#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kta s TYR 3 N 0.00 0.16 -0.34 6.00 1.13 -0.99 -4.98 117.35 118.34 3kta s TYR 3 Ca 0.00 -0.52 -0.28 0.00 -1.41 0.00 0.00 57.07 54.86 3kta s TYR 3 Cb 0.00 0.13 0.02 0.00 -1.10 0.00 0.00 41.96 41.01 3kta s TYR 3 CO 0.00 -0.79 1.02 0.42 -2.51 0.00 0.00 175.55 173.69 3kta s ILE 4 N -3.92 4.54 -0.02 -3.49 1.01 -1.26 -0.42 121.20 117.63 3kta s ILE 4 Ca 0.13 1.55 -0.19 0.00 0.00 0.00 0.00 60.65 62.14 3kta s ILE 4 Cb 0.02 -4.38 -0.33 0.00 0.01 0.00 0.00 42.46 37.78 3kta s ILE 4 CO -0.02 -0.49 0.91 -0.33 0.00 0.00 0.00 174.94 175.00 3kta h GLU 5 N 8.22 0.39 -2.38 2.79 5.08 -0.79 -3.40 114.58 124.49 3kta h GLU 5 Ca -0.21 -0.67 0.11 0.00 -1.00 0.00 0.00 59.36 57.59 3kta h GLU 5 Cb 1.07 0.25 -0.13 0.00 0.50 0.00 0.00 28.75 30.43 3kta h GLU 5 CO 1.01 1.32 0.46 -1.59 -1.00 0.00 0.00 179.01 179.21 3kta s LYS 6 N -2.50 0.96 0.02 2.33 -2.85 -1.18 -1.95 119.74 114.58 3kta s LYS 6 Ca -0.12 -0.40 0.08 0.00 -1.00 0.00 0.00 55.97 54.53 3kta s LYS 6 Cb 0.02 0.41 -0.03 0.00 -2.06 0.00 0.00 37.83 36.18 3kta s LYS 6 CO 0.87 -0.42 -0.23 -0.51 0.10 0.00 0.00 175.35 175.16 3kta s LEU 7 N -2.60 2.32 -0.11 2.77 1.43 -0.19 -1.04 118.68 121.26 3kta s LEU 7 Ca 0.06 -0.48 0.03 0.00 -1.03 0.00 0.00 54.13 52.71 3kta s LEU 7 Cb -0.01 -1.39 0.00 0.00 0.03 0.00 0.00 46.19 44.83 3kta s LEU 7 CO -0.07 0.28 -0.22 -1.61 0.23 0.00 0.00 176.35 174.95 3kta s GLU 8 N -1.12 2.93 -0.08 1.70 2.02 0.42 -0.41 118.70 124.15 3kta s GLU 8 Ca 0.12 -0.83 0.03 0.00 0.02 0.00 0.00 54.97 54.31 3kta s GLU 8 Cb -0.10 -2.28 -0.01 0.00 0.10 0.00 0.00 34.13 31.83 3kta s GLU 8 CO 0.02 0.09 -0.19 -0.51 0.02 0.00 0.00 175.26 174.70 3kta s LEU 9 N 0.55 2.42 -0.14 1.80 1.02 -0.21 -0.69 118.68 123.44 3kta s LEU 9 Ca -0.14 -0.39 -0.03 0.00 0.02 0.00 0.00 54.13 53.59 3kta s LEU 9 Cb -0.17 -1.49 0.05 0.00 0.02 0.00 0.00 46.19 44.60 3kta s LEU 9 CO 0.05 0.23 0.03 -0.75 0.02 0.00 0.00 176.35 175.93 3kta s LYS 10 N -0.08 0.49 -0.97 1.70 2.47 0.08 -0.69 119.74 122.74 3kta s LYS 10 Ca -0.04 -0.12 0.00 0.00 -1.56 0.00 0.00 55.97 54.24 3kta s LYS 10 Cb -0.14 -1.56 0.00 0.00 -1.46 0.00 0.00 37.83 34.67 3kta s LYS 10 CO 0.04 -0.51 0.00 0.41 0.16 0.00 0.00 175.35 175.46 3kta n GLY 11 N 5.14 1.08 3.54 5.54 0.00 0.65 -0.34 105.19 120.80 3kta n GLY 11 Ca -0.08 -0.60 -0.38 0.00 0.00 0.00 0.00 46.02 44.97 3kta n GLY 11 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3kta s PHE 12 N -2.33 3.19 0.00 1.61 5.36 -1.26 -1.03 117.98 123.53 3kta s PHE 12 Ca 0.00 -0.09 0.00 0.00 -0.96 0.00 0.00 56.93 55.88 3kta s PHE 12 Cb 0.00 -2.36 0.00 0.00 -0.34 0.00 0.00 43.02 40.32 3kta s PHE 12 CO 0.00 -0.25 0.00 1.63 -1.46 0.00 0.00 175.22 175.14 3kta n LYS 13 N 5.03 0.00 -0.01 10.12 5.02 0.66 -1.14 118.16 137.85 3kta n LYS 13 Ca -0.14 0.00 0.13 0.00 -2.02 0.00 0.00 58.31 56.27 3kta n LYS 13 Cb 0.51 0.00 0.71 0.00 -0.02 0.00 0.00 35.03 36.24 3kta n LYS 13 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 3kta n SER 14 N 2.72 0.21 -0.16 4.39 3.41 -1.26 -3.73 113.62 119.21 3kta n SER 14 Ca 0.00 -1.26 0.15 0.00 -0.26 0.00 0.00 58.87 57.50 3kta n SER 14 Cb 0.00 -0.01 0.80 0.00 -0.26 0.00 0.00 64.21 64.74 3kta n SER 14 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 3kta n TYR 15 N -0.75 0.00 -3.82 7.33 4.02 -0.29 -5.02 117.16 118.63 3kta n TYR 15 Ca 0.19 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 58.08 3kta n TYR 15 Cb 0.12 -0.01 -0.00 0.00 -0.02 0.00 0.00 39.34 39.43 3kta n TYR 15 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3kta n GLY 16 N 1.07 -2.01 0.01 2.72 0.00 -1.26 -4.47 105.19 101.25 3kta n GLY 16 Ca 0.22 -1.40 0.11 0.00 0.00 0.00 0.00 46.02 44.95 3kta n GLY 16 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3kta n ASN 17 N 0.49 0.66 -4.71 1.61 3.02 -1.26 -0.25 115.26 114.82 3kta n ASN 17 Ca 0.00 -0.42 -0.39 0.00 -0.03 0.00 0.00 54.58 53.74 3kta n ASN 17 Cb 0.00 0.58 -0.05 0.00 -0.61 0.00 0.00 39.78 39.70 3kta n ASN 17 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 3kta s LYS 18 N -3.06 4.36 0.00 3.52 1.02 -1.26 -4.62 119.74 119.70 3kta s LYS 18 Ca 0.08 0.66 -0.35 0.00 0.02 0.00 0.00 55.97 56.38 3kta s LYS 18 Cb 0.16 -3.47 -0.13 0.00 -0.52 0.00 0.00 37.83 33.87 3kta s LYS 18 CO 0.77 0.04 1.70 1.17 -0.92 0.00 0.00 175.35 178.11 3kta n LYS 19 N 3.98 1.95 -4.31 1.68 4.81 -1.26 -4.79 118.16 120.21 3kta n LYS 19 Ca -0.04 0.71 -0.34 0.00 -0.87 0.00 0.00 58.31 57.77 3kta n LYS 19 Cb 0.51 -2.49 -0.13 0.00 0.02 0.00 0.00 35.03 32.94 3kta n LYS 19 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 3kta s VAL 20 N 2.48 3.60 -0.18 3.15 1.01 0.13 -4.95 120.40 125.64 3kta s VAL 20 Ca 0.87 -0.45 -0.07 0.00 0.00 0.00 0.00 61.98 62.34 3kta s VAL 20 Cb -0.75 -2.59 -0.04 0.00 0.00 0.00 0.00 36.38 33.00 3kta s VAL 20 CO 0.48 0.47 0.05 -0.69 0.00 0.00 0.00 175.10 175.41 3kta s VAL 21 N 0.73 4.68 -0.30 2.92 1.01 -1.26 -1.05 120.40 127.14 3kta s VAL 21 Ca -0.02 -0.07 0.01 0.00 0.00 0.00 0.00 61.98 61.89 3kta s VAL 21 Cb -0.15 -3.11 0.09 0.00 0.00 0.00 0.00 36.38 33.21 3kta s VAL 21 CO 0.02 0.45 0.04 -0.63 0.00 0.00 0.00 175.10 174.99 3kta s ILE 22 N 0.46 1.45 0.30 2.22 1.01 0.45 -4.99 121.20 122.10 3kta s ILE 22 Ca 0.03 -1.61 -0.12 0.00 0.00 0.00 0.00 60.65 58.95 3kta s ILE 22 Cb -0.13 -1.98 -0.08 0.00 0.01 0.00 0.00 42.46 40.28 3kta s ILE 22 CO 0.01 -0.49 0.66 -2.16 0.00 0.00 0.00 174.94 172.96 3kta s