -0.26 0.25 1.61 -0.85 -1.18 -4.58 117.35 110.35 1ysp s TYR 109 Ca 0.00 -0.02 0.11 0.00 -0.52 0.00 0.00 57.07 56.65 1ysp s TYR 109 Cb 0.00 0.30 -0.05 0.00 0.38 0.00 0.00 41.96 42.59 1ysp s TYR 109 CO 0.00 -0.71 -0.20 0.20 -1.52 0.00 0.00 175.55 173.31 1ysp s GLY 110 N -2.73 1.79 0.09 5.49 0.00 0.04 -4.47 107.32 107.53 1ysp s GLY 110 Ca 0.02 -1.79 0.01 0.00 0.00 0.00 0.00 44.72 42.96 1ysp s GLY 110 CO -0.11 -1.87 -0.06 -0.54 0.00 0.00 0.00 173.10 170.52 1ysp s GLU 111 N -3.32 0.79 -0.32 2.90 2.02 -1.26 -0.64 118.70 118.87 1ysp s GLU 111 Ca 0.27 -1.29 0.02 0.00 0.02 0.00 0.00 54.97 53.99 1ysp s GLU 111 Cb -0.05 -0.16 0.10 0.00 0.10 0.00 0.00 34.13 34.11 1ysp s GLU 111 CO 0.13 -0.02 0.05 0.34 0.02 0.00 0.00 175.26 175.77 1ysp s ASP 112 N -2.94 4.45 -0.97 -0.19 2.15 -0.31 -4.19 116.67 114.67 1ysp s ASP 112 Ca 0.10 -1.88 -0.11 0.00 0.43 0.00 0.00 52.55 51.09 1ysp s ASP 112 Cb 0.05 -1.35 0.25 0.00 -0.30 0.00 0.00 42.92 41.57 1ysp s ASP 112 CO -0.05 -0.37 0.93 0.21 -0.17 0.00 0.00 175.17 175.72 1ysp s ASN 113 N 1.18 6.97 -1.64 -0.34 2.47 -1.26 -1.00 114.94 121.32 1ysp s ASN 113 Ca 0.08 -3.19 -0.15 0.00 0.42 0.00 0.00 52.86 50.02 1ysp s ASN 113 Cb -0.18 -2.19 0.12 0.00 -1.45 0.00 0.00 41.25 37.55 1ysp s ASN 113 CO -0.13 -0.41 0.71 -0.62 -3.72 0.00 0.00 177.10 172.94 1ysp n GLU 114 N 3.25 -3.26 0.03 0.43 1.02 -0.75 -4.88 120.64 116.48 1ysp n GLU 114 Ca 0.19 0.38 -0.02 0.00 -0.02 0.00 0.00 57.16 57.69 1ysp n GLU 114 Cb 0.42 -4.98 -0.09 0.00 -0.02 0.00 0.00 31.44 26.77 1ysp n GLU 114 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 1ysp h GLU 115 N -1.60 0.00 0.06 3.49 5.08 -1.81 -3.39 114.58 116.40 1ysp h GLU 115 Ca -0.60 0.00 -0.38 0.00 -1.00 0.00 0.00 59.36 57.38 1ysp h GLU 115 Cb 1.38 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.59 1ysp h GLU 115 CO 0.75 0.38 -2.24 1.04 -1.00 0.00 0.00 179.01 177.93 1ysp n GLN 116 N -2.97 0.70 -3.71 2.33 6.02 -1.26 -4.16 117.38 114.33 1ysp n GLN 116 Ca -0.10 0.21 -0.11 0.00 -0.01 0.00 0.00 57.00 56.99 1ysp n GLN 116 Cb 0.89 -1.61 -0.11 0.00 1.02 0.00 0.00 30.24 30.43 1ysp n GLN 116 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 177.06 174.05 1ysp s GLU 117 N -2.53 0.34 0.31 -1.09 2.12 -1.26 -4.70 118.70 111.89 1ysp s GLU 117 Ca -0.29 0.68 -0.29 0.00 0.36 0.00 0.00 54.97 55.43 1ysp s GLU 117 Cb 0.08 -0.02 -0.13 0.00 0.26 0.00 0.00 34.13 34.32 1ysp s GLU 117 CO 0.67 -0.15 1.26 0.39 -0.54 0.00 0.00 175.26 