#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kop h LEU -4 N 0.00 0.24 -2.16 1.20 5.85 -2.09 -3.48 115.31 114.87 3kop h LEU -4 Ca 0.00 -0.31 -0.40 0.00 0.84 0.00 0.00 57.88 58.01 3kop h LEU -4 Cb 0.00 -0.08 0.08 0.00 0.37 0.00 0.00 40.66 41.03 3kop h LEU -4 CO 0.00 1.25 -0.86 -1.22 -0.34 0.00 0.00 178.44 177.28 3kop n TYR -3 N -3.38 -1.98 -1.96 1.25 4.01 -1.26 -4.90 117.16 108.94 3kop n TYR -3 Ca -0.11 0.76 -0.41 0.00 -0.16 0.00 0.00 57.90 57.99 3kop n TYR -3 Cb 1.01 -4.17 -0.02 0.00 -0.31 0.00 0.00 39.34 35.86 3kop n TYR -3 CO 0.00 0.00 0.00 0.12 -0.46 0.00 0.00 176.86 176.52 3kop s PHE -2 N -3.59 2.88 -0.24 -0.72 5.36 -1.26 -5.02 117.98 115.39 3kop s PHE -2 Ca 0.16 1.15 0.02 0.00 -0.96 0.00 0.00 56.93 57.30 3kop s PHE -2 Cb -0.04 -3.86 0.05 0.00 -0.34 0.00 0.00 43.02 38.83 3kop s PHE -2 CO 0.81 -2.61 -0.12 -0.65 -1.46 0.00 0.00 175.22 171.19 3kop s GLN -1 N -1.28 2.30 -0.28 10.12 -1.52 -1.26 -5.23 119.66 122.51 3kop s GLN -1 Ca 0.55 -1.17 0.06 0.00 -1.95 0.00 0.00 55.36 52.85 3kop s GLN -1 Cb -0.43 -2.75 0.55 0.00 -0.22 0.00 0.00 33.01 30.15 3kop s GLN -1 CO 0.52 -0.49 1.60 0.41 -0.25 0.00 0.00 175.29 177.08 3kop n GLY 0 N 4.51 3.40 3.72 3.09 0.00 -1.26 -4.95 105.19 113.70 3kop n GLY 0 Ca -0.15 -0.77 -0.37 0.00 0.00 0.00 0.00 46.02 44.73 3kop n GLY 0 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kop s ALA 2 N -2.43 3.59 0.08 4.61 0.00 -1.26 -5.24 121.76 121.11 3kop s ALA 2 Ca 0.42 -0.48 0.06 0.00 0.00 0.00 0.00 51.96 51.96 3kop s ALA 2 Cb 0.34 -2.41 -0.04 0.00 0.00 0.00 0.00 23.12 21.01 3kop s ALA 2 CO 0.10 0.04 -0.06 1.03 0.00 0.00 0.00 175.76 176.87 3kop s ARG 3 N 0.59 2.36 0.03 0.00 0.52 -1.26 -5.05 118.95 116.13 3kop s ARG 3 Ca 0.16 -0.90 0.05 0.00 -0.52 0.00 0.00 55.73 54.52 3kop s ARG 3 Cb -0.13 -2.43 -0.02 0.00 0.52 0.00 0.00 34.95 32.89 3kop s ARG 3 CO 0.04 0.54 -0.15 0.71 0.02 0.00 0.00 175.30 176.45 3kop s TYR 4 N -1.22 1.36 0.10 -0.53 2.02 -1.26 -0.63 117.35 117.19 3kop s TYR 4 Ca 0.22 -0.33 0.08 0.00 -0.37 0.00 0.00 57.07 56.67 3kop s TYR 4 Cb -0.11 -0.83 -0.04 0.00 -0.40 0.00 0.00 41.96 40.58 3kop s TYR 4 CO 0.14 0.03 -0.16 0.96 -1.57 0.00 0.00 175.55 174.95 3kop s ILE 5 N -0.71 2.96 0.04 2.71 -4.36 0.07 -1.25 121.20 120.67 3kop s ILE 5 Ca 0.04 -1.37 -0.07 0.00 -0.26 0.00 0.00 60.65 58.98 3kop s ILE 5 Cb -0.07 -2.34 -0.05 0.00 1.25 0.00 0.00 42.46 41.25 3kop s ILE 5 CO 0.01 0.16 0.32 0.20 0.24 0.00 0.00 174.94 175.86 3kop s ASN 6 N -1.99 6.53 -0.12 4.36 0.01 0.64 -0.51 114.94 123.85 3kop s ASN 6 Ca 0.18 0.62 -0.01 0.00 -0.71 0.00 0.00 52.86 52.94 3kop s ASN 6 Cb -0.11 -2.11 0.04 0.00 0.41 0.00 0.00 41.25 39.48 3kop s ASN 6 CO 0.10 0.21 -0.02 -0.63 -1.51 0.00 0.00 177.10 175.24 3kop s ILE 7 N -1.37 0.71 -0.04 0.60 1.01 0.41 -1.30 121.20 121.21 3kop s ILE 7 Ca 0.31 -0.25 0.03 0.00 0.00 0.00 0.00 60.65 60.73 3kop s ILE 7 Cb -0.13 -0.90 0.01 0.00 0.01 0.00 0.00 42.46 41.45 3kop s ILE 7 CO 0.18 0.18 -0.11 -0.89 0.00 0.00 0.00 174.94 174.30 3kop s THR 8 N 1.82 0.95 -0.36 2.92 2.01 -0.45 -0.53 115.64 122.01 3kop s THR 8 Ca 0.03 -0.42 -0.17 0.00 0.31 0.00 0.00 61.69 61.44 3kop s THR 8 Cb -0.14 -0.86 -0.00 0.00 0.01 0.00 0.00 72.50 71.51 3kop s THR 8 CO -0.07 0.30 0.45 -0.76 -0.69 0.00 0.00 174.62 173.86 3kop s LEU 9 N 0.38 4.46 0.04 4.42 1.43 0.78 -0.85 118.68 129.34 3kop s LEU 9 Ca -0.07 -0.21 -0.22 0.00 -1.03 0.00 0.00 54.13 52.60 3kop s LEU 9 Cb -0.12 -2.48 -0.14 0.00 0.03 0.00 0.00 46.19 43.48 3kop s LEU 9 CO 0.02 -0.46 1.40 -0.33 0.23 0.00 0.00 176.35 177.21 3kop h GLU 10 N 8.52 0.25 0.23 1.70 4.39 -1.61 0.13 114.58 128.18 3kop h GLU 10 Ca -0.28 -0.10 -0.01 0.00 0.34 0.00 0.00 59.36 59.31 3kop h GLU 10 Cb 1.13 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.77 3kop h GLU 10 CO 0.75 0.57 -0.11 -0.22 -1.16 0.00 0.00 179.01 178.84 3kop h LYS 11 N -0.09 -0.30 0.00 2.33 3.64 -1.81 -3.02 116.57 117.32 3kop h LYS 11 Ca 0.03 0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.42 3kop h LYS 11 Cb 0.49 0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 32.38 3kop h LYS 11 CO 0.02 0.05 -0.04 0.00 -2.27 0.00 0.00 179.45 177.21 3kop h ARG 12 N -0.71 0.00 -4.04 1.90 3.08 -1.94 -3.47 114.38 109.20 3kop h ARG 12 Ca -0.03 0.00 -0.23 0.00 0.07 0.00 0.00 59.98 59.79 3kop h ARG 12 Cb 0.49 0.00 0.09 0.00 0.08 0.00 0.00 29.97 30.63 3kop h ARG 12 CO 0.05 0.04 -0.43 0.41 -1.07 0.00 0.00 179.97 178.97 3kop n GLY 13 N -0.50 0.01 3.21 0.04 0.00 0.40 -5.04 105.19 103.32 3kop n GLY 13 Ca -0.01 -0.12 -0.31 0.00 0.00 0.00 0.00 