PRO 23 N 1.36 3.88 0.09 2.79 0.04 -1.26 -1.02 135.00 140.87 3kta s PRO 23 Ca 0.06 0.46 0.07 0.00 0.04 0.00 0.00 61.00 61.63 3kta s PRO 23 Cb -0.18 -2.51 -0.03 0.00 0.04 0.00 0.00 34.50 31.81 3kta s PRO 23 CO -0.15 0.19 -0.18 -0.06 0.04 0.00 0.00 177.00 176.85 3kta s PHE 24 N -1.99 1.52 0.46 0.56 0.40 -0.82 -4.97 117.98 113.14 3kta s PHE 24 Ca 0.51 -0.43 -0.23 0.00 -0.60 0.00 0.00 56.93 56.17 3kta s PHE 24 Cb -0.11 -0.84 -0.07 0.00 0.51 0.00 0.00 43.02 42.51 3kta s PHE 24 CO 0.21 0.13 1.24 0.45 0.70 0.00 0.00 175.22 177.95 3kta s SER 25 N -1.79 6.03 0.59 1.36 0.15 -1.26 -4.78 113.70 114.00 3kta s SER 25 Ca 0.03 2.48 0.29 0.00 0.70 0.00 0.00 55.95 59.44 3kta s SER 25 Cb -0.10 -2.62 1.60 0.00 -1.71 0.00 0.00 66.02 63.19 3kta s SER 25 CO 0.03 -1.02 2.04 0.50 1.20 0.00 0.00 173.24 175.98 3kta h LYS 26 N 2.10 0.00 0.00 5.44 3.64 -1.96 -3.42 116.57 122.37 3kta h LYS 26 Ca -0.50 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.88 3kta h LYS 26 Cb 1.26 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.08 3kta h LYS 26 CO 0.60 0.00 0.00 0.41 -2.27 0.00 0.00 179.45 178.19 3kta n GLY 27 N -1.43 0.29 3.21 5.01 0.00 -1.26 -5.00 105.19 105.99 3kta n GLY 27 Ca 0.04 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.70 3kta n GLY 27 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3kta s PHE 28 N 1.87 3.22 -0.14 1.61 5.36 -1.26 -5.09 117.98 123.56 3kta s PHE 28 Ca 0.00 -1.68 -0.03 0.00 -0.96 0.00 0.00 56.93 54.26 3kta s PHE 28 Cb 0.00 -2.14 -0.03 0.00 -0.34 0.00 0.00 43.02 40.52 3kta s PHE 28 CO 0.00 -0.76 -0.05 0.99 -1.46 0.00 0.00 175.22 173.94 3kta s THR 29 N 1.31 3.80 -0.12 0.12 2.01 -1.26 -4.86 115.64 116.64 3kta s THR 29 Ca -0.03 -0.40 -0.06 0.00 0.31 0.00 0.00 61.69 61.51 3kta s THR 29 Cb -0.19 -2.64 -0.04 0.00 0.01 0.00 0.00 72.50 69.64 3kta s THR 29 CO -0.01 0.52 0.10 0.00 -0.69 0.00 0.00 174.62 174.54 3kta s ALA 30 N 0.12 3.71 -0.16 7.40 0.00 -1.26 -5.06 121.76 126.51 3kta s ALA 30 Ca -0.02 -0.69 -0.01 0.00 0.00 0.00 0.00 51.96 51.25 3kta s ALA 30 Cb -0.14 -1.86 -0.01 0.00 0.00 0.00 0.00 23.12 21.12 3kta s ALA 30 CO 0.03 0.58 -0.11 0.42 0.00 0.00 0.00 175.76 176.67 3kta s ILE 31 N -0.88 3.01 0.23 0.00 1.01 -1.26 -5.12 121.20 118.19 3kta s ILE 31 Ca 0.14 -0.65 0.07 0.00 0.00 0.00 0.00 60.65 60.21 3kta s ILE 31 Cb -0.12 -2.30 -0.05 0.00 0.01 0.00 0.00 42.46 40.01 3kta s ILE 31 CO 0.03 0.50 -0.11 0.68 0.00 0.00 0.00 174.94 176.04 3kta s VAL 32 N 0.81 1.67 0.00 2.92 -7.23 -1.26 -5.11 120.40 112.20 3kta s VAL 32 Ca -0.04 -2.17 0.00 0.00 -1.81 0.00 0.00 61.98 57.96 3kta s VAL 32 Cb -0.15 -2.20 0.00 0.00 0.56 0.00 0.00 36.38 34.59 3kta s VAL 32 CO 0.01 -0.48 0.00 0.61 -0.31 0.00 0.00 175.10 174.92 3kta n GLY 33 N -0.45 3.22 3.70 2.32 0.00 -1.26 -5.01 105.19 107.71 3kta n GLY 33 Ca -0.07 -0.99 -0.33 0.00 0.00 0.00 0.00 46.02 44.62 3kta n GLY 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kta s ALA 34 N -2.00 1.89 0.23 4.61 0.00 -1.26 -4.89 121.76 120.34 3kta s ALA 34 Ca 0.00 0.81 -0.31 0.00 0.00 0.00 0.00 51.96 52.46 3kta s ALA 34 Cb 0.00 -3.48 -0.14 0.00 0.00 0.00 0.00 23.12 19.51 3kta s ALA 34 CO 0.00 -2.21 1.38 0.09 0.00 0.00 0.00 175.76 175.01 3kta n ASN 35 N -3.24 2.57 -0.03 0.00 3.02 -1.26 -1.85 115.26 114.47 3kta n ASN 35 Ca 0.13 1.14 -0.00 0.00 -0.03 0.00 0.00 54.58 55.82 3kta n ASN 35 Cb 0.51 -1.40 -0.00 0.00 -0.61 0.00 0.00 39.78 38.27 3kta n ASN 35 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3kta n GLY 36 N 2.15 0.47 0.16 7.41 0.00 -1.26 -4.93 105.19 109.18 3kta n GLY 36 Ca 0.12 -0.18 0.09 0.00 0.00 0.00 0.00 46.02 46.05 3kta n GLY 36 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3kta h SER 37 N 0.00 0.00 0.00 1.61 4.64 -1.71 -3.47 113.55 114.62 3kta h SER 37 Ca -0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 3kta h SER 37 Cb 0.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.21 3kta h SER 37 CO 0.01 0.16 0.00 0.61 -0.87 0.00 0.00 176.83 176.74 3kta n GLY 38 N 1.18 0.92 0.20 -0.77 0.00 -1.26 -5.04 105.19 100.42 3kta n GLY 38 Ca 0.01 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 3kta n GLY 38 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3kta h LYS 39 N 0.00 -0.40 0.00 1.61 1.57 -1.92 -3.08 116.57 114.35 3kta h LYS 39 Ca 0.00 0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.79 3kta h LYS 39 Cb 0.00 0.09 -0.00 0.00 0.08 0.00 0.00 32.23 32.40 3kta h LYS 39 CO 0.00 -0.07 -0.07 0.77 -0.57 0.00 0.00 179.45 179.51 3kta h SER 40 N -0.85 0.00 0.04 0.86 0.02 -1.99 -1.23 113.55 110.41 3kta h SER 40 Ca -0.04 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.90 3kta h SER 40 Cb 0.52 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.06 3kta h SER 40 CO 0.07 0.07 -0.03 0.78 -1.14 0.00 0.00 176.83 176.58 3kta h ASN 41 N 0.00 0.00 -0.44 3.07 2.35 -1.97 -0.34 115.58 118.25 3kta h ASN 41 Ca -0.00 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.72 3kta h ASN 41 Cb 0.14 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.49 3kta h ASN 41 CO 0.01 0.03 0.16 0.40 -1.65 0.00 0.00 177.43 176.37 3kta h ILE 42 N 0.00 1.21 -0.97 2.81 2.04 -1.18 -1.04 117.51 120.38 3kta h ILE 42 Ca -0.00 -0.68 0.04 0.00 1.00 0.00 0.00 64.86 65.22 3kta h ILE 42 Cb 0.06 0.83 -0.06 0.00 -0.74 0.00 0.00 36.82 36.91 3kta h ILE 42 CO 0.00 0.25 0.64 1.23 0.00 0.00 0.00 178.15 180.27 3kta h GLY 43 N 0.57 1.43 1.56 5.37 0.00 -1.18 -2.33 103.07 108.48 3kta