176.89 1ysp n GLU 118 N 4.07 1.95 -0.94 4.30 4.71 -1.26 -2.01 120.64 131.46 1ysp n GLU 118 Ca -0.23 0.69 0.00 0.00 -0.01 0.00 0.00 57.16 57.61 1ysp n GLU 118 Cb 0.55 -2.24 0.00 0.00 -1.01 0.00 0.00 31.44 28.74 1ysp n GLU 118 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1ysp n GLY 119 N 1.14 0.93 3.31 0.62 0.00 -1.26 -5.01 105.19 104.92 1ysp n GLY 119 Ca 0.07 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.76 1ysp n GLY 119 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1ysp s LEU 120 N 0.00 2.62 0.02 0.99 2.96 -0.85 -4.62 118.68 119.80 1ysp s LEU 120 Ca 0.00 -0.41 0.05 0.00 -0.22 0.00 0.00 54.13 53.56 1ysp s LEU 120 Cb 0.00 -1.60 -0.02 0.00 0.50 0.00 0.00 46.19 45.07 1ysp s LEU 120 CO 0.00 0.10 -0.16 -0.60 -1.32 0.00 0.00 176.35 174.38 1ysp s ARG 121 N 0.71 1.11 0.04 1.98 3.52 -1.26 -1.81 118.95 123.24 1ysp s ARG 121 Ca -0.06 -0.72 0.02 0.00 -0.13 0.00 0.00 55.73 54.84 1ysp s ARG 121 Cb -0.15 -1.13 -0.02 0.00 -1.56 0.00 0.00 34.95 32.09 1ysp s ARG 121 CO 0.02 0.29 -0.08 0.00 -0.81 0.00 0.00 175.30 174.72 1ysp s ILE 123 N -1.31 1.09 0.05 0.00 1.01 -0.27 -1.16 121.20 120.62 1ysp s ILE 123 Ca -0.09 -0.58 -0.04 0.00 0.00 0.00 0.00 60.65 59.94 1ysp s ILE 123 Cb -0.10 -0.92 -0.02 0.00 0.01 0.00 0.00 42.46 41.43 1ysp s ILE 123 CO 0.00 0.31 0.05 0.00 0.00 0.00 0.00 174.94 175.31 1ysp s ALA 124 N -0.22 0.16 0.08 9.38 0.00 0.18 -0.91 121.76 130.44 1ysp s ALA 124 Ca 0.03 -0.86 0.04 0.00 0.00 0.00 0.00 51.96 51.17 1ysp s ALA 124 Cb -0.06 0.31 -0.03 0.00 0.00 0.00 0.00 23.12 23.33 1ysp s ALA 124 CO -0.00 -0.38 -0.11 0.14 0.00 0.00 0.00 175.76 175.41 1ysp s VAL 125 N -3.42 0.92 0.39 0.00 -7.23 -0.33 -0.78 120.40 109.96 1ysp s VAL 125 Ca 0.02 -1.44 -0.25 0.00 -1.81 0.00 0.00 61.98 58.50 1ysp s VAL 125 Cb 0.04 -1.13 -0.09 0.00 0.56 0.00 0.00 36.38 35.76 1ysp s VAL 125 CO -0.08 -0.43 1.10 -2.16 -0.31 0.00 0.00 175.10 173.22 1ysp s PRO 126 N -2.26 4.13 -0.14 4.82 0.04 -1.26 -1.34 135.00 138.99 1ysp s PRO 126 Ca 0.00 1.67 0.01 0.00 0.04 0.00 0.00 61.00 62.72 1ysp s PRO 126 Cb -0.06 -2.64 -0.01 0.00 0.04 0.00 0.00 34.50 31.84 1ysp s PRO 126 CO 0.01 -0.21 -0.15 0.08 0.04 0.00 0.00 177.00 176.77 1ysp s VAL 127 N -1.52 2.74 0.03 -0.36 1.01 -0.23 -4.86 120.40 117.21 1ysp s VAL 127 Ca 0.57 -0.76 0.01 0.00 0.00 0.00 0.00 61.98 61.80 1ysp s VAL 127 Cb -0.26 -2.14 -0.04 0.00 0.00 0.00 0.00 36.38 33.93 1ysp s VAL 127 CO 0.33 0.52 0.09 -0.36 0.00 0.00 0.00 175.10 