46.02 45.58 3kop n GLY 13 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3kop s VAL 14 N -3.20 1.98 -0.00 1.61 1.01 -0.91 -4.97 120.40 115.91 3kop s VAL 14 Ca 0.22 -0.98 0.05 0.00 0.00 0.00 0.00 61.98 61.27 3kop s VAL 14 Cb -0.10 -1.71 -0.01 0.00 0.00 0.00 0.00 36.38 34.56 3kop s VAL 14 CO 0.44 0.54 -0.17 -0.89 0.00 0.00 0.00 175.10 175.02 3kop s THR 15 N 0.27 1.35 0.34 3.92 2.01 -1.26 -0.16 115.64 122.12 3kop s THR 15 Ca -0.16 -0.79 0.05 0.00 0.31 0.00 0.00 61.69 61.10 3kop s THR 15 Cb -0.17 -1.14 -0.07 0.00 0.01 0.00 0.00 72.50 71.14 3kop s THR 15 CO 0.08 0.33 0.03 0.00 -0.69 0.00 0.00 174.62 174.36 3kop s LYS 17 N -3.81 1.94 0.00 0.00 2.20 -0.52 -0.45 119.74 119.11 3kop s LYS 17 Ca 0.35 -0.72 0.05 0.00 -0.36 0.00 0.00 55.97 55.29 3kop s LYS 17 Cb 0.08 -1.73 -0.02 0.00 -1.51 0.00 0.00 37.83 34.66 3kop s LYS 17 CO 0.16 0.34 -0.17 0.00 -0.36 0.00 0.00 175.35 175.32 3kop s ALA 18 N -0.18 1.41 0.09 3.13 0.00 0.33 -0.68 121.76 125.87 3kop s ALA 18 Ca -0.00 -0.78 -0.30 0.00 0.00 0.00 0.00 51.96 50.88 3kop s ALA 18 Cb -0.11 -0.33 -0.06 0.00 0.00 0.00 0.00 23.12 22.62 3kop s ALA 18 CO 0.02 0.33 1.17 -1.17 0.00 0.00 0.00 175.76 176.11 3kop s LEU 19 N -0.60 4.40 -0.06 0.00 2.96 0.23 -0.75 118.68 124.86 3kop s LEU 19 Ca 0.06 2.04 -0.24 0.00 -0.22 0.00 0.00 54.13 55.77 3kop s LEU 19 Cb -0.07 -3.59 -0.04 0.00 0.50 0.00 0.00 46.19 43.00 3kop s LEU 19 CO -0.00 -0.41 0.72 -0.22 -1.32 0.00 0.00 176.35 175.12 3kop s LEU 20 N 0.71 4.32 -1.41 -0.68 2.96 0.19 -1.16 118.68 123.61 3kop s LEU 20 Ca 0.56 1.22 -0.08 0.00 -0.22 0.00 0.00 54.13 55.61 3kop s LEU 20 Cb -0.29 -3.12 0.07 0.00 0.50 0.00 0.00 46.19 43.34 3kop s LEU 20 CO 0.31 -0.13 2.41 0.18 -1.32 0.00 0.00 176.35 177.80 3kop n LEU 21 N 3.83 7.82 0.25 -0.68 4.77 0.57 -4.60 117.00 128.95 3kop n LEU 21 Ca -0.01 -4.62 0.11 0.00 -0.03 0.00 0.00 56.01 51.47 3kop n LEU 21 Cb 0.51 -1.47 0.73 0.00 -2.33 0.00 0.00 43.42 40.86 3kop n LEU 21 CO 0.47 1.82 1.10 0.44 -1.33 0.00 0.00 177.39 179.89 3kop h ASP 22 N 5.10 0.00 0.15 -1.43 3.32 -1.83 0.33 116.42 122.06 3kop h ASP 22 Ca 0.67 0.00 -0.29 0.00 0.02 0.00 0.00 57.03 57.43 3kop h ASP 22 Cb 0.40 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.96 3kop h ASP 22 CO 1.64 0.00 -1.46 0.44 -1.72 0.00 0.00 179.24 178.14 3kop h ASP 23 N 0.00 0.48 0.59 6.45 3.32 -1.93 -3.24 116.42 122.09 3kop h ASP 23 Ca 0.02 -0.89 0.00 0.00 0.02 0.00 0.00 57.03 56.18 3kop h ASP 23 Cb 0.09 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 39.48 3kop h ASP 23 CO -0.00 1.65 -1.23 1.33 -1.72 0.00 0.00 179.24 179.28 3kop n VAL 24 N -3.83 0.33 -3.10 -1.35 0.24 -1.19 -4.43 118.33 105.00 3kop n VAL 24 Ca -0.23 -0.43 -0.22 0.00 -2.04 0.00 0.00 64.34 61.41 3kop n VAL 24 Cb 0.96 -0.08 -0.04 0.00 -1.47 0.00 0.00 33.84 33.20 3kop n VAL 24 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3kop n ALA 25 N -2.08 3.22 -0.22 2.33 0.00 0.12 -4.39 120.51 119.49 3kop n ALA 25 Ca -0.00 -4.00 -0.08 0.00 0.00 0.00 0.00 53.44 49.36 3kop n ALA 25 Cb 0.52 -0.84 0.03 0.00 0.00 0.00 0.00 19.45 19.15 3kop n ALA 25 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 3kop h PRO 26 N 3.09 0.95 -0.18 0.00 0.13 -1.65 -1.17 132.00 133.17 3kop h PRO 26 Ca 0.11 -0.20 -0.05 0.00 -0.87 0.00 0.00 66.00 64.99 3kop h PRO 26 Cb 0.76 -0.14 -0.00 0.00 0.13 0.00 0.00 31.00 31.75 3kop h PRO 26 CO 0.64 0.84 -0.09 0.00 -0.23 0.00 0.00 178.00 179.17 3kop h ARG 27 N 0.87 0.37 -0.26 0.86 3.08 -1.92 -2.14 114.38 115.25 3kop h ARG 27 Ca 0.20 -0.17 -0.02 0.00 0.07 0.00 0.00 59.98 60.06 3kop h ARG 27 Cb 0.29 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.32 3kop h ARG 27 CO -0.01 0.68 0.08 1.15 -1.07 0.00 0.00 179.97 180.81 3kop h THR 28 N 0.06 1.20 -0.60 2.04 2.02 -1.90 -0.96 112.91 114.77 3kop h THR 28 Ca 0.04 -0.63 0.07 0.00 0.77 0.00 0.00 66.41 66.66 3kop h THR 28 Cb 0.57 1.12 -0.06 0.00 -1.74 0.00 0.00 68.15 68.05 3kop h THR 28 CO 0.03 0.21 0.27 0.28 0.37 0.00 0.00 175.52 176.68 3kop h SER 29 N 0.25 0.35 0.03 4.18 0.02 -1.20 -0.55 113.55 116.63 3kop h SER 29 Ca 0.08 0.05 -0.00 0.00 -0.84 0.00 0.00 61.79 61.09 3kop h SER 29 Cb 0.24 -0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.78 3kop h SER 29 CO -0.00 0.22 -0.01 0.50 -1.14 0.00 0.00 176.83 176.40 3kop h LYS 30 N 0.50 -0.03 -0.58 3.45 3.64 -1.30 0.16 116.57 122.40 3kop h LYS 30 Ca 0.29 0.00 0.10 0.00 -1.27 0.00 0.00 60.65 59.77 3kop h LYS 30 Cb 0.27 0.01 -0.08 0.00 -0.41 0.00 0.00 32.23 32.03 3kop h LYS 30 CO -0.24 0.27 0.17 0.00 -2.27 0.00 0.00 179.45 