h GLY 43 Ca 0.14 -0.48 -0.09 0.00 0.00 0.00 0.00 47.33 46.90 3kta h GLY 43 CO -0.01 0.39 -0.23 -0.55 0.00 0.00 0.00 176.54 176.15 3kta h ASP 44 N 1.21 0.52 -0.90 0.19 3.32 -0.85 -1.39 116.42 118.51 3kta h ASP 44 Ca 0.40 -0.17 -0.01 0.00 0.02 0.00 0.00 57.03 57.26 3kta h ASP 44 Cb 0.05 -0.14 -0.04 0.00 0.22 0.00 0.00 39.33 39.41 3kta h ASP 44 CO -0.13 0.75 0.52 0.00 -1.72 0.00 0.00 179.24 178.66 3kta h ALA 45 N 1.30 1.16 -0.18 3.45 0.00 -0.68 0.79 119.26 125.09 3kta h ALA 45 Ca 0.07 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 3kta h ALA 45 Cb 0.65 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 3kta h ALA 45 CO 0.05 0.64 0.00 0.82 0.00 0.00 0.00 179.25 180.76 3kta h ILE 46 N 1.25 1.25 -0.53 0.00 2.04 -1.01 -0.72 117.51 119.80 3kta h ILE 46 Ca 0.32 -0.83 0.08 0.00 1.00 0.00 0.00 64.86 65.43 3kta h ILE 46 Cb -0.02 1.45 -0.06 0.00 -0.74 0.00 0.00 36.82 37.46 3kta h ILE 46 CO -0.06 0.25 0.18 -0.07 0.00 0.00 0.00 178.15 178.46 3kta h LEU 47 N 0.06 0.17 0.32 1.44 3.38 -0.92 -2.05 115.31 117.71 3kta h LEU 47 Ca 0.05 0.07 -0.02 0.00 0.09 0.00 0.00 57.88 58.07 3kta h LEU 47 Cb 0.37 0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.18 3kta h LEU 47 CO 0.01 0.12 -0.16 0.15 0.09 0.00 0.00 178.44 178.65 3kta h PHE 48 N 0.35 -0.40 0.00 1.13 3.57 -0.68 0.12 116.94 121.03 3kta h PHE 48 Ca 0.26 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.72 3kta h PHE 48 Cb 0.30 0.13 -0.00 0.00 2.79 0.00 0.00 35.95 39.17 3kta h PHE 48 CO -0.17 -0.25 -0.16 -0.24 -2.23 0.00 0.00 178.31 175.26 3kta h VAL 49 N -0.44 0.43 -0.22 1.41 3.04 -0.92 -1.43 116.25 118.13 3kta h VAL 49 Ca -0.04 -0.87 0.00 0.00 -1.01 0.00 0.00 66.70 64.77 3kta h VAL 49 Cb 0.34 1.63 0.00 0.00 -2.01 0.00 0.00 31.29 31.24 3kta h VAL 49 CO 0.07 0.15 0.00 0.18 -1.01 0.00 0.00 177.57 176.97 3kta n LEU 50 N -3.37 1.41 0.00 3.16 4.77 -0.79 -4.77 117.00 117.42 3kta n LEU 50 Ca -0.00 -0.66 0.00 0.00 -0.03 0.00 0.00 56.01 55.32 3kta n LEU 50 Cb 0.36 -0.14 0.00 0.00 -2.33 0.00 0.00 43.42 41.31 3kta n LEU 50 CO 0.31 0.33 0.00 0.61 -1.33 0.00 0.00 177.39 177.31 3kta n GLY 51 N 0.99 0.99 3.73 -0.72 0.00 -0.54 -4.23 105.19 105.41 3kta n GLY 51 Ca 0.12 -0.12 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 3kta n GLY 51 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kta n GLY 52 N -2.04 0.88 0.00 -0.02 0.00 0.39 -4.90 105.19 99.50 3kta n GLY 52 Ca 0.00 0.35 0.01 0.00 0.00 0.00 0.00 46.02 46.38 3kta n GLY 52 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3kta n LEU 53 N 0.97 0.08 -4.55 0.99 4.77 -1.26 -4.82 117.00 113.18 3kta n LEU 53 Ca 0.05 -0.34 -0.38 0.00 -0.03 0.00 0.00 56.01 55.30 3kta n LEU 53 Cb 0.37 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.42 3kta n LEU 53 CO 0.63 0.02 1.41 -0.55 -1.33 0.00 0.00 177.39 177.57 3kta s SER 54 N -1.58 5.69 0.25 -1.43 0.15 -1.26 -4.86 113.70 110.65 3kta s SER 54 Ca 0.00 -0.21 -0.05 0.00 0.70 0.00 0.00 55.95 56.40 3kta s SER 54 Cb 0.02 -2.55 0.48 0.00 -1.71 0.00 0.00 66.02 62.26 3kta s SER 54 CO 0.11 -2.14 1.68 0.00 1.20 0.00 0.00 173.24 174.08 3kta h ALA 55 N 12.34 0.95 0.26 5.45 0.00 -1.94 -2.42 119.26 133.90 3kta h ALA 55 Ca -0.19 0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 3kta h ALA 55 Cb 1.09 0.26 -0.01 0.00 0.00 0.00 0.00 17.79 19.13 3kta h ALA 55 CO 1.26 -0.36 -0.19 -0.22 0.00 0.00 0.00 179.25 179.74 3kta h LYS 56 N 0.24 -0.43 -0.96 0.00 3.64 -1.89 0.40 116.57 117.56 3kta h LYS 56 Ca 0.42 0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.83 3kta h LYS 56 Cb 0.74 0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.66 3kta h LYS 56 CO -0.54 -0.29 0.00 0.00 -2.27 0.00 0.00 179.45 176.35 3kta n ALA 57 N -2.39 1.08 -2.67 5.00 0.00 -0.91 -4.57 120.51 116.05 3kta n ALA 57 Ca -0.09 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.31 3kta n ALA 57 Cb 0.23 -0.86 0.11 0.00 0.00 0.00 0.00 19.45 18.92 3kta n ALA 57 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3kta n ARG 59 N 0.69 1.14 -4.76 0.00 1.74 -0.44 -5.02 116.66 110.01 3kta n ARG 59 Ca 0.00 -1.33 -0.24 0.00 -0.77 0.00 0.00 57.85 55.51 3kta n ARG 59 Cb 0.00 0.19 -0.16 0.00 -1.02 0.00 0.00 32.46 31.48 3kta n ARG 59 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3kta s ALA 60 N 0.14 1.36 -0.17 7.54 0.00 0.00 -5.00 121.76 125.64 3kta s ALA 60 Ca 0.13 -0.66 0.18 0.00 0.00 0.00 0.00 51.96 51.60 3kta s ALA 60 Cb 0.38 -0.39 -0.26 0.00 0.00 0.00 0.00 23.12 22.85 3kta s ALA 60 CO -0.10 0.30 0.45 -1.13 0.00 0.00 0.00 175.76 175.28 3kta n SER 61 N 2.88 0.93 -4.01 0.00 3.41 -1.26 -4.22 113.62 111.35 3kta n SER 61 Ca -0.16 -0.17 -0.09 0.00 -0.26 0.00 0.00 58.87 58.19 3kta n SER 61 Cb 0.54 1.65 -0.06 0.00 -0.26 0.00 0.00 64.21 66.09 3kta n SER 61 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3kta s ARG 62 N -3.11 1.51 0.37 4.33 1.70 -1.26 -5.06 118.95 117.43 3kta s ARG 62 Ca -0.04 -1.27 0.09 0.00 -0.47 0.00 0.00 55.73 54.04 3kta s ARG 62 Cb 0.12 0.45 0.73 0.00 -0.57 0.00 0.00 34.95 35.68 3kta s ARG 62 CO 0.73 -0.62 1.88 0.97 -1.08 0.00 0.00 175.30 177.18 3kta h ILE 63 N 2.29 1.20 0.00 4.99 -0.00 -1.95 -1.89 117.51 122.15 3kta h ILE 63 Ca -0.27 -0.93 0.00 0.00 -0.00 0.00 0.00 64.86 63.66 3kta h ILE 63 Cb 1.25 1.33 0.00 0.00 -0.00 0.00 0.00 36.82 39.40 3kta h ILE 63 CO 0.37 0.28 0.00 0.77 -0.00 0.00 0.00 178.15 179.57 3kta h SER 64 N 0.20 0.00 0.65 2.19 4.64 -1.89 0.12 113.55 119.45 3kta