175.68 1ysp s PHE 128 N 0.59 3.27 0.54 5.22 0.08 -1.26 -0.69 117.98 125.73 1ysp s PHE 128 Ca -0.09 0.17 -0.05 0.00 0.12 0.00 0.00 56.93 57.07 1ysp s PHE 128 Cb -0.16 -1.70 0.12 0.00 -0.57 0.00 0.00 43.02 40.71 1ysp s PHE 128 CO 0.03 0.54 0.73 -0.40 -0.10 0.00 0.00 175.22 176.03 1ysp n ASP 129 N 0.87 0.43 0.16 1.36 5.75 -0.03 -4.51 116.55 120.58 1ysp n ASP 129 Ca -0.11 -1.50 0.12 0.00 -0.01 0.00 0.00 54.79 53.29 1ysp n ASP 129 Cb 0.52 -0.52 0.58 0.00 -1.03 0.00 0.00 41.12 40.67 1ysp n ASP 129 CO 0.00 0.00 0.00 -2.11 -0.11 0.00 0.00 177.20 174.98 1ysp n ARG 130 N -2.47 0.16 -0.09 0.11 1.85 -1.26 -1.57 116.66 113.40 1ysp n ARG 130 Ca 0.10 0.59 0.11 0.00 -1.00 0.00 0.00 57.85 57.65 1ysp n ARG 130 Cb 0.36 -1.95 0.14 0.00 -1.05 0.00 0.00 32.46 29.96 1ysp n ARG 130 CO 0.00 0.00 0.00 1.19 -0.01 0.00 0.00 177.63 178.81 1ysp n PHE 131 N -2.28 0.22 -0.74 2.89 3.72 -1.26 -4.64 117.46 115.37 1ysp n PHE 131 Ca -0.01 -0.12 0.00 0.00 -0.05 0.00 0.00 57.45 57.27 1ysp n PHE 131 Cb 0.09 -0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.63 1ysp n PHE 131 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1ysp n GLY 132 N 1.30 0.61 3.77 1.37 0.00 -0.61 -5.05 105.19 106.58 1ysp n GLY 132 Ca 0.15 -0.16 -0.39 0.00 0.00 0.00 0.00 46.02 45.62 1ysp n GLY 132 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ysp s VAL 133 N -2.00 4.87 -0.26 1.61 1.01 -1.26 -4.86 120.40 119.51 1ysp s VAL 133 Ca 0.00 1.23 -0.29 0.00 0.00 0.00 0.00 61.98 62.92 1ysp s VAL 133 Cb 0.00 -3.92 -0.02 0.00 0.00 0.00 0.00 36.38 32.44 1ysp s VAL 133 CO 0.00 0.45 1.68 -0.69 0.00 0.00 0.00 175.10 176.54 1ysp s VAL 134 N -0.40 3.61 -0.33 2.92 1.01 -1.26 -0.85 120.40 125.09 1ysp s VAL 134 Ca 0.30 0.67 0.20 0.00 0.00 0.00 0.00 61.98 63.16 1ysp s VAL 134 Cb -0.18 -3.69 -0.29 0.00 0.00 0.00 0.00 36.38 32.22 1ysp s VAL 134 CO 0.17 -0.35 0.59 2.30 0.00 0.00 0.00 175.10 177.81 1ysp n ILE 135 N 6.78 0.00 -3.76 2.22 -5.35 0.14 -4.94 119.36 114.44 1ysp n ILE 135 Ca 0.20 -0.32 -0.09 0.00 -0.27 0.00 0.00 62.75 62.26 1ysp n ILE 135 Cb 0.46 0.35 -0.04 0.00 -1.74 0.00 0.00 39.64 38.67 1ysp n ILE 135 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1ysp s ALA 136 N -3.26 -0.93 0.05 -1.28 0.00 -1.16 -4.58 121.76 110.60 1ysp s ALA 136 Ca -0.03 -0.26 0.08 0.00 0.00 0.00 0.00 51.96 51.75 1ysp s ALA 136 Cb 0.14 0.87 -0.03 0.00 0.00 0.00 0.00 23.12 24.10 1ysp s ALA 136 CO 0.85 -0.83 -0.20 0.20 0.00 0.00 0.00 175.76 175.78 