177.39 3kop h ALA 31 N 0.62 0.72 0.16 5.00 0.00 -0.83 -0.01 119.26 124.91 3kop h ALA 31 Ca -0.00 0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 3kop h ALA 31 Cb 0.32 0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.22 3kop h ALA 31 CO 0.01 -0.25 -0.08 0.28 0.00 0.00 0.00 179.25 179.21 3kop h VAL 32 N 0.33 0.98 -0.50 0.00 2.07 -1.08 -3.21 116.25 114.85 3kop h VAL 32 Ca 0.30 -0.92 0.10 0.00 0.82 0.00 0.00 66.70 66.99 3kop h VAL 32 Cb 0.40 1.51 -0.08 0.00 -1.52 0.00 0.00 31.29 31.60 3kop h VAL 32 CO -0.34 0.20 -0.02 -0.25 0.02 0.00 0.00 177.57 177.19 3kop h TRP 33 N -0.68 -0.07 0.00 1.57 2.91 -0.66 -1.39 115.95 117.64 3kop h TRP 33 Ca -0.02 0.04 -0.01 0.00 1.13 0.00 0.00 58.89 60.03 3kop h TRP 33 Cb 0.50 0.11 -0.00 0.00 -0.51 0.00 0.00 29.16 29.25 3kop h TRP 33 CO 0.06 -0.13 -0.04 -0.44 -1.03 0.00 0.00 178.44 176.87 3kop h ASP 34 N 0.10 0.00 -0.08 2.65 3.32 -1.08 -2.80 116.42 118.53 3kop h ASP 34 Ca 0.25 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.30 3kop h ASP 34 Cb 0.38 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.93 3kop h ASP 34 CO -0.43 0.04 0.00 0.00 -1.72 0.00 0.00 179.24 177.12 3kop n ALA 35 N -2.20 2.45 -1.78 3.45 0.00 -0.57 -5.00 120.51 116.86 3kop n ALA 35 Ca -0.02 -0.69 -0.35 0.00 0.00 0.00 0.00 53.44 52.37 3kop n ALA 35 Cb 0.15 -0.54 -0.02 0.00 0.00 0.00 0.00 19.45 19.04 3kop n ALA 35 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3kop s LEU 36 N -1.27 3.89 0.44 0.00 1.43 -0.94 -4.31 118.68 117.92 3kop s LEU 36 Ca 0.20 2.11 -0.21 0.00 -1.03 0.00 0.00 54.13 55.19 3kop s LEU 36 Cb 0.14 -4.45 -0.10 0.00 0.03 0.00 0.00 46.19 41.80 3kop s LEU 36 CO 0.20 -0.92 0.97 -2.16 0.23 0.00 0.00 176.35 174.67 3kop s PRO 37 N -3.04 4.15 -0.09 1.29 0.04 -1.26 -4.92 135.00 131.17 3kop s PRO 37 Ca 0.67 1.20 0.04 0.00 0.04 0.00 0.00 61.00 62.94 3kop s PRO 37 Cb -0.22 -2.20 0.00 0.00 0.04 0.00 0.00 34.50 32.12 3kop s PRO 37 CO 0.26 -0.11 -0.21 -0.65 0.04 0.00 0.00 177.00 176.34 3kop s GLN 38 N -3.11 2.65 -0.14 4.56 -1.52 -0.58 -4.99 119.66 116.51 3kop s GLN 38 Ca 0.62 -0.75 -0.09 0.00 -1.95 0.00 0.00 55.36 53.20 3kop s GLN 38 Cb -0.12 -2.04 0.05 0.00 -0.22 0.00 0.00 33.01 30.69 3kop s GLN 38 CO 0.16 0.14 0.35 0.45 -0.25 0.00 0.00 175.29 176.14 3kop s SER 39 N 0.41 -0.42 0.17 5.90 0.15 -1.26 -0.35 113.70 118.30 3kop s SER 39 Ca -0.17 0.76 -0.24 0.00 0.70 0.00 0.00 55.95 56.99 3kop s SER 39 Cb -0.17 0.66 0.06 0.00 -1.71 0.00 0.00 66.02 64.86 3kop s SER 39 CO 0.07 -0.17 0.90 -0.55 1.20 0.00 0.00 173.24 174.69 3kop s SER 40 N 1.11 -0.21 0.07 5.45 0.15 -0.98 -5.00 113.70 114.29 3kop s SER 40 Ca -0.08 -0.41 -0.36 0.00 0.70 0.00 0.00 55.95 55.80 3kop s SER 40 Cb -0.08 0.53 -0.18 0.00 -1.71 0.00 0.00 66.02 64.58 3kop s SER 40 CO -0.09 -0.97 1.01 1.67 1.20 0.00 0.00 173.24 176.05 3kop n GLN 41 N -0.45 0.28 -3.16 5.44 -0.06 -1.26 -0.88 117.38 117.29 3kop n GLN 41 Ca -0.06 0.10 -0.32 0.00 -2.00 0.00 0.00 57.00 54.72 3kop n GLN 41 Cb 0.61 -1.52 -0.06 0.00 -4.06 0.00 0.00 30.24 25.21 3kop n GLN 41 CO 0.00 0.00 0.00 0.54 -0.20 0.00 0.00 177.06 177.40 3kop s VAL 42 N -0.17 4.72 0.05 1.69 0.11 -0.98 -4.37 120.40 121.45 3kop s VAL 42 Ca 0.83 0.86 0.03 0.00 -2.93 0.00 0.00 61.98 60.78 3kop s VAL 42 Cb -1.12 -3.62 -0.02 0.00 -1.53 0.00 0.00 36.38 30.09 3kop s VAL 42 CO 0.55 -0.19 -0.10 -0.36 -3.33 0.00 0.00 175.10 171.66 3kop s PHE 43 N -1.99 0.90 0.02 1.54 0.08 0.13 -4.87 117.98 113.80 3kop s PHE 43 Ca 0.53 -0.43 -0.14 0.00 0.12 0.00 0.00 56.93 57.01 3kop s PHE 43 Cb -0.10 -0.53 -0.06 0.00 -0.57 0.00 0.00 43.02 41.76 3kop s PHE 43 CO 0.19 -0.02 0.42 -1.58 -0.10 0.00 0.00 175.22 174.13 3kop s HIS 44 N -1.14 3.71 0.60 0.36 5.65 -1.26 -0.91 115.29 122.29 3kop s HIS 44 Ca -0.05 0.98 -0.19 0.00 0.25 0.00 0.00 55.06 56.06 3kop s HIS 44 Cb -0.09 -2.29 -0.03 0.00 -1.18 0.00 0.00 32.58 28.99 3kop s HIS 44 CO 0.01 0.61 1.24 0.20 -0.65 0.00 0.00 174.74 176.15 3kop s GLY 45 N -1.21 2.78 -0.02 1.59 0.00 -0.02 -4.96 107.32 105.48 3kop s GLY 45 Ca 0.26 1.07 0.13 0.00 0.00 0.00 0.00 44.72 46.19 3kop s GLY 45 CO 0.15 1.48 0.31 0.28 0.00 0.00 0.00 173.10 175.32 3kop n LYS 46 N -1.61 0.52 0.00 2.90 5.02 -1.26 -4.69 118.16 119.05 3kop n LYS 46 Ca 0.14 -0.12 0.00 0.00 -2.02 0.00 0.00 58.31 56.31 3kop n LYS 46 Cb 0.49 -1.31 0.00 0.00 -0.02 0.00 0.00 35.03 34.19 3kop n LYS 46 CO 0.00 0.00 0.00 2.48 -0.52 0.00 0.00 177.40 179.36 3kop n TYR 47 N -1.93 0.00 1.97 2.13 0.18 -1.26 -4.76 117.16 113.49 3kop n TYR 47 Ca -0.02 0.00 0.14 0.00 1.88 0.00 0.00 