h SER 64 Ca 0.04 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.21 3kta h SER 64 Cb 0.47 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.54 3kta h SER 64 CO 0.03 0.00 -0.70 0.44 -0.87 0.00 0.00 176.83 175.73 3kta h ASP 65 N 0.00 0.05 1.13 4.97 3.32 -1.74 -3.21 116.42 120.94 3kta h ASP 65 Ca 0.00 -0.04 -0.14 0.00 0.02 0.00 0.00 57.03 56.88 3kta h ASP 65 Cb 0.10 -0.02 -0.02 0.00 0.22 0.00 0.00 39.33 39.61 3kta h ASP 65 CO 0.00 0.73 -0.92 -0.07 -1.72 0.00 0.00 179.24 177.26 3kta h LEU 66 N 0.03 0.00 -9.33 1.55 -0.00 -0.91 -3.42 115.31 103.22 3kta h LEU 66 Ca -0.01 0.00 -0.58 0.00 -0.00 0.00 0.00 57.88 57.29 3kta h LEU 66 Cb 1.24 0.00 -0.08 0.00 -0.00 0.00 0.00 40.66 41.82 3kta h LEU 66 CO 0.09 0.56 -0.16 -0.63 -0.00 0.00 0.00 178.44 178.31 3kta s ILE 67 N -2.93 5.19 -0.15 1.22 1.01 -0.96 -0.25 121.20 124.34 3kta s ILE 67 Ca 0.01 0.92 -0.40 0.00 0.00 0.00 0.00 60.65 61.17 3kta s ILE 67 Cb 0.08 -3.80 -0.17 0.00 0.01 0.00 0.00 42.46 38.58 3kta s ILE 67 CO 0.78 0.34 1.48 0.33 0.00 0.00 0.00 174.94 177.86 3kta n PHE 68 N 3.61 1.59 -4.02 3.97 7.35 -0.19 -4.66 117.46 125.11 3kta n PHE 68 Ca -0.08 0.76 -0.34 0.00 -0.76 0.00 0.00 57.45 57.03 3kta n PHE 68 Cb 0.52 -2.32 -0.15 0.00 0.35 0.00 0.00 39.48 37.88 3kta n PHE 68 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 3kta s ALA 69 N 1.86 2.57 -0.12 3.13 0.00 -1.26 -4.31 121.76 123.62 3kta s ALA 69 Ca 0.94 -1.31 -0.01 0.00 0.00 0.00 0.00 51.96 51.58 3kta s ALA 69 Cb -1.14 -1.48 0.00 0.00 0.00 0.00 0.00 23.12 20.51 3kta s ALA 69 CO 0.61 -0.56 0.09 -0.35 0.00 0.00 0.00 175.76 175.54 3kta n PRO 75 N 4.66 -0.29 -2.02 0.00 -0.05 -1.26 -5.10 135.00 130.95 3kta n PRO 75 Ca -0.19 0.05 -0.40 0.00 -0.05 0.00 0.00 63.50 62.91 3kta n PRO 75 Cb 0.49 -0.23 -0.01 0.00 -0.05 0.00 0.00 33.50 33.70 3kta n PRO 75 CO 0.00 0.00 0.00 -2.14 -0.05 0.00 0.00 175.50 173.31 3kta s PRO 76 N -2.73 4.08 0.28 0.54 0.02 -1.26 -4.94 135.00 131.00 3kta s PRO 76 Ca 0.01 2.25 -0.30 0.00 0.02 0.00 0.00 61.00 62.98 3kta s PRO 76 Cb -0.00 -2.87 -0.13 0.00 0.02 0.00 0.00 34.50 31.51 3kta s PRO 76 CO 0.13 -0.43 1.27 0.00 -0.33 0.00 0.00 177.00 177.64 3kta n ALA 77 N 0.35 0.75 0.17 -1.55 0.00 -1.26 -4.88 120.51 114.09 3kta n ALA 77 Ca 0.02 0.39 0.05 0.00 0.00 0.00 0.00 53.44 53.91 3kta n ALA 77 Cb 0.42 -2.20 0.14 0.00 0.00 0.00 0.00 19.45 17.81 3kta n ALA 77 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 3kta h LYS 78 N 3.14 0.00 -2.27 0.00 1.57 -1.95 -3.48 116.57 113.58 3kta h LYS 78 Ca -0.44 0.00 0.15 0.00 -1.87 0.00 0.00 60.65 58.49 3kta h LYS 78 Cb 1.30 0.00 -0.12 0.00 0.08 0.00 0.00 32.23 33.49 3kta h LYS 78 CO 0.68 0.37 0.50 1.52 -0.57 0.00 0.00 179.45 181.95 3kta s TYR 79 N -3.14 -0.23 -0.09 -1.35 1.13 -1.26 -4.37 117.35 108.04 3kta s TYR 79 Ca 0.04 0.02 0.01 0.00 -1.41 0.00 0.00 57.07 55.72 3kta s TYR 79 Cb 0.08 0.59 -0.02 0.00 -1.10 0.00 0.00 41.96 41.50 3kta s TYR 79 CO 0.71 -0.67 -0.10 0.00 -2.51 0.00 0.00 175.55 172.99 3kta s ALA 80 N -3.17 2.82 -0.01 9.51 0.00 -0.35 -4.54 121.76 126.01 3kta s ALA 80 Ca 0.09 -0.90 0.02 0.00 0.00 0.00 0.00 51.96 51.16 3kta s ALA 80 Cb -0.01 -1.20 0.00 0.00 0.00 0.00 0.00 23.12 21.91 3kta s ALA 80 CO -0.03 0.44 -0.05 -2.00 0.00 0.00 0.00 175.76 174.12 3kta s GLU 81 N -0.35 0.54 -0.05 0.00 2.12 0.54 -0.45 118.70 121.04 3kta s GLU 81 Ca 0.04 -0.17 0.05 0.00 0.36 0.00 0.00 54.97 55.25 3kta s GLU 81 Cb -0.12 -0.54 -0.00 0.00 0.26 0.00 0.00 34.13 33.72 3kta s GLU 81 CO 0.02 0.07 -0.20 0.08 -0.54 0.00 0.00 175.26 174.69 3kta s VAL 82 N 0.16 1.67 -0.08 3.70 1.01 -0.43 -0.74 120.40 125.69 3kta s VAL 82 Ca -0.02 -0.85 0.05 0.00 0.00 0.00 0.00 61.98 61.16 3kta s VAL 82 Cb -0.06 -1.43 -0.01 0.00 0.00 0.00 0.00 36.38 34.89 3kta s VAL 82 CO -0.00 0.47 -0.23 0.00 0.00 0.00 0.00 175.10 175.34 3kta s ALA 83 N 0.01 2.23 -0.09 5.51 0.00 0.14 -0.93 121.76 128.62 3kta s ALA 83 Ca -0.05 -1.00 0.02 0.00 0.00 0.00 0.00 51.96 50.93 3kta s ALA 83 Cb -0.13 -0.79 -0.02 0.00 0.00 0.00 0.00 23.12 22.19 3kta s ALA 83 CO 0.03 0.36 -0.17 -1.50 0.00 0.00 0.00 175.76 174.48 3kta s ILE 84 N 0.05 2.78 -0.26 0.00 2.07 0.30 -0.44 121.20 125.71 3kta s ILE 84 Ca -0.10 -0.79 -0.03 0.00 -1.41 0.00 0.00 60.65 58.32 3kta s ILE 84 Cb -0.15 -2.11 0.02 0.00 0.13 0.00 0.00 42.46 40.34 3kta s ILE 84 CO 0.06 0.55 -0.02 -0.31 -1.91 0.00 0.00 174.94 173.32 3kta s TYR 85 N -0.05 3.07 -0.18 3.50 1.51 -0.21 -1.34 117.35 123.66 3kta s TYR 85 Ca -0.04 -1.29 -0.09 0.00 -1.01 0.00 0.00 57.07 54.64 3kta s TYR 85 Cb -0.14 -2.12 -0.05 0.00 -0.11 0.00 0.00 41.96 39.54 3kta s TYR 85 CO 0.04 -0.66 0.10 -0.06 -1.11 0.00 0.00 175.55 173.87 3kta s PHE 86 N 1.40 3.36 -0.12 2.71 0.40 0.47 -0.07 117.98 126.14 3kta s PHE 86 Ca 0.02 0.25 -0.29 0.00 -0.60 0.00 0.00 56.93 56.31 3kta s PHE 86 Cb -0.16 -2.10 -0.03 0.00 0.51 0.00 0.00 43.02 41.24 3kta s PHE 86 CO -0.02 0.29 1.34 1.21 0.70 0.00 0.00 175.22 178.73 3kta s ASN 87 N 0.21 6.90 -0.21 1.36 3.84 0.44 -1.30 114.94 126.17 3kta s ASN 87 Ca 0.07 1.84 0.12 0.00 0.21 0.00 0.00 52.86 55.11 3kta s ASN 87 Cb -0.12 -2.54 0.41 0.00 -0.55 0.00 0.00 41.25 38.46 3kta s ASN 87 CO -0.01 -0.77 1.25 -3.20 -2.79 0.00 0.00 177.10 171.59 3kta n ASN 88 N 6.43 2.05 0.03 -4.21 5.15 0.12 -2.34 115.26 122.48 3kta n ASN 88 Ca 0.14 -3.69 0.14 0.00 -0.60 0.00 0.00 54.58 50.57 3kta n ASN 88 Cb 0.44 -0.53 0.61 0.00 -0.53 0.00 0.00 39.78 39.77 3kta n ASN 88 CO 0.00 