1ysp s GLY 137 N -2.89 1.55 -0.18 0.00 0.00 -0.67 -1.07 107.32 104.06 1ysp s GLY 137 Ca 0.10 -1.22 -0.01 0.00 0.00 0.00 0.00 44.72 43.59 1ysp s GLY 137 CO -0.01 -1.12 -0.14 -2.27 0.00 0.00 0.00 173.10 169.56 1ysp s LEU 138 N -1.45 2.48 0.18 0.66 2.96 -0.45 -1.26 118.68 121.81 1ysp s LEU 138 Ca 0.14 -0.50 0.06 0.00 -0.22 0.00 0.00 54.13 53.61 1ysp s LEU 138 Cb -0.10 -1.58 -0.05 0.00 0.50 0.00 0.00 46.19 44.96 1ysp s LEU 138 CO 0.05 0.03 -0.12 -0.94 -1.32 0.00 0.00 176.35 174.05 1ysp s SER 139 N 1.13 2.27 -0.02 3.68 1.04 -0.05 -1.18 113.70 120.56 1ysp s SER 139 Ca 0.01 -1.02 0.02 0.00 0.48 0.00 0.00 55.95 55.43 1ysp s SER 139 Cb -0.14 -0.09 0.00 0.00 0.10 0.00 0.00 66.02 65.89 1ysp s SER 139 CO -0.05 -0.24 -0.06 -0.51 0.98 0.00 0.00 173.24 173.36 1ysp s ILE 140 N -3.12 0.51 0.76 -1.02 2.07 -0.09 -1.84 121.20 118.47 1ysp s ILE 140 Ca 0.21 -0.22 -0.12 0.00 -1.41 0.00 0.00 60.65 59.11 1ysp s ILE 140 Cb 0.01 -0.47 0.05 0.00 0.13 0.00 0.00 42.46 42.18 1ysp s ILE 140 CO 0.05 0.17 1.10 -0.94 -1.91 0.00 0.00 174.94 173.41 1ysp s SER 141 N 0.20 4.52 -0.11 4.50 1.04 -0.61 -1.12 113.70 122.12 1ysp s SER 141 Ca -0.02 1.91 -0.05 0.00 0.48 0.00 0.00 55.95 58.26 1ysp s SER 141 Cb -0.07 -2.53 0.05 0.00 0.10 0.00 0.00 66.02 63.57 1ysp s SER 141 CO -0.00 -2.03 0.26 0.12 0.98 0.00 0.00 173.24 172.57 1ysp s PHE 142 N -2.73 -0.37 -0.13 5.02 5.36 -0.96 -4.80 117.98 119.38 1ysp s PHE 142 Ca 0.63 0.85 -0.29 0.00 -0.96 0.00 0.00 56.93 57.16 1ysp s PHE 142 Cb -0.19 0.05 -0.04 0.00 -0.34 0.00 0.00 43.02 42.51 1ysp s PHE 142 CO 0.52 -0.26 1.53 -1.25 -1.46 0.00 0.00 175.22 174.30 1ysp s PRO 143 N 1.47 4.09 0.00 10.12 0.04 -1.26 -3.99 135.00 145.46 1ysp s PRO 143 Ca -0.08 1.89 0.00 0.00 0.04 0.00 0.00 61.00 62.85 1ysp s PRO 143 Cb -0.11 -3.94 0.00 0.00 0.04 0.00 0.00 34.50 30.50 1ysp s PRO 143 CO -0.09 -0.93 0.38 -2.37 0.04 0.00 0.00 177.00 174.03 1ysp n THR 144 N 5.71 0.00 0.22 1.26 5.66 -1.26 -2.43 114.28 123.44 1ysp n THR 144 Ca 0.17 0.84 0.00 0.00 -3.05 0.00 0.00 64.05 62.00 1ysp n THR 144 Cb 0.44 -1.75 0.00 0.00 -1.55 0.00 0.00 70.33 67.47 1ysp n THR 144 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 175.07 172.20 1ysp n LEU 145 N -1.79 0.00 -4.17 1.09 4.77 -1.26 -3.11 117.00 112.53 1ysp n LEU 145 Ca 0.00 0.33 -0.36 0.00 -0.03 0.00 0.00 56.01 55.95 1ysp n LEU 145 Cb 0.00 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 40.97 1ysp n LEU 145 CO 0.00 -0.33 -0.24 -0.60 -1.33 0.00 0.00 177.39 174.89 1ysp s ARG 146 N -3.30 2.30 -0.05 3.23 6.06 -1.02 -5.09 118.95 121.08 1ysp s ARG 146 Ca 0.00 -1.50 0.04 0.00 -2.50 0.00 0.00 55.73 51.77 1ysp s ARG 146 Cb 0.00 -3.44 -0.00 0.00 0.06 0.00 0.00 34.95 31.57 1ysp s ARG 146 CO 0.00 -0.84 -0.17 0.12 -2.50 0.00 0.00 175.30 171.90 1ysp s PHE 147 N 1.24 1.76 -0.05 5.12 5.36 -1.18 -4.14 117.98 126.09 1ysp s PHE 147 Ca 0.02 -0.53 -0.02 0.00 -0.96 0.00 0.00 56.93 55.44 1ysp s PHE 147 Cb -0.21 -1.19 0.04 0.00 -0.34 0.00 0.00 43.02 41.32 1ysp s PHE 147 CO -0.01 -0.19 0.11 0.45 -1.46 0.00 0.00 175.22 174.12 1ysp s SER 148 N 0.09 -0.04 0.40 6.13 0.15 -1.26 -4.99 113.70 114.18 1ysp s SER 148 Ca -0.05 0.23 0.09 0.00 0.70 0.00 0.00 55.95 56.91 1ysp s SER 148 Cb -0.12 0.11 0.83 0.00 -1.71 0.00 0.00 66.02 65.14 1ysp s SER 148 CO 0.03 -0.15 1.98 -0.08 1.20 0.00 0.00 173.24 176.22 1ysp h GLU 149 N 7.28 0.36 -0.47 5.44 4.57 -1.99 -1.79 114.58 127.98 1ysp h GLU 149 Ca -0.44 -0.05 -0.04 0.00 -1.18 0.00 0.00 59.36 57.66 1ysp h GLU 149 Cb 1.13 -0.06 -0.02 0.00 -0.16 0.00 0.00 28.75 29.64 1ysp h GLU 149 CO 0.44 0.36 0.16 0.93 -1.18 0.00 0.00 179.01 179.71 1ysp h GLU 150 N 0.35 0.72 -0.29 1.92 3.07 -1.99 -0.09 114.58 118.27 1ysp h GLU 150 Ca 0.08 -0.15 -0.02 0.00 -0.50 0.00 0.00 59.36 58.77 1ysp h GLU 150 Cb 0.18 -0.11 -0.01 0.00 -0.84 0.00 0.00 28.75 27.97 1ysp h GLU 150 CO 0.00 0.68 0.10 -0.09 -1.40 0.00 0.00 179.01 178.30 1ysp h ARG 151 N 0.62 0.44 -0.19 2.33 2.43 -1.88 -1.54 114.38 116.59 1ysp h ARG 151 Ca 0.15 -0.09 0.05 0.00 -0.81 0.00 0.00 59.98 59.28 1ysp h ARG 151 Cb 0.25 -0.07 -0.05 0.00 -0.42 0.00 0.00 29.97 29.68 1ysp h ARG 151 CO -0.01 0.48 -0.14 1.25 -1.51 0.00 0.00 179.97 180.05 1ysp h LEU 152 N 0.31 -0.45 -0.85 3.80 5.85 -1.13 0.77 115.31 123.61 1ysp h LEU 152 Ca 0.10 0.09 -0.05 0.00 0.84 0.00 0.00 57.88 58.86 1ysp h LEU 152 Cb 0.21 0.23 -0.03 0.00 0.37 0.00 0.00 40.66 41.44 1ysp h LEU 152 CO -0.01 -0.18 0.25 1.56 -0.34 0.00 0.00 178.44 179.73 1ysp h GLN 153 N -0.14 1.11 -0.61 1.25 1.08 -0.93 0.43 115.11 117.29 1ysp h GLN 153 Ca 0.11 -0.22 -0.06 0.00 -1.45 0.00 0.00 58.65 57.04 1ysp h GLN 153 Cb 0.31 -0.17 -0.03 0.00 -0.05 0.00 0.00 27.48 27.54 1ysp h GLN 153 CO -0.28 0.92 0.16 1.49 -0.95 0.00 0.00 178.83 180.17 1ysp h GLU 154 N 1.07 0.97 -0.72 1.46 4.81 -0.95 -0.84 114.58 120.38 1ysp h GLU 154 Ca 0.24 -0.23 -0.07 0.00 -0.13 0.00 0.00 59.36 59.17 1ysp h GLU 154 Cb 0.26 -0.13 -0.03 0.00 