57.90 59.89 3kop n TYR 47 Cb 0.34 0.00 0.80 0.00 -0.38 0.00 0.00 39.34 40.10 3kop n TYR 47 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 3kop n ALA 48 N -2.08 2.66 -0.14 -3.48 0.00 -1.26 -4.68 120.51 111.52 3kop n ALA 48 Ca 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.26 3kop n ALA 48 Cb 0.48 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.50 3kop n ALA 48 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 3kop n ARG 49 N -0.88 0.00 -1.95 0.00 0.63 -1.26 -4.27 116.66 108.94 3kop n ARG 49 Ca 0.20 0.00 -0.41 0.00 -0.92 0.00 0.00 57.85 56.72 3kop n ARG 49 Cb 0.11 0.00 -0.00 0.00 0.45 0.00 0.00 32.46 33.01 3kop n ARG 49 CO 0.00 0.00 0.00 0.09 -2.51 0.00 0.00 177.63 175.21 3kop n ASN 50 N 8.99 5.64 -3.87 6.15 3.02 -1.26 -4.62 115.26 129.30 3kop n ASN 50 Ca 0.00 -2.95 -0.17 0.00 -0.03 0.00 0.00 54.58 51.43 3kop n ASN 50 Cb 0.00 -1.53 -0.15 0.00 -0.61 0.00 0.00 39.78 37.48 3kop n ASN 50 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 3kop s GLU 51 N 1.31 0.37 0.23 3.52 2.12 -1.26 -1.05 118.70 123.94 3kop s GLU 51 Ca 0.48 -0.03 0.11 0.00 0.36 0.00 0.00 54.97 55.90 3kop s GLU 51 Cb 0.14 -0.46 -0.05 0.00 0.26 0.00 0.00 34.13 34.02 3kop s GLU 51 CO -0.05 -0.05 -0.21 0.96 -0.54 0.00 0.00 175.26 175.38 3kop s ILE 52 N 0.59 2.32 0.22 -3.70 -4.36 -0.49 -0.84 121.20 114.94 3kop s ILE 52 Ca -0.06 -2.22 -0.21 0.00 -0.26 0.00 0.00 60.65 57.89 3kop s ILE 52 Cb -0.09 -2.18 0.04 0.00 1.25 0.00 0.00 42.46 41.48 3kop s ILE 52 CO -0.01 -0.31 0.65 -0.72 0.24 0.00 0.00 174.94 174.80 3kop s TYR 53 N -2.21 -0.32 0.41 1.37 1.13 -0.09 -0.34 117.35 117.29 3kop s TYR 53 Ca 0.25 -0.03 0.04 0.00 -1.41 0.00 0.00 57.07 55.92 3kop s TYR 53 Cb -0.06 0.62 -0.05 0.00 -1.10 0.00 0.00 41.96 41.37 3kop s TYR 53 CO 0.12 -1.06 0.05 0.54 -2.51 0.00 0.00 175.55 172.69 3kop s ASN 54 N -2.85 3.28 -0.08 -0.18 2.20 -0.50 -0.69 114.94 116.11 3kop s ASN 54 Ca 0.07 -1.50 -0.00 0.00 -0.94 0.00 0.00 52.86 50.49 3kop s ASN 54 Cb -0.04 0.09 0.02 0.00 -2.00 0.00 0.00 41.25 39.33 3kop s ASN 54 CO -0.02 -0.69 -0.05 -0.76 -2.94 0.00 0.00 177.10 172.64 3kop s LEU 55 N -3.66 1.08 0.07 3.54 1.43 -1.26 -1.92 118.68 117.95 3kop s LEU 55 Ca 0.26 -0.21 0.05 0.00 -1.03 0.00 0.00 54.13 53.20 3kop s LEU 55 Cb 0.06 -0.66 -0.03 0.00 0.03 0.00 0.00 46.19 45.59 3kop s LEU 55 CO 0.13 -0.11 -0.13 0.68 0.23 0.00 0.00 176.35 177.14 3kop s VAL 56 N 1.55 1.03 0.39 -1.59 -7.23 -0.11 -4.86 120.40 109.58 3kop s VAL 56 Ca 0.00 -1.26 -0.25 0.00 -1.81 0.00 0.00 61.98 58.66 3kop s VAL 56 Cb -0.13 -1.00 -0.12 0.00 0.56 0.00 0.00 36.38 35.69 3kop s VAL 56 CO -0.05 -0.24 1.00 -2.65 -0.31 0.00 0.00 175.10 172.86 3kop n PRO 57 N 1.33 1.36 -1.54 4.82 -0.02 -1.26 -0.29 135.00 139.40 3kop n PRO 57 Ca -0.21 0.48 -0.47 0.00 -2.02 0.00 0.00 63.50 61.29 3kop n PRO 57 Cb 0.54 -1.99 -0.03 0.00 -0.02 0.00 0.00 33.50 32.01 3kop n PRO 57 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3kop n ALA 58 N -0.30 -1.06 0.00 3.55 0.00 -0.66 -4.65 120.51 117.40 3kop n ALA 58 Ca 0.09 0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.96 3kop n ALA 58 Cb 0.37 -1.92 0.00 0.00 0.00 0.00 0.00 19.45 17.90 3kop n ALA 58 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.50 179.47 3kop n PHE 59 N 0.49 0.00 -2.90 0.00 1.16 -1.26 -5.04 117.46 109.91 3kop n PHE 59 Ca 0.13 0.00 -0.33 0.00 -1.87 0.00 0.00 57.45 55.38 3kop n PHE 59 Cb 0.28 0.00 -0.07 0.00 -1.61 0.00 0.00 39.48 38.08 3kop n PHE 59 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 3kop s ALA 60 N -1.34 3.11 0.30 1.98 0.00 -1.26 -4.96 121.76 119.59 3kop s ALA 60 Ca 0.00 0.32 0.00 0.00 0.00 0.00 0.00 51.96 52.28 3kop s ALA 60 Cb 0.00 -3.06 0.51 0.00 0.00 0.00 0.00 23.12 20.57 3kop s ALA 60 CO 0.00 0.18 1.93 -1.35 0.00 0.00 0.00 175.76 176.51 3kop h PRO 61 N 1.99 1.02 -3.69 0.00 0.11 -1.98 -3.42 132.00 126.04 3kop h PRO 61 Ca -0.49 -0.06 -0.16 0.00 0.11 0.00 0.00 66.00 65.40 3kop h PRO 61 Cb 1.18 -0.23 -0.22 0.00 0.11 0.00 0.00 31.00 31.84 3kop h PRO 61 CO 0.62 0.68 -0.59 -1.59 -0.21 0.00 0.00 178.00 176.91 3kop s LYS 62 N -5.91 0.36 0.49 1.05 -2.85 -1.26 -5.14 119.74 106.48 3kop s LYS 62 Ca -0.11 -0.40 -0.22 0.00 -1.00 0.00 0.00 55.97 54.24 3kop s LYS 62 Cb 0.19 0.14 -0.07 0.00 -2.06 0.00 0.00 37.83 36.04 3kop s LYS 62 CO 0.80 -0.07 1.20 -1.21 0.10 0.00 0.00 175.35 176.16 3kop s GLU 63 N -1.19 3.56 0.51 1.78 0.41 -1.26 -4.91 118.70 117.60 3kop s GLU 63 Ca -0.13 1.84 0.29 0.00 -0.41 0.00 0.00 54.97 56.56 3kop s GLU 63 Cb -0.07 -2.31 1.25 0.00 -1.78 0.00 