0.00 0.00 -0.33 1.40 0.00 0.00 177.26 178.33 3kta h GLU 89 N 0.83 0.15 -0.00 1.20 5.08 -1.81 0.53 114.58 120.57 3kta h GLU 89 Ca 0.04 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 3kta h GLU 89 Cb 1.13 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.34 3kta h GLU 89 CO 0.07 0.10 -0.01 -0.40 -1.00 0.00 0.00 179.01 177.77 3kta n ASP 90 N -4.45 0.29 -2.79 1.42 5.68 -1.26 -4.91 116.55 110.52 3kta n ASP 90 Ca 0.07 -0.94 -0.20 0.00 -0.50 0.00 0.00 54.79 53.22 3kta n ASP 90 Cb 0.40 -0.04 0.01 0.00 -1.14 0.00 0.00 41.12 40.35 3kta n ASP 90 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 3kta n ARG 91 N -0.84 -3.27 -0.25 0.11 5.12 0.18 -4.88 116.66 112.82 3kta n ARG 91 Ca 0.21 0.82 -0.01 0.00 -1.93 0.00 0.00 57.85 56.94 3kta n ARG 91 Cb 0.18 -5.55 0.20 0.00 -1.16 0.00 0.00 32.46 26.13 3kta n ARG 91 CO 0.00 0.00 0.00 0.78 -1.93 0.00 0.00 177.63 176.48 3kta h GLY 92 N -0.67 1.14 -3.87 -0.13 0.00 -1.91 -3.41 103.07 94.21 3kta h GLY 92 Ca -0.46 -0.45 -0.50 0.00 0.00 0.00 0.00 47.33 45.92 3kta h GLY 92 CO 0.53 0.44 0.31 -1.36 0.00 0.00 0.00 176.54 176.46 3kta s PHE 93 N -5.85 3.95 -0.86 5.60 0.40 -1.26 -4.29 117.98 115.67 3kta s PHE 93 Ca -0.11 1.84 -0.08 0.00 -0.60 0.00 0.00 56.93 57.98 3kta s PHE 93 Cb 0.18 -2.94 -0.15 0.00 0.51 0.00 0.00 43.02 40.61 3kta s PHE 93 CO 0.79 0.45 3.02 -0.35 0.70 0.00 0.00 175.22 179.83 3kta n PRO 94 N 1.65 2.72 -3.95 0.24 -0.04 -1.26 -4.74 135.00 129.62 3kta n PRO 94 Ca -0.02 -1.57 -0.15 0.00 -0.04 0.00 0.00 63.50 61.72 3kta n PRO 94 Cb 0.48 -2.40 -0.15 0.00 -0.04 0.00 0.00 33.50 31.38 3kta n PRO 94 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 3kta s ILE 95 N 1.91 0.16 -1.48 0.52 1.01 -1.26 -5.06 121.20 116.99 3kta s ILE 95 Ca 0.62 0.02 -0.10 0.00 0.00 0.00 0.00 60.65 61.19 3kta s ILE 95 Cb 0.22 -0.21 0.02 0.00 0.01 0.00 0.00 42.46 42.50 3kta s ILE 95 CO -0.03 0.10 2.50 -0.67 0.00 0.00 0.00 174.94 176.84 3kta n ASP 96 N 3.67 6.67 -3.80 3.58 2.03 -1.26 -4.84 116.55 122.60 3kta n ASP 96 Ca -0.21 -2.82 -0.13 0.00 0.52 0.00 0.00 54.79 52.16 3kta n ASP 96 Cb 0.54 -1.55 -0.13 0.00 -0.72 0.00 0.00 41.12 39.26 3kta n ASP 96 CO 0.00 0.00 0.00 -1.61 -1.92 0.00 0.00 177.20 173.67 3kta s GLU 97 N 1.71 0.17 0.46 -0.67 0.41 -1.26 -5.04 118.70 114.48 3kta s GLU 97 Ca 0.56 0.26 0.21 0.00 -0.41 0.00 0.00 54.97 55.59 3kta s GLU 97 Cb 0.16 0.04 1.10 0.00 -1.78 0.00 0.00 34.13 33.65 3kta s GLU 97 CO -0.07 -0.05 1.95 -0.44 -0.49 0.00 0.00 175.26 176.17 3kta h ASP 98 N 6.16 0.00 -3.82 -0.19 3.32 -1.88 -3.41 116.42 116.59 3kta h ASP 98 Ca -0.28 0.00 -0.54 0.00 0.02 0.00 0.00 57.03 56.23 3kta h ASP 98 Cb 1.19 0.00 -0.31 0.00 0.22 0.00 0.00 39.33 40.42 3kta h ASP 98 CO 0.41 0.22 -0.83 -0.70 -1.72 0.00 0.00 179.24 176.62 3kta s GLU 99 N -4.16 1.67 -0.19 3.56 2.12 -1.26 0.14 118.70 120.57 3kta s GLU 99 Ca -0.02 -0.54 -0.00 0.00 0.36 0.00 0.00 54.97 54.76 3kta s GLU 99 Cb 0.13 -1.45 0.01 0.00 0.26 0.00 0.00 34.13 33.09 3kta s GLU 99 CO 0.65 0.20 -0.15 0.08 -0.54 0.00 0.00 175.26 175.49 3kta s VAL 100 N 0.14 2.43 -0.18 3.70 1.01 -0.42 -4.91 120.40 122.17 3kta s VAL 100 Ca -0.05 -0.83 -0.01 0.00 0.00 0.00 0.00 61.98 61.09 3kta s VAL 100 Cb -0.12 -2.06 -0.00 0.00 0.00 0.00 0.00 36.38 34.21 3kta s VAL 100 CO 0.02 0.50 -0.12 -0.69 0.00 0.00 0.00 175.10 174.81 3kta s VAL 101 N 1.34 2.86 -0.11 2.92 1.01 -1.26 -0.39 120.40 126.76 3kta s VAL 101 Ca 0.05 -0.69 0.02 0.00 0.00 0.00 0.00 61.98 61.36 3kta s VAL 101 Cb -0.13 -2.24 -0.01 0.00 0.00 0.00 0.00 36.38 34.00 3kta s VAL 101 CO -0.10 0.49 -0.19 -0.63 0.00 0.00 0.00 175.10 174.67 3kta s ILE 102 N 1.05 2.55 -0.06 2.22 1.01 -0.45 -0.63 121.20 126.89 3kta s ILE 102 Ca -0.01 -0.85 0.03 0.00 0.00 0.00 0.00 60.65 59.83 3kta s ILE 102 Cb -0.15 -2.02 0.01 0.00 0.01 0.00 0.00 42.46 40.31 3kta s ILE 102 CO -0.03 0.54 -0.14 -0.60 0.00 0.00 0.00 174.94 174.71 3kta s ARG 103 N 0.28 1.80 -0.07 2.79 3.52 -0.57 -0.53 118.95 126.17 3kta s ARG 103 Ca -0.13 -0.50 0.03 0.00 -0.13 0.00 0.00 55.73 55.00 3kta s ARG 103 Cb -0.17 -1.49 0.01 0.00 -1.56 0.00 0.00 34.95 31.73 3kta s ARG 103 CO 0.07 0.11 -0.16 0.50 -0.81 0.00 0.00 175.30 175.00 3kta s ARG 104 N 0.43 2.05 -0.07 5.12 3.52 -0.11 -1.01 118.95 128.88 3kta s ARG 104 Ca -0.11 -0.58 0.05 0.00 -0.13 0.00 0.00 55.73 54.95 3kta s ARG 104 Cb -0.14 -1.66 -0.00 0.00 -1.56 0.00 0.00 34.95 31.58 3kta s ARG 104 CO 0.04 0.13 -0.21 0.50 -0.81 0.00 0.00 175.30 174.94 3kta s ARG 105 N 0.40 2.40 0.02 5.12 3.52 -0.39 -1.31 118.95 128.71 3kta s ARG 105 Ca -0.12 -0.77 0.09 0.00 -0.13 0.00 0.00 55.73 54.79 3kta s ARG 105 Cb -0.15 -1.96 -0.02 0.00 -1.56 0.00 0.00 34.95 31.25 3kta s ARG 105 CO 0.05 0.25 -0.26 0.54 -0.81 0.00 0.00 175.30 175.07 3kta s VAL 106 N 0.12 2.06 0.29 7.11 0.11 0.40 -1.01 120.40 129.48 3kta s VAL 106 Ca -0.09 -1.25 0.07 0.00 -2.93 0.00 0.00 61.98 57.78 3kta s VAL 106 Cb -0.15 -1.74 -0.03 0.00 -1.53 0.00 0.00 36.38 32.94 3kta s VAL 106 CO 0.05 0.44 0.27 -0.31 -3.33 0.00 0.00 175.10 172.22 3kta s TYR 107 N -0.71 3.05 0.66 1.54 1.51 -0.88 -1.21 117.35 121.31 3kta s TYR 107 Ca 0.11 -0.19 0.37 0.00 -1.01 0.00 0.00 57.07 56.34 3kta s TYR 107 Cb -0.10 -1.63 2.00 0.00 -0.11 0.00 0.00 41.96 42.12 3kta s TYR 107 CO 0.01 0.33 2.14 -1.35 -1.11 0.00 0.00 175.55 175.56 3kta h PRO 108 N 1.32 0.00 -0.00 -1.71 0.11 -1.91 0.37 132.00 130.18 3kta h PRO 108 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 