0.63 0.00 0.00 28.75 29.48 1ysp h GLU 154 CO -0.01 0.88 0.18 1.88 -0.73 0.00 0.00 179.01 181.21 1ysp h TYR 155 N 0.89 1.21 -0.43 0.92 -1.99 -0.41 -0.26 116.97 116.90 1ysp h TYR 155 Ca 0.19 -0.14 -0.08 0.00 2.00 0.00 0.00 58.73 60.70 1ysp h TYR 155 Cb 0.34 -0.34 -0.01 0.00 2.00 0.00 0.00 36.73 38.71 1ysp h TYR 155 CO 0.02 0.97 -0.06 0.28 -0.00 0.00 0.00 178.16 179.38 1ysp h VAL 156 N 1.09 1.27 -0.52 -2.88 2.07 -0.73 -0.32 116.25 116.23 1ysp h VAL 156 Ca 0.23 -1.14 -0.04 0.00 0.82 0.00 0.00 66.70 66.57 1ysp h VAL 156 Cb 0.37 1.14 -0.02 0.00 -1.52 0.00 0.00 31.29 31.26 1ysp h VAL 156 CO 0.00 0.39 0.17 0.00 0.02 0.00 0.00 177.57 178.15 1ysp h ALA 157 N 0.87 0.68 -0.28 1.67 0.00 -0.77 -0.12 119.26 121.31 1ysp h ALA 157 Ca 0.11 -0.18 -0.16 0.00 0.00 0.00 0.00 54.91 54.69 1ysp h ALA 157 Cb 0.58 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 1ysp h ALA 157 CO 0.03 0.33 -0.45 0.52 0.00 0.00 0.00 179.25 179.68 1ysp h MET 158 N 0.71 0.71 -0.38 0.00 2.07 -0.88 -1.84 114.93 115.33 1ysp h MET 158 Ca 0.17 -0.40 0.03 0.00 -2.07 0.00 0.00 59.70 57.43 1ysp h MET 158 Cb 0.26 0.03 -0.03 0.00 -1.87 0.00 0.00 31.60 29.98 1ysp h MET 158 CO -0.01 1.02 0.17 -0.07 1.07 0.00 0.00 176.91 179.10 1ysp h LEU 159 N 0.57 0.24 -0.52 1.22 3.38 -0.78 -1.85 115.31 117.59 1ysp h LEU 159 Ca 0.04 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1ysp h LEU 159 Cb 1.01 -0.02 -0.03 0.00 0.09 0.00 0.00 40.66 41.72 1ysp h LEU 159 CO 0.10 0.18 0.32 0.45 0.09 0.00 0.00 178.44 179.58 1ysp h HIS 160 N 0.36 0.67 -0.06 1.13 3.86 -0.80 0.23 115.15 120.55 1ysp h HIS 160 Ca 0.16 0.01 0.03 0.00 -1.16 0.00 0.00 60.37 59.41 1ysp h HIS 160 Cb 0.09 -0.22 -0.04 0.00 1.06 0.00 0.00 27.41 28.30 1ysp h HIS 160 CO -0.11 0.44 -0.16 1.15 0.86 0.00 0.00 177.93 180.12 1ysp h THR 161 N 0.69 0.60 -0.10 2.45 2.02 -1.27 0.24 112.91 117.55 1ysp h THR 161 Ca 0.19 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.39 1ysp h THR 161 Cb -0.04 0.60 -0.02 0.00 -1.74 0.00 0.00 68.15 66.95 1ysp h THR 161 CO -0.04 0.00 -0.01 0.00 0.37 0.00 0.00 175.52 175.84 1ysp h ALA 162 N 0.76 0.08 -0.85 6.16 0.00 -1.01 -2.37 119.26 122.03 1ysp h ALA 162 Ca 0.07 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 1ysp h ALA 162 Cb 0.33 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.14 1ysp h ALA 162 CO -0.19 -0.48 0.45 0.00 0.00 0.00 0.00 179.25 179.04 1ysp h ALA 163 N 1.10 1.10 -0.50 0.00 0.00 -0.41 -1.64 119.26 118.90 