0.00 34.13 31.22 3kop s GLU 63 CO 0.00 -0.73 1.96 -1.00 -0.49 0.00 0.00 175.26 175.00 3kop h PRO 64 N 1.78 0.00 -1.29 0.39 0.13 -1.98 -3.50 132.00 127.54 3kop h PRO 64 Ca -0.50 0.00 0.16 0.00 -0.87 0.00 0.00 66.00 64.79 3kop h PRO 64 Cb 1.26 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.35 3kop h PRO 64 CO 0.59 0.11 -0.23 0.41 -0.23 0.00 0.00 178.00 178.66 3kop n GLY 65 N -0.10 -1.60 3.67 1.56 0.00 -1.26 -4.81 105.19 102.64 3kop n GLY 65 Ca -0.00 -1.38 -0.47 0.00 0.00 0.00 0.00 46.02 44.16 3kop n GLY 65 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kop n ALA 66 N -1.66 1.07 -3.65 4.61 0.00 -1.26 -4.97 120.51 114.64 3kop n ALA 66 Ca 0.00 0.41 -0.04 0.00 0.00 0.00 0.00 53.44 53.81 3kop n ALA 66 Cb 0.26 -2.37 -0.06 0.00 0.00 0.00 0.00 19.45 17.29 3kop n ALA 66 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 3kop s GLU 67 N 1.69 0.56 -1.45 0.00 2.12 -1.26 -4.95 118.70 115.40 3kop s GLU 67 Ca 0.83 1.31 -0.06 0.00 0.36 0.00 0.00 54.97 57.40 3kop s GLU 67 Cb -0.71 0.58 0.05 0.00 0.26 0.00 0.00 34.13 34.31 3kop s GLU 67 CO 0.42 -0.19 0.71 -1.71 -0.54 0.00 0.00 175.26 173.94 3kop n ASN 68 N 5.12 -2.20 -4.84 -1.70 5.15 -1.26 -3.87 115.26 111.66 3kop n ASN 68 Ca -0.14 -0.89 -0.32 0.00 -0.60 0.00 0.00 54.58 52.63 3kop n ASN 68 Cb 0.52 -3.54 -0.02 0.00 -0.53 0.00 0.00 39.78 36.21 3kop n ASN 68 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 3kop s THR 69 N -3.60 4.44 0.02 -0.44 -4.23 -1.26 -1.56 115.64 109.00 3kop s THR 69 Ca 0.29 1.10 0.01 0.00 -1.18 0.00 0.00 61.69 61.91 3kop s THR 69 Cb -0.15 -3.68 -0.02 0.00 1.34 0.00 0.00 72.50 69.99 3kop s THR 69 CO 0.86 -0.73 -0.05 0.28 -0.54 0.00 0.00 174.62 174.44 3kop s THR 70 N -2.69 0.35 -1.22 3.99 -1.32 -0.54 -4.88 115.64 109.33 3kop s THR 70 Ca 0.59 -0.72 0.10 0.00 -1.21 0.00 0.00 61.69 60.46 3kop s THR 70 Cb -0.11 -0.40 0.13 0.00 -1.51 0.00 0.00 72.50 70.61 3kop s THR 70 CO 0.36 -0.25 0.93 1.33 -2.21 0.00 0.00 174.62 174.78 3kop n VAL 71 N 2.02 0.24 -3.29 5.08 0.24 -1.26 -1.58 118.33 119.78 3kop n VAL 71 Ca -0.20 -0.62 -0.26 0.00 -2.04 0.00 0.00 64.34 61.23 3kop n VAL 71 Cb 0.56 1.05 -0.07 0.00 -1.47 0.00 0.00 33.84 33.91 3kop n VAL 71 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 3kop n THR 72 N 0.57 1.70 -2.10 3.34 -2.24 -1.26 -0.72 114.28 113.57 3kop n THR 72 Ca 0.07 -4.99 -0.36 0.00 -2.27 0.00 0.00 64.05 56.50 3kop n THR 72 Cb 0.30 -1.89 0.02 0.00 -2.10 0.00 0.00 70.33 66.66 3kop n THR 72 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 3kop s PRO 73 N -2.35 3.29 0.35 -0.78 0.04 -1.26 -4.98 135.00 129.31 3kop s PRO 73 Ca 0.40 1.83 0.09 0.00 0.04 0.00 0.00 61.00 63.36 3kop s PRO 73 Cb 0.18 -2.13 -0.05 0.00 0.04 0.00 0.00 34.50 32.54 3kop s PRO 73 CO -0.05 -0.95 0.04 0.96 0.04 0.00 0.00 177.00 177.04 3kop s ILE 74 N -1.57 2.63 0.21 0.56 -4.36 -1.26 -4.31 121.20 113.10 3kop s ILE 74 Ca 0.72 -1.92 -0.32 0.00 -0.26 0.00 0.00 60.65 58.86 3kop s ILE 74 Cb -0.30 -2.84 -0.13 0.00 1.25 0.00 0.00 42.46 40.44 3kop s ILE 74 CO 0.34 -0.18 1.51 -2.65 0.24 0.00 0.00 174.94 174.21 3kop n PRO 75 N -1.00 2.17 0.00 0.37 -0.02 -1.18 -1.47 135.00 133.86 3kop n PRO 75 Ca -0.04 0.78 0.00 0.00 -2.02 0.00 0.00 63.50 62.22 3kop n PRO 75 Cb 0.62 -2.50 0.00 0.00 -0.02 0.00 0.00 33.50 31.60 3kop n PRO 75 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3kop n GLY 76 N 2.79 1.67 3.76 -1.23 0.00 0.32 -4.92 105.19 107.57 3kop n GLY 76 Ca 0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 3kop n GLY 76 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3kop s ASP 77 N -1.87 6.62 -0.15 1.61 1.01 -0.54 -0.63 116.67 122.72 3kop s ASP 77 Ca 0.00 2.75 0.02 0.00 0.71 0.00 0.00 52.55 56.03 3kop s ASP 77 Cb 0.00 -2.64 0.01 0.00 1.01 0.00 0.00 42.92 41.30 3kop s ASP 77 CO 0.00 -0.69 -0.20 -0.69 0.21 0.00 0.00 175.17 173.80 3kop s VAL 78 N -0.53 2.19 0.18 -1.27 1.01 -0.54 -1.29 120.40 120.15 3kop s VAL 78 Ca 0.55 -0.93 0.11 0.00 0.00 0.00 0.00 61.98 61.72 3kop s VAL 78 Cb -0.42 -1.89 -0.04 0.00 0.00 0.00 0.00 36.38 34.02 3kop s VAL 78 CO 0.50 0.54 -0.25 0.00 0.00 0.00 0.00 175.10 175.89 3kop s TYR 80 N -1.52 2.25 -0.03 0.00 6.14 -0.15 -1.32 117.35 122.72 3kop s TYR 80 Ca 0.19 -0.79 0.04 0.00 0.64 0.00 0.00 57.07 57.15 3kop s TYR 80 Cb -0.08 -1.51 -0.00 0.00 0.42 0.00 0.00 41.96 40.79 3kop s TYR 80 CO 0.09 -0.29 -0.14 -0.06 0.64 0.00 0.00 175.55 175.79 3kop s PHE 81 N 0.16 1.37 -0.24 4.97 0.40 -0.59 -1.07 117.98 122.98 3kop s PHE 81 Ca -0.11 -0.37 -0.13 0.00 -0.60 0.00 0.00 56.93 55.73 3kop