3kta h PRO 108 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 3kta h PRO 108 CO 0.59 0.00 -0.01 -0.40 -0.21 0.00 0.00 178.00 177.97 3kta n ASP 109 N -3.04 0.02 0.00 -2.05 5.75 -1.26 -4.81 116.55 111.16 3kta n ASP 109 Ca -0.02 0.30 0.00 0.00 -0.01 0.00 0.00 54.79 55.06 3kta n ASP 109 Cb 0.24 -0.42 0.00 0.00 -1.03 0.00 0.00 41.12 39.91 3kta n ASP 109 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3kta n GLY 110 N 1.44 0.51 3.81 6.12 0.00 0.13 -5.06 105.19 112.14 3kta n GLY 110 Ca 0.09 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.72 3kta n GLY 110 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3kta s ARG 111 N -0.89 4.24 0.09 1.61 1.70 -1.25 -4.82 118.95 119.62 3kta s ARG 111 Ca 0.00 0.79 0.08 0.00 -0.47 0.00 0.00 55.73 56.13 3kta s ARG 111 Cb 0.00 -3.23 -0.04 0.00 -0.57 0.00 0.00 34.95 31.12 3kta s ARG 111 CO 0.00 0.62 -0.17 0.45 -1.08 0.00 0.00 175.30 175.12 3kta s SER 112 N -1.14 3.92 0.07 -2.89 0.15 -1.26 -2.06 113.70 110.49 3kta s SER 112 Ca 0.30 -0.49 0.07 0.00 0.70 0.00 0.00 55.95 56.54 3kta s SER 112 Cb -0.20 -0.61 -0.04 0.00 -1.71 0.00 0.00 66.02 63.47 3kta s SER 112 CO 0.20 0.21 -0.13 -0.94 1.20 0.00 0.00 173.24 173.77 3kta s SER 113 N -1.88 4.16 0.12 5.45 1.04 -0.18 -4.97 113.70 117.43 3kta s SER 113 Ca 0.17 -0.40 0.08 0.00 0.48 0.00 0.00 55.95 56.28 3kta s SER 113 Cb -0.11 -0.75 -0.04 0.00 0.10 0.00 0.00 66.02 65.23 3kta s SER 113 CO 0.09 0.22 -0.19 -0.31 0.98 0.00 0.00 173.24 174.02 3kta s TYR 114 N -1.08 1.74 0.01 5.02 1.51 -1.24 -1.26 117.35 122.05 3kta s TYR 114 Ca 0.18 -0.44 0.01 0.00 -1.01 0.00 0.00 57.07 55.81 3kta s TYR 114 Cb -0.11 -0.93 -0.01 0.00 -0.11 0.00 0.00 41.96 40.80 3kta s TYR 114 CO 0.10 0.23 -0.04 -1.58 -1.11 0.00 0.00 175.55 173.14 3kta s TRP 115 N -1.44 0.38 -0.20 2.71 0.51 -0.18 -0.78 118.94 119.93 3kta s TRP 115 Ca 0.08 -0.22 0.01 0.00 -2.12 0.00 0.00 56.10 53.86 3kta s TRP 115 Cb -0.09 -0.24 0.04 0.00 -0.81 0.00 0.00 33.47 32.37 3kta s TRP 115 CO 0.05 -0.05 -0.11 -1.17 -0.51 0.00 0.00 176.95 175.16 3kta s LEU 116 N -0.59 2.30 -1.60 2.99 2.96 0.16 -1.52 118.68 123.37 3kta s LEU 116 Ca -0.03 -0.87 -0.18 0.00 -0.22 0.00 0.00 54.13 52.82 3kta s LEU 116 Cb -0.04 -1.27 0.16 0.00 0.50 0.00 0.00 46.19 45.54 3kta s LEU 116 CO -0.00 -0.13 0.66 0.59 -1.32 0.00 0.00 176.35 176.15 3kta n ASN 117 N 4.67 -2.88 0.00 3.68 3.02 0.19 -1.20 115.26 122.75 3kta n ASN 117 Ca -0.15 -0.90 0.00 0.00 -0.03 0.00 0.00 54.58 53.50 3kta n ASN 117 Cb 0.47 -2.40 0.00 0.00 -0.61 0.00 0.00 39.78 37.24 3kta n ASN 117 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3kta n GLY 118 N -1.22 1.05 3.80 7.41 0.00 -1.26 -5.03 105.19 109.93 3kta n GLY 118 Ca 0.07 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.73 3kta n GLY 118 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3kta s ARG 119 N -0.32 3.91 0.24 1.61 1.81 -0.34 -5.04 118.95 120.81 3kta s ARG 119 Ca 0.00 0.03 -0.31 0.00 -1.72 0.00 0.00 55.73 53.72 3kta s ARG 119 Cb 0.00 -3.31 -0.13 0.00 -0.45 0.00 0.00 34.95 31.06 3kta s ARG 119 CO 0.00 0.51 1.48 -2.13 -0.68 0.00 0.00 175.30 174.49 3kta n ARG 120 N 2.71 2.22 -4.26 3.54 3.00 -1.26 -0.67 116.66 121.94 3kta n ARG 120 Ca -0.16 0.79 -0.15 0.00 -0.00 0.00 0.00 57.85 58.34 3kta n ARG 120 Cb 0.53 -2.50 -0.10 0.00 0.00 0.00 0.00 32.46 30.39 3kta n ARG 120 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 3kta s ALA 121 N 0.13 1.51 0.31 5.13 0.00 0.04 -4.80 121.76 124.07 3kta s ALA 121 Ca 0.69 -1.78 0.09 0.00 0.00 0.00 0.00 51.96 50.95 3kta s ALA 121 Cb -0.61 1.25 -0.04 0.00 0.00 0.00 0.00 23.12 23.71 3kta s ALA 121 CO 0.47 -0.54 0.10 0.95 0.00 0.00 0.00 175.76 176.74 3kta s THR 122 N -3.90 3.27 0.27 0.00 -4.23 -1.26 -3.66 115.64 106.12 3kta s THR 122 Ca 0.38 -1.75 -0.00 0.00 -1.18 0.00 0.00 61.69 59.14 3kta s THR 122 Cb 0.07 -2.96 0.26 0.00 1.34 0.00 0.00 72.50 71.21 3kta s THR 122 CO 0.14 -0.26 1.83 -0.09 -0.54 0.00 0.00 174.62 175.70 3kta h ARG 123 N 1.66 0.90 -0.49 3.99 2.43 -1.96 -1.30 114.38 119.61 3kta h ARG 123 Ca -0.44 -0.05 0.08 0.00 -0.81 0.00 0.00 59.98 58.76 3kta h ARG 123 Cb 1.25 -0.20 -0.07 0.00 -0.42 0.00 0.00 29.97 30.53 3kta h ARG 123 CO 0.62 0.60 0.10 1.03 -1.51 0.00 0.00 179.97 180.81 3kta h SER 124 N 0.93 0.01 -0.50 -3.80 0.87 -1.99 0.19 113.55 109.25 3kta h SER 124 Ca 0.47 0.09 -0.08 0.00 -1.23 0.00 0.00 61.79 61.03 3kta h SER 124 Cb 0.46 0.12 -0.02 0.00 -0.44 0.00 0.00 62.40 62.51 3kta h SER 124 CO -0.26 0.03 -0.00 -0.33 -0.53 0.00 0.00 176.83 175.74 3kta h GLU 125 N 0.24 0.93 -0.29 2.24 5.08 -1.67 -2.13 114.58 118.98 3kta h GLU 125 Ca 0.24 -0.27 -0.04 0.00 -1.00 0.00 0.00 59.36 58.29 3kta h GLU 125 Cb 0.32 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.46 3kta h GLU 125 CO -0.31 0.92 0.04 0.82 -1.00 0.00 0.00 179.01 179.47 3kta h ILE 126 N 0.86 1.24 -0.72 3.13 1.08 -0.64 -1.99 117.51 120.46 3kta h ILE 126 Ca 0.16 -0.83 -0.03 0.00 -0.39 0.00 0.00 64.86 63.78 3kta h ILE 126 Cb 0.51 1.22 -0.03 0.00 -3.07 0.00 0.00 36.82 35.44 3kta h ILE 126 CO 0.02 0.27 0.34 -0.07 -0.69 0.00 0.00 178.15 178.03 3kta h LEU 127 N 0.30 0.93 -0.29 1.44 3.38 -0.85 -1.03 115.31 119.18 3kta h LEU 127 Ca 0.09 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.96 3kta h LEU 127 Cb 0.36 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 3kta h LEU 127 CO 0.01 0.79 0.19 0.44 0.09 0.00 0.00 178.44 179.96 3kta h ASP 128 N 1.02 0.33 -0.51 -0.43 3.32 -1.13 0.28 116.42 119.29 3kta h ASP 128 Ca 0.25 -0.01 -0.06 0.00 0.02 0.00 0.00 57.03 57.23 3kta h ASP 128 Cb 0.11 -0.08 -0.02 0.00 0.22 0.00 0.00 39.33 39.56 3kta h ASP 128 CO -0.03 0.24 0.09 0.40 -1.72 0.00 0.00 179.24 178.21 3kta h ILE 129 N 0.39 1.25 -0.39 0.35 1.08 -1.03 -1.98 117.51 117.18 3kta h ILE 129 Ca 0.11 -0.93 -0.03 0.00 -0.39 0.00 0.00 64.86 63.61 3kta h ILE 129 Cb -0.04 0.86 -0.02 0.00 -3.07 0.00 0.00 36.82 34.55 3kta h ILE 129 CO -0.03 0.33 0.12 -0.07 -0.69 0.00 0.00 178.15 177.82 3kta h LEU 130 N 0.73 0.56 -0.84 1.44 3.38 -1.04 -2.46 115.31 117.08 3kta h LEU 130 Ca 0.16 -0.21 0.07 0.00 0.09 0.00 0.00 57.88 57.99 3kta h LEU 130 Cb 0.39 -0.15 -0.06 0.00 0.09 0.00 0.00 40.66 40.93 3kta h LEU 130 CO 0.01 0.62 0.51 0.74 0.09 0.00 0.00 178.44 180.41 3kta h THR 131 N 0.48 1.00 -0.08 0.22 2.02 -0.74 0.13 112.91 115.94 3kta h THR 131 Ca 0.12 -0.31 -0.02 0.00 0.77 0.00 0.00 66.41 66.97 3kta h THR 131 Cb 0.26 0.01 -0.01 0.00 -1.74 0.00 0.00 68.15 66.67 3kta h THR 131 CO -0.00 0.17 -0.03 0.00 0.37 0.00 0.00 175.52 176.02 3kta h ALA 132 N 1.42 1.80 0.00 6.16 0.00 -1.10 -3.38 119.26 124.16 3kta h ALA 132 Ca 0.38 -0.08 -0.16 0.00 0.00 0.00 0.00 54.91 55.05 3kta h ALA 132 Cb 0.23 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 3kta h ALA 132 CO -0.19 0.15 -1.14 0.00 0.00 0.00 0.00 179.25 178.07 3kta n ALA 133 N -2.51 0.73 0.00 0.00 0.00 -0.25 -4.88 120.51 113.60 3kta n ALA 133 Ca -0.02 -0.58 0.00 0.00 0.00 0.00 0.00 53.44 52.84 3kta n ALA 133 Cb 0.15 -0.20 0.00 0.00 0.00 0.00 0.00 19.45 19.40 3kta n ALA 133 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 3kta n ILE 135 N -4.48 0.00 -3.62 0.00 5.41 0.28 -4.93 119.36 112.02 3kta n ILE 135 Ca -0.24 0.00 -0.16 0.00 1.00 0.00 0.00 62.75 63.35 3kta n ILE 135 Cb 0.54 0.00 -0.07 0.00 -0.71 0.00 0.00 39.64 39.40 3kta n ILE 135 CO 0.00 0.00 0.00 -0.94 0.00 0.00 0.00 176.55 175.61 3kta s SER 136 N 0.00 -0.54 0.60 4.38 1.04 -1.26 -2.73 113.70 115.18 3kta s SER 136 Ca 0.00 0.71 0.35 0.00 0.48 0.00 0.00 55.95 57.48 3kta s SER 136 Cb 0.00 0.68 1.91 0.00 0.10 0.00 0.00 66.02 68.71 3kta s SER 136 CO 0.00 -0.46 2.23 1.55 0.98 0.00 0.00 173.24 177.54 3kta h PRO 137 N 3.80 0.00 -0.34 4.02 0.13 -1.90 -1.96 132.00 135.76 3kta h PRO 137 Ca -0.28 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.79 3kta h PRO 137 Cb 1.16 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.25 3kta h PRO 137 CO 0.32 0.03 0.02 -0.40 -0.23 0.00 0.00 178.00 177.74 3kta n ASP 138 N -3.49 3.75 -4.78 1.44 5.68 -1.26 -4.94 116.55 112.95 3kta n ASP 138 Ca -0.02 -3.19 -0.32 0.00 -0.50 0.00 0.00 54.79 50.75 3kta n ASP 138 Cb 0.13 -0.59 0.06 0.00 -1.14 0.00 0.00 41.12 39.58 3kta n ASP 138 CO 0.00 0.00 0.00 -0.83 -1.33 0.00 0.00 177.20 175.04 3kta s GLY 139 N -1.94 1.92 0.39 6.12 0.00 -0.74 -4.91 107.32 108.16 3kta s GLY 139 Ca 0.44 0.38 0.27 0.00 0.00 0.00 0.00 44.72 45.82 3kta s GLY 139 CO 0.08 0.72 1.83 0.10 0.00 0.00 0.00 173.10 175.83 3kta h TYR 140 N -0.44 0.00 -0.00 1.90 -0.00 -1.96 -2.71 116.97 113.76 3kta h TYR 140 Ca -0.45 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.28 3kta h TYR 140 Cb 1.23 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.96 3kta h TYR 140 CO 0.57 0.00 -0.10 0.27 -0.00 0.00 0.00 178.16 178.90 3kta n ASN 141 N -2.49 0.46 -4.30 0.10 6.94 -1.26 -4.60 115.26 110.11 3kta n ASN 141 Ca -0.00 -0.60 -0.35 0.00 -0.02 0.00 0.00 54.58 53.60 3kta n ASN 141 Cb 0.13 -0.08 -0.14 0.00 -2.36 0.00 0.00 39.78 37.34 3kta n ASN 141 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 3kta s ILE 142 N -2.44 3.33 -0.30 1.53 1.01 -1.02 -5.08 121.20 118.23 3kta s ILE 142 Ca 0.30 -0.54 0.02 0.00 0.00 0.00 0.00 60.65 60.43 3kta s ILE 142 Cb 0.20 -2.53 0.07 0.00 0.01 0.00 0.00 42.46 40.21 3kta s ILE 142 CO 0.47 0.40 -0.02 -0.69 0.00 0.00 0.00 174.94 175.09 3kta s VAL 143 N 1.47 2.43 0.73 2.92 1.01 -1.26 -4.89 120.40 122.80 3kta s VAL 143 Ca 0.05 -1.82 -0.11 0.00 0.00 0.00 0.00 61.98 60.10 3kta s VAL 143 Cb -0.14 -2.54 0.03 0.00 0.00 0.00 0.00 36.38 33.72 3kta s VAL 143 CO -0.03 -0.25 1.08 -0.76 0.00 0.00 0.00 175.10 175.14 3kta s LEU 144 N 1.08 2.88 0.13 3.92 1.43 -1.26 -4.93 118.68 121.92 3kta s LEU 144 Ca -0.02 1.34 -0.34 0.00 -1.03 0.00 0.00 54.13 54.08 3kta s LEU 144 Cb -0.20 -4.11 -0.13 0.00 0.03 0.00 0.00 46.19 41.78 3kta s LEU 144 CO -0.05 -1.54 1.63 1.67 0.23 0.00 0.00 176.35 178.29 3kta n GLN 145 N -3.16 2.20 -1.04 1.70 7.27 -1.26 -1.28 117.38 121.81 3kta n GLN 145 Ca 0.07 0.80 -0.02 0.00 0.07 0.00 0.00 57.00 57.92 3kta n GLN 145 Cb 0.56 -2.58 -0.01 0.00 2.41 0.00 0.00 30.24 30.62 3kta n GLN 145 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 3kta n GLY 146 N 3.60 0.41 0.43 1.69 0.00 -1.26 -4.90 105.19 105.17 3kta n GLY 146 Ca 0.18 -0.10 0.04 0.00 0.00 0.00 0.00 46.02 46.14 3kta n GLY 146 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3kta n ASP 147 N -0.29 2.71 0.29 1.61 2.03 -0.40 -4.65 116.55 117.86 3kta n ASP 147 Ca -0.02 -2.19 0.14 0.00 0.52 0.00 0.00 54.79 53.24 3kta n ASP 147 Cb 0.23 -0.21 0.87 0.00 -0.72 0.00 0.00 41.12 41.30 3kta n ASP 147 CO 0.00 0.00 0.00 -0.29 -1.92 0.00 0.00 177.20 174.99 3kta h ILE 148 N 1.23 0.59 0.00 5.18 6.09 -1.91 -0.16 117.51 128.53 3kta h ILE 148 Ca 0.00 -0.04 0.00 0.00 -1.37 0.00 0.00 64.86 63.45 3kta h ILE 148 Cb 0.76 1.02 0.00 0.00 0.47 0.00 0.00 36.82 39.07 3kta h ILE 148 