1ysp h ALA 163 Ca 0.05 -0.14 0.05 0.00 0.00 0.00 0.00 54.91 54.87 1ysp h ALA 163 Cb 0.07 -0.34 -0.05 0.00 0.00 0.00 0.00 17.79 17.47 1ysp h ALA 163 CO -0.10 0.62 0.24 -0.09 0.00 0.00 0.00 179.25 179.92 1ysp h ARG 164 N 1.20 0.45 -0.16 0.00 2.43 -0.75 0.12 114.38 117.66 1ysp h ARG 164 Ca 0.30 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.43 1ysp h ARG 164 Cb 0.05 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 29.49 1ysp h ARG 164 CO -0.05 0.30 0.05 0.87 -1.51 0.00 0.00 179.97 179.63 1ysp h LYS 165 N 0.46 0.25 -0.37 0.20 1.57 -1.10 0.96 116.57 118.54 1ysp h LYS 165 Ca 0.23 -0.05 0.03 0.00 -1.87 0.00 0.00 60.65 58.98 1ysp h LYS 165 Cb 0.16 -0.04 -0.03 0.00 0.08 0.00 0.00 32.23 32.40 1ysp h LYS 165 CO -0.18 0.37 0.17 0.82 -0.57 0.00 0.00 179.45 180.07 1ysp h ILE 166 N 0.08 0.95 -0.19 1.86 2.04 -1.02 -0.29 117.51 120.94 1ysp h ILE 166 Ca 0.05 -0.12 0.00 0.00 1.00 0.00 0.00 64.86 65.79 1ysp h ILE 166 Cb 0.23 0.57 -0.01 0.00 -0.74 0.00 0.00 36.82 36.87 1ysp h ILE 166 CO -0.00 0.06 0.12 0.28 0.00 0.00 0.00 178.15 178.62 1ysp h SER 167 N 0.35 0.21 -0.80 1.72 0.02 -0.90 -1.52 113.55 112.64 1ysp h SER 167 Ca 0.16 -0.01 0.12 0.00 -0.84 0.00 0.00 61.79 61.22 1ysp h SER 167 Cb 0.09 -0.05 -0.08 0.00 0.14 0.00 0.00 62.40 62.50 1ysp h SER 167 CO -0.13 0.15 0.42 0.00 -1.14 0.00 0.00 176.83 176.14 1ysp h ALA 168 N 1.07 1.16 0.00 3.77 0.00 -0.52 0.29 119.26 125.03 1ysp h ALA 168 Ca 0.07 0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1ysp h ALA 168 Cb -0.03 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.71 1ysp h ALA 168 CO -0.02 -0.02 0.00 1.96 0.00 0.00 0.00 179.25 181.17 1ysp h GLN 169 N 0.66 0.00 0.00 0.00 4.20 -0.73 -2.10 115.11 117.15 1ysp h GLN 169 Ca 0.41 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.12 1ysp h GLN 169 Cb 0.49 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.27 1ysp h GLN 169 CO -0.30 0.00 -0.32 -1.33 -0.67 0.00 0.00 178.83 176.21 1ysp n MET 170 N -2.31 0.15 0.00 1.46 2.81 -0.17 -4.95 117.12 114.11 1ysp n MET 170 Ca 0.03 0.07 0.00 0.00 -1.81 0.00 0.00 57.70 55.99 1ysp n MET 170 Cb 0.27 -1.63 0.00 0.00 -0.71 0.00 0.00 33.22 31.16 1ysp n MET 170 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1ysp n GLY 171 N 1.41 0.86 0.00 3.03 0.00 -0.79 -4.17 105.19 105.53 1ysp n GLY 171 Ca 0.05 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.18 1ysp n GLY 171 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30