s PHE 81 Cb -0.15 -0.94 -0.04 0.00 0.51 0.00 0.00 43.02 42.40 3kop s PHE 81 CO 0.05 -0.13 0.26 0.99 0.70 0.00 0.00 175.22 177.10 3kop s THR 82 N 0.07 5.28 0.26 0.64 2.01 -1.26 -1.25 115.64 121.39 3kop s THR 82 Ca -0.03 0.38 0.05 0.00 0.31 0.00 0.00 61.69 62.40 3kop s THR 82 Cb -0.10 -3.60 -0.06 0.00 0.01 0.00 0.00 72.50 68.76 3kop s THR 82 CO 0.01 0.27 -0.01 -0.36 -0.69 0.00 0.00 174.62 173.84 3kop s PHE 83 N 1.41 1.77 0.33 4.92 0.08 -0.06 -5.02 117.98 121.41 3kop s PHE 83 Ca 0.12 -0.85 0.08 0.00 0.12 0.00 0.00 56.93 56.39 3kop s PHE 83 Cb -0.15 -1.04 -0.03 0.00 -0.57 0.00 0.00 43.02 41.23 3kop s PHE 83 CO 0.07 0.08 0.27 0.95 -0.10 0.00 0.00 175.22 176.49 3kop s THR 84 N -3.25 3.50 0.34 0.64 -4.23 -1.26 -1.23 115.64 110.15 3kop s THR 84 Ca 0.30 -1.41 0.13 0.00 -1.18 0.00 0.00 61.69 59.52 3kop s THR 84 Cb 0.05 -3.17 0.33 0.00 1.34 0.00 0.00 72.50 71.06 3kop s THR 84 CO 0.11 -0.18 1.71 0.28 -0.54 0.00 0.00 174.62 175.99 3kop h SER 85 N 1.30 0.59 -0.12 3.99 0.02 -1.81 -1.07 113.55 116.45 3kop h SER 85 Ca -0.45 0.15 -0.04 0.00 -0.84 0.00 0.00 61.79 60.62 3kop h SER 85 Cb 1.25 0.07 -0.01 0.00 0.14 0.00 0.00 62.40 63.85 3kop h SER 85 CO 0.59 0.01 -0.02 0.78 -1.14 0.00 0.00 176.83 177.05 3kop h ASN 86 N 0.46 0.31 -0.52 3.07 -0.26 -1.89 0.30 115.58 117.06 3kop h ASN 86 Ca 0.68 -0.05 -0.04 0.00 -0.56 0.00 0.00 56.30 56.33 3kop h ASN 86 Cb 1.45 -0.08 -0.03 0.00 -1.06 0.00 0.00 38.32 38.60 3kop h ASN 86 CO -0.51 0.39 0.20 0.44 -1.06 0.00 0.00 177.43 176.89 3kop h ASP 87 N 0.33 0.76 0.00 5.81 3.32 -1.59 -3.40 116.42 121.66 3kop h ASP 87 Ca 0.08 -0.11 -0.24 0.00 0.02 0.00 0.00 57.03 56.77 3kop h ASP 87 Cb 0.25 -0.20 -0.04 0.00 0.22 0.00 0.00 39.33 39.57 3kop h ASP 87 CO 0.01 0.71 -1.88 0.18 -1.72 0.00 0.00 179.24 176.54 3kop n LEU 88 N -4.31 2.22 -3.74 1.55 4.77 -0.79 -4.71 117.00 111.99 3kop n LEU 88 Ca 0.05 0.03 -0.42 0.00 -0.03 0.00 0.00 56.01 55.64 3kop n LEU 88 Cb 0.18 -0.51 -0.02 0.00 -2.33 0.00 0.00 43.42 40.74 3kop n LEU 88 CO 0.39 0.58 2.40 1.17 -1.33 0.00 0.00 177.39 180.61 3kop n LYS 89 N -3.26 2.29 -4.30 3.23 4.81 1.00 -4.64 118.16 117.28 3kop n LYS 89 Ca -0.29 -2.31 -0.20 0.00 -0.87 0.00 0.00 58.31 54.64 3kop n LYS 89 Cb 0.76 -3.16 -0.11 0.00 0.02 0.00 0.00 35.03 32.54 3kop n LYS 89 CO 0.00 0.00 0.00 0.95 1.17 0.00 0.00 177.40 179.52 3kop s THR 90 N 4.15 1.62 0.22 3.15 -4.23 -1.26 -4.85 115.64 114.44 3kop s THR 90 Ca 0.52 -1.87 -0.07 0.00 -1.18 0.00 0.00 61.69 59.08 3kop s THR 90 Cb 0.13 -1.75 0.18 0.00 1.34 0.00 0.00 72.50 72.41 3kop s THR 90 CO 0.01 -0.38 1.72 -0.65 -0.54 0.00 0.00 174.62 174.77 3kop h PRO 91 N 3.28 0.34 -0.05 3.99 0.11 -1.99 -2.24 132.00 135.44 3kop h PRO 91 Ca -0.41 -0.02 0.02 0.00 0.11 0.00 0.00 66.00 65.70 3kop h PRO 91 Cb 1.20 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 32.23 3kop h PRO 91 CO 0.52 0.23 0.05 0.66 -0.21 0.00 0.00 178.00 179.24 3kop h SER 92 N 0.35 0.00 0.10 -2.05 4.64 -1.96 -2.47 113.55 112.15 3kop h SER 92 Ca 0.35 0.00 -0.20 0.00 -0.47 0.00 0.00 61.79 61.48 3kop h SER 92 Cb 0.52 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.62 3kop h SER 92 CO -0.39 0.00 -0.96 0.45 -0.87 0.00 0.00 176.83 175.06 3kop h HIS 93 N 0.00 0.37 -5.64 4.77 3.86 -1.70 -3.49 115.15 113.32 3kop h HIS 93 Ca 0.03 -0.27 -0.36 0.00 -1.16 0.00 0.00 60.37 58.60 3kop h HIS 93 Cb 0.12 -0.01 0.14 0.00 1.06 0.00 0.00 27.41 28.72 3kop h HIS 93 CO 0.00 1.37 -0.69 0.41 0.86 0.00 0.00 177.93 179.89 3kop n GLY 94 N 1.67 -0.45 3.75 2.45 0.00 -0.89 -4.99 105.19 106.73 3kop n GLY 94 Ca -0.19 0.18 -0.37 0.00 0.00 0.00 0.00 46.02 45.64 3kop n GLY 94 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3kop s TYR 95 N -3.32 2.28 -0.74 1.61 2.02 -1.26 -5.14 117.35 112.79 3kop s TYR 95 Ca 0.38 1.48 0.00 0.00 -0.37 0.00 0.00 57.07 58.56 3kop s TYR 95 Cb -0.17 -3.62 0.00 0.00 -0.40 0.00 0.00 41.96 37.77 3kop s TYR 95 CO 0.71 -2.57 0.58 0.39 -1.57 0.00 0.00 175.55 173.09 3kop n GLU 96 N -1.54 0.93 -2.74 -0.62 1.02 -1.26 -5.10 120.64 111.33 3kop n GLU 96 Ca 0.13 0.00 -0.42 0.00 -0.02 0.00 0.00 57.16 56.86 3kop n GLU 96 Cb 0.48 -1.35 -0.03 0.00 -0.02 0.00 0.00 31.44 30.52 3kop n GLU 96 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 3kop s VAL 104 N -0.72 4.84 -0.02 2.62 -7.23 -1.26 -5.25 120.40 113.38 3kop s VAL 104 Ca 0.00 1.98 -0.16 0.00 -1.81 0.00 0.00 61.98 61.99 3kop s VAL 104 Cb 0.00 -4.28 0.03 0.00 0.56 0.00 0.00 36.38 32.68 3kop s VAL 104 CO 0.00 0.09 0.34 -1.58 -0.31 0.00 0.00 175.10 173.64 3kop s GLN 105 N 1.53 0.69 -0.17 4.82 0.74 -1.26 -5.00 119.66 121.01 3kop s GLN 105 Ca 0.48 -0.12 -0.14 0.00 0.05 0.00 0.00 55.36 55.62 3kop s GLN 105 Cb -0.19 0.31 -0.04 0.00 1.10 0.00 0.00 33.01 34.18 3kop s GLN 105 CO 0.22 -0.19 0.32 0.99 -0.55 0.00 0.00 175.29 176.08 3kop s THR 106 N -1.25 5.28 -0.03 -0.34 2.01 -1.26 -2.08 115.64 117.98 3kop s THR 106 Ca -0.13 0.58 0.06 0.00 0.31 0.00 0.00 61.69 62.51 3kop s THR 106 Cb -0.05 -3.66 -0.01 0.00 0.01 0.00 0.00 72.50 68.79 3kop s THR 106 CO 0.05 0.35 -0.20 -0.63 -0.69 0.00 0.00 174.62 173.50 3kop s ILE 107 N 0.70 1.60 -0.14 1.82 1.01 -0.36 -1.65 121.20 124.18 3kop s ILE 107 Ca 0.17 -0.85 -0.04 0.00 0.00 0.00 0.00 60.65 59.93 3kop s ILE 107 Cb -0.13 -1.34 -0.03 0.00 0.01 0.00 0.00 42.46 40.96 3kop s ILE 107 CO 0.05 0.45 -0.01 -0.69 0.00 0.00 0.00 174.94 174.74 3kop s VAL 108 N -0.32 4.15 -0.25 2.92 1.01 0.60 -0.88 120.40 127.63 3kop s VAL 108 Ca 0.04 -0.27 -0.10 0.00 0.00 0.00 0.00 61.98 61.65 3kop s VAL 108 Cb -0.09 -2.81 -0.04 0.00 0.00 0.00 0.00 36.38 33.43 3kop s VAL 108 CO 0.00 0.51 0.14 -0.62 0.00 0.00 0.00 175.10 175.14 3kop s ASP 109 N 0.07 5.81 -0.25 3.32 -1.08 -0.38 -0.93 116.67 123.23 3kop s ASP 109 Ca 0.01 -0.01 -0.04 0.00 -0.52 0.00 0.00 52.55 51.99 3kop s ASP 109 Cb -0.13 -2.05 0.00 0.00 -1.46 0.00 0.00 42.92 39.28 3kop s ASP 109 CO 0.02 0.01 -0.00 -0.76 0.52 0.00 0.00 175.17 174.96 3kop s LEU 110 N 1.36 3.28 0.09 -1.34 1.43 -0.81 -1.54 118.68 121.16 3kop s LEU 110 Ca 0.07 -0.58 0.09 0.00 -1.03 0.00 0.00 54.13 52.68 3kop s LEU 110 Cb -0.15 -1.78 -0.03 0.00 0.03 0.00 0.00 46.19 44.26 3kop s LEU 110 CO 0.06 -0.10 -0.25 0.00 0.23 0.00 0.00 176.35 176.30 3kop s ALA 111 N 1.46 2.15 -0.13 4.21 0.00 -0.44 -1.41 121.76 127.61 3kop s ALA 111 Ca 0.04 -1.31 0.02 0.00 0.00 0.00 0.00 51.96 50.70 3kop s ALA 111 Cb -0.16 -0.38 0.01 0.00 0.00 0.00 0.00 23.12 22.60 3kop s ALA 111 CO -0.01 0.49 -0.17 0.08 0.00 0.00 0.00 175.76 176.14 3kop s VAL 112 N -0.96 1.70 -0.29 0.00 1.01 0.53 -1.02 120.40 121.38 3kop s VAL 112 Ca 0.11 -0.75 -0.13 0.00 0.00 0.00 0.00 61.98 61.21 3kop s VAL 112 Cb -0.10 -1.54 -0.04 0.00 0.00 0.00 0.00 36.38 34.70 3kop s VAL 112 CO 0.04 0.48 0.28 -0.36 0.00 0.00 0.00 175.10 175.54 3kop s PHE 113 N 1.04 3.23 -1.56 5.22 0.08 -0.42 -1.39 117.98 124.18 3kop s PHE 113 Ca -0.04 0.19 0.17 0.00 0.12 0.00 0.00 56.93 57.37 3kop s PHE 113 Cb -0.15 -2.48 -0.00 0.00 -0.57 0.00 0.00 43.02 39.82 3kop s PHE 113 CO -0.04 -0.22 0.89 2.48 -0.10 0.00 0.00 175.22 178.23 3kop n TYR 114 N 5.19 0.00 -3.80 0.36 0.18 -0.22 -0.52 117.16 118.35 3kop n TYR 114 Ca -0.11 0.00 -0.05 0.00 1.88 0.00 0.00 57.90 59.61 3kop n TYR 114 Cb 0.51 0.00 -0.01 0.00 -0.38 0.00 0.00 39.34 39.46 3kop n TYR 114 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 3kop n GLY 115 N 1.18 2.91 3.41 -7.48 0.00 -1.24 -4.77 105.19 99.20 3kop n GLY 115 Ca 0.07 -1.51 -0.27 0.00 0.00 0.00 0.00 46.02 44.32 3kop n GLY 115 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 3kop n ARG 116 N -0.21 0.81 -3.40 1.61 1.85 -1.26 -3.10 116.66 112.95 3kop n ARG 116 Ca 0.01 -3.26 -0.18 0.00 -1.00 0.00 0.00 57.85 53.42 3kop n ARG 116 Cb 0.21 0.60 0.08 0.00 -1.05 0.00 0.00 32.46 32.31 3kop n ARG 116 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 3kop n ASN 117 N -1.58 -3.14 -4.74 2.89 3.02 -1.26 -4.76 115.26 105.68 3kop n ASN 117 Ca -0.10 -0.57 -0.35 0.00 -0.03 0.00 0.00 54.58 53.53 3kop n ASN 117 Cb 0.58 -4.86 -0.08 0.00 -0.61 0.00 0.00 39.78 34.81 3kop n ASN 117 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 3kop s ASN 118 N -4.02 5.55 -0.10 6.41 0.01 -1.26 -4.91 114.94 116.62 3kop s ASN 118 Ca 0.15 0.20 0.02 0.00 -0.71 0.00 0.00 52.86 52.52 3kop s ASN 118 Cb -0.07 -1.62 0.01 0.00 0.41 0.00 0.00 41.25 39.99 3kop s ASN 118 CO 0.69 0.36 -0.15 -0.76 -1.51 0.00 0.00 177.10 175.73 3kop s LEU 119 N -1.13 1.70 -1.24 0.60 1.43 -1.26 -4.21 118.68 114.57 3kop s LEU 119 Ca 0.16 -0.40 -0.14 0.00 -1.03 0.00 0.00 54.13 52.73 3kop s LEU 119 Cb -0.12 -1.03 0.15 0.00 0.03 0.00 0.00 46.19 45.23 3kop s LEU 119 CO 0.05 0.03 1.56 0.18 0.23 0.00 0.00 176.35 178.40 3kop n LEU 120 N 4.08 5.45 -3.73 1.79 4.77 0.10 -4.23 117.00 125.22 3kop n LEU 120 Ca -0.20 -4.41 -0.12 0.00 -0.03 0.00 0.00 56.01 51.25 3kop n LEU 120 Cb 0.51 -1.62 -0.12 0.00 -2.33 0.00 0.00 43.42 39.87 3kop n LEU 120 CO 0.24 0.76 -0.08 -0.22 -1.33 0.00 0.00 177.39 176.77 3kop s LEU 121 N 1.66 0.44 0.23 2.23 2.96 -1.26 -0.76 118.68 124.18 3kop s LEU 121 Ca 0.44 0.59 0.00 0.00 -0.22 0.00 0.00 54.13 54.94 3kop