CO 0.03 0.01 0.00 0.35 -3.07 0.00 0.00 178.15 175.47 3kta n THR 149 N -3.91 0.17 0.00 2.19 -2.24 -1.26 -3.15 114.28 106.07 3kta n THR 149 Ca -0.03 0.04 0.17 0.00 -2.27 0.00 0.00 64.05 61.96 3kta n THR 149 Cb 0.09 -0.69 0.63 0.00 -2.10 0.00 0.00 70.33 68.26 3kta n THR 149 CO 0.00 0.00 0.00 0.07 -0.57 0.00 0.00 175.07 174.57 3kta h LYS 150 N 0.00 0.11 0.00 -0.78 2.10 -1.38 0.15 116.57 116.77 3kta h LYS 150 Ca 0.00 -0.01 -0.02 0.00 -2.00 0.00 0.00 60.65 58.63 3kta h LYS 150 Cb 0.10 -0.02 -0.00 0.00 -0.90 0.00 0.00 32.23 31.40 3kta h LYS 150 CO 0.00 0.07 -0.08 0.74 -2.00 0.00 0.00 179.45 178.18 3kta h PHE 151 N 0.11 0.00 0.07 0.07 0.04 -1.79 -3.05 116.94 112.39 3kta h PHE 151 Ca 0.24 0.00 -0.28 0.00 2.80 0.00 0.00 57.97 60.73 3kta h PHE 151 Cb 0.79 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.92 3kta h PHE 151 CO -0.00 0.08 -1.44 0.82 -0.60 0.00 0.00 178.31 177.17 3kta h ILE 152 N 0.00 1.23 -1.67 -0.55 1.08 -1.02 -3.49 117.51 113.08 3kta h ILE 152 Ca -0.00 -2.93 -0.77 0.00 -0.39 0.00 0.00 64.86 60.78 3kta h ILE 152 Cb 0.94 2.71 -0.18 0.00 -3.07 0.00 0.00 36.82 37.22 3kta h ILE 152 CO 0.01 0.79 1.80 0.29 -0.69 0.00 0.00 178.15 180.35 3kta n LYS 153 N -3.35 3.88 -4.15 2.37 5.02 -0.02 -5.08 118.16 116.84 3kta n LYS 153 Ca -0.13 -3.74 -0.25 0.00 -2.02 0.00 0.00 58.31 52.17 3kta n LYS 153 Cb 1.02 -2.82 -0.06 0.00 -0.02 0.00 0.00 35.03 33.15 3kta n LYS 153 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 3kta s SER 155 N 0.26 5.17 0.38 4.39 1.04 -1.26 -5.08 113.70 118.59 3kta s SER 155 Ca 0.39 -0.29 0.10 0.00 0.48 0.00 0.00 55.95 56.63 3kta s SER 155 Cb 0.09 -1.23 0.86 0.00 0.10 0.00 0.00 66.02 65.85 3kta s SER 155 CO 0.02 0.05 1.91 -0.65 0.98 0.00 0.00 173.24 175.55 3kta h PRO 156 N 2.34 0.61 -0.14 4.02 0.11 -1.99 -0.30 132.00 136.65 3kta h PRO 156 Ca -0.47 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 65.59 3kta h PRO 156 Cb 1.21 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 32.18 3kta h PRO 156 CO 0.61 0.40 0.05 1.25 -0.21 0.00 0.00 178.00 180.10 3kta h LEU 157 N 0.63 0.19 -0.94 2.35 5.85 -2.02 -1.35 115.31 120.01 3kta h LEU 157 Ca 0.38 -0.17 0.05 0.00 0.84 0.00 0.00 57.88 58.98 3kta h LEU 157 Cb 0.62 -0.05 -0.06 0.00 0.37 0.00 0.00 40.66 41.54 3kta h LEU 157 CO -0.15 0.31 0.61 -0.33 -0.34 0.00 0.00 178.44 178.54 3kta h GLU 158 N 0.06 1.12 -0.68 1.25 5.08 -1.76 -1.09 114.58 118.56 3kta h GLU 158 Ca 0.04 -0.07 -0.07 0.00 -1.00 0.00 0.00 59.36 58.27 3kta h GLU 158 Cb 0.18 -0.25 -0.03 0.00 0.50 0.00 0.00 28.75 29.15 3kta h GLU 158 CO -0.00 0.74 0.16 -0.09 -1.00 0.00 0.00 179.01 178.82 3kta h ARG 159 N 1.15 1.09 -0.37 2.33 2.43 -0.87 -2.36 114.38 117.79 3kta h ARG 159 Ca 0.39 -0.26 -0.14 0.00 -0.81 0.00 0.00 59.98 59.16 3kta h ARG 159 Cb 0.07 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.47 3kta h ARG 159 CO -0.14 0.97 -0.32 -0.09 -1.51 0.00 0.00 179.97 178.88 3kta h ARG 160 N 1.03 0.83 -0.43 0.20 2.43 -0.60 -2.55 114.38 115.28 3kta h ARG 160 Ca 0.21 -0.40 0.07 0.00 -0.81 0.00 0.00 59.98 59.06 3kta h ARG 160 Cb 0.37 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.89 3kta h ARG 160 CO 0.00 1.03 0.29 -0.07 -1.51 0.00 0.00 179.97 179.71 3kta h LEU 161 N 0.70 0.24 -0.44 3.80 -0.00 -0.95 0.32 115.31 118.99 3kta h LEU 161 Ca 0.07 0.00 -0.04 0.00 -0.00 0.00 0.00 57.88 57.91 3kta h LEU 161 Cb 0.88 -0.05 -0.02 0.00 -0.00 0.00 0.00 40.66 41.47 3kta h LEU 161 CO 0.08 0.16 0.11 0.25 -0.00 0.00 0.00 178.44 179.04 3kta h LEU 162 N 0.28 0.66 -0.76 1.67 5.85 -1.01 -0.56 115.31 121.43 3kta h LEU 162 Ca 0.19 -0.23 -0.11 0.00 0.84 0.00 0.00 57.88 58.57 3kta h LEU 162 Cb 0.40 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.24 3kta h LEU 162 CO -0.04 0.71 -0.26 0.40 -0.34 0.00 0.00 178.44 178.92 3kta h ILE 163 N 0.57 1.27 -0.56 4.05 1.08 -1.02 -1.53 117.51 121.37 3kta h ILE 163 Ca 0.14 -1.35 0.11 0.00 -0.39 0.00 0.00 64.86 63.37 3kta h ILE 163 Cb 0.31 1.30 -0.09 0.00 -3.07 0.00 0.00 36.82 35.27 3kta h ILE 163 CO 0.00 0.44 0.04 0.44 -0.69 0.00 0.00 178.15 178.38 3kta h ASP 164 N 0.57 -0.16 -0.12 1.72 5.19 -0.05 -1.16 116.42 122.40 3kta h ASP 164 Ca 0.08 0.13 -0.01 0.00 -0.62 0.00 0.00 57.03 56.60 3kta h ASP 164 Cb 0.74 0.21 -0.00 0.00 0.18 0.00 0.00 39.33 40.46 3kta h ASP 164 CO 0.06 -0.06 0.02 -0.78 -3.12 0.00 0.00 179.24 175.36 3kta h ASP 165 N 0.16 0.19 -0.97 6.45 3.58 -0.70 -2.81 116.42 122.32 3kta h ASP 165 Ca 0.29 -0.25 0.09 0.00 0.42 0.00 0.00 57.03 57.59 3kta h ASP 165 Cb 0.45 -0.05 -0.07 0.00 1.72 0.00 0.00 39.33 41.38 3kta h ASP 165 CO -0.44 0.39 0.62 0.40 -2.88 0.00 0.00 179.24 177.33 3kta h ILE 166 N -0.01 1.00 0.00 2.25 1.08 -0.99 -2.29 117.51 118.55 3kta h ILE 166 Ca 0.04 -0.36 -0.03 0.00 -0.39 0.00 0.00 64.86 64.12 3kta h ILE 166 Cb 0.27 -0.13 -0.00 0.00 -3.07 0.00 0.00 36.82 33.89 3kta h ILE 166 CO 0.00 0.19 -0.13 0.77 -0.69 0.00 0.00 178.15 178.29 3kta h SER 167 N 1.04 0.00 0.00 1.72 4.64 -1.08 -3.47 113.55 116.40 3kta h SER 167 Ca 0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.77 3kta h SER 167 Cb 0.33 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.42 3kta h SER 167 CO -0.20 0.13 0.00 0.61 -0.87 0.00 0.00 176.83 176.50 3kta n GLY 168 N 0.49 0.72 0.00 -0.77 0.00 -0.86 -5.11 105.19 99.66 3kta n GLY 168 Ca 0.01 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.06 3kta n GLY 168 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61