s LEU 121 Cb 0.00 0.89 -0.05 0.00 0.50 0.00 0.00 46.19 47.54 3kop s LEU 121 CO 0.01 -0.16 0.11 0.54 -1.32 0.00 0.00 176.35 175.54 3kop s ASN 122 N 1.04 0.67 0.00 3.68 2.20 -0.23 -4.75 114.94 117.55 3kop s ASN 122 Ca -0.07 -1.38 0.20 0.00 -0.94 0.00 0.00 52.86 50.67 3kop s ASN 122 Cb -0.08 0.27 0.87 0.00 -2.00 0.00 0.00 41.25 40.30 3kop s ASN 122 CO -0.07 -0.78 1.60 0.61 -2.94 0.00 0.00 177.10 175.52 3kop n GLY 123 N -0.36 -0.18 0.09 0.45 0.00 -1.26 -1.23 105.19 102.69 3kop n GLY 123 Ca 0.01 -0.31 -0.17 0.00 0.00 0.00 0.00 46.02 45.55 3kop n GLY 123 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3kop h ASP 124 N 1.41 0.15 0.00 1.61 3.32 -2.00 -3.45 116.42 117.46 3kop h ASP 124 Ca 0.00 -0.95 0.00 0.00 0.02 0.00 0.00 57.03 56.10 3kop h ASP 124 Cb 0.31 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 39.81 3kop h ASP 124 CO 0.00 1.17 0.00 1.07 -1.72 0.00 0.00 179.24 179.76 3kop n THR 125 N -4.43 0.00 0.00 0.35 5.66 -1.24 -5.13 114.28 109.49 3kop n THR 125 Ca -0.13 -0.07 0.00 0.00 -3.05 0.00 0.00 64.05 60.80 3kop n THR 125 Cb 0.61 1.38 0.00 0.00 -1.55 0.00 0.00 70.33 70.77 3kop n THR 125 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 3kop n GLY 126 N 0.07 0.87 3.75 1.09 0.00 -0.37 -4.96 105.19 105.64 3kop n GLY 126 Ca 0.00 -1.24 -0.40 0.00 0.00 0.00 0.00 46.02 44.38 3kop n GLY 126 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3kop s TRP 127 N 0.00 3.69 -0.52 1.61 0.52 -1.26 -1.07 118.94 121.91 3kop s TRP 127 Ca 0.00 1.73 0.04 0.00 0.02 0.00 0.00 56.10 57.89 3kop s TRP 127 Cb 0.00 -3.20 0.15 0.00 -1.15 0.00 0.00 33.47 29.27 3kop s TRP 127 CO 0.00 -0.29 0.34 0.14 0.02 0.00 0.00 176.95 177.16 3kop s VAL 128 N -0.90 1.71 0.41 4.03 -7.23 0.06 -4.94 120.40 113.54 3kop s VAL 128 Ca 0.45 -3.16 -0.26 0.00 -1.81 0.00 0.00 61.98 57.20 3kop s VAL 128 Cb -0.30 -2.16 -0.09 0.00 0.56 0.00 0.00 36.38 34.40 3kop s VAL 128 CO 0.37 -1.00 1.32 -2.84 -0.31 0.00 0.00 175.10 172.64 3kop s PRO 129 N -0.31 3.94 0.03 4.82 0.02 -1.26 -4.80 135.00 137.44 3kop s PRO 129 Ca 0.23 2.19 0.06 0.00 0.02 0.00 0.00 61.00 63.50 3kop s PRO 129 Cb -0.12 -2.75 -0.03 0.00 0.02 0.00 0.00 34.50 31.61 3kop s PRO 129 CO -0.09 -0.52 -0.14 0.20 -0.33 0.00 0.00 177.00 176.11 3kop s GLY 130 N -0.71 1.64 -0.23 0.52 0.00 -0.61 -4.91 107.32 103.02 3kop s GLY 130 Ca 0.57 -1.14 -0.29 0.00 0.00 0.00 0.00 44.72 43.86 3kop s GLY 130 CO 0.50 -1.03 1.03 -1.31 0.00 0.00 0.00 173.10 172.29 3kop s ASN 131 N -1.47 7.08 -0.34 1.64 -0.87 -0.23 -1.47 114.94 119.29 3kop s ASN 131 Ca 0.16 1.35 -0.25 0.00 -1.57 0.00 0.00 52.86 52.55 3kop s ASN 131 Cb -0.11 -2.54 0.01 0.00 -0.02 0.00 0.00 41.25 38.60 3kop s ASN 131 CO 0.06 -0.67 0.88 -0.69 -2.57 0.00 0.00 177.10 174.11 3kop s VAL 132 N 3.20 4.67 0.00 1.60 1.01 -0.60 -0.97 120.40 129.31 3kop s VAL 132 Ca 0.44 1.24 0.00 0.00 0.00 0.00 0.00 61.98 63.65 3kop s VAL 132 Cb -0.15 -4.26 0.00 0.00 0.00 0.00 0.00 36.38 31.97 3kop s VAL 132 CO 0.06 -0.41 0.01 2.22 0.00 0.00 0.00 175.10 176.98 3kop n PHE 133 N 6.54 0.00 -3.89 5.22 -1.74 -0.33 -4.70 117.46 118.56 3kop n PHE 133 Ca 0.06 0.00 -0.09 0.00 -0.56 0.00 0.00 57.45 56.86 3kop n PHE 133 Cb 0.48 0.00 -0.07 0.00 1.52 0.00 0.00 39.48 41.40 3kop n PHE 133 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 3kop s ALA 134 N -0.86 -0.12 -0.09 1.98 0.00 -1.12 -0.31 121.76 121.23 3kop s ALA 134 Ca 0.00 -0.71 0.00 0.00 0.00 0.00 0.00 51.96 51.26 3kop s ALA 134 Cb 0.00 0.50 0.02 0.00 0.00 0.00 0.00 23.12 23.65 3kop s ALA 134 CO 0.00 -0.51 -0.08 0.99 0.00 0.00 0.00 175.76 176.16 3kop s THR 135 N -3.88 0.93 0.02 0.00 2.01 -0.30 -1.47 115.64 112.95 3kop s THR 135 Ca 0.06 -0.28 -0.30 0.00 0.31 0.00 0.00 61.69 61.48 3kop s THR 135 Cb 0.05 -0.93 -0.06 0.00 0.01 0.00 0.00 72.50 71.57 3kop s THR 135 CO -0.10 0.34 1.36 -0.63 -0.69 0.00 0.00 174.62 174.89 3kop s ILE 136 N 1.35 3.73 -0.10 1.82 1.01 0.19 -0.60 121.20 128.60 3kop s ILE 136 Ca -0.02 1.15 0.04 0.00 0.00 0.00 0.00 60.65 61.82 3kop s ILE 136 Cb -0.14 -3.74 -0.05 0.00 0.01 0.00 0.00 42.46 38.55 3kop s ILE 136 CO -0.04 0.03 0.13 1.33 0.00 0.00 0.00 174.94 176.39 3kop n VAL 137 N 4.43 0.00 -3.83 2.92 0.24 0.15 -4.89 118.33 117.35 3kop n VAL 137 Ca 0.12 -0.28 -0.12 0.00 -2.04 0.00 0.00 64.34 62.02 3kop n VAL 137 Cb 0.44 0.76 -0.13 0.00 -1.47 0.00 0.00 33.84 33.43 3kop n VAL 137 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 3kop s GLU 138 N -1.72 0.09 0.00 7.34 2.02 -0.99 -4.91 118.70 120.53 3kop s GLU 138 Ca 0.00 0.13 0.00 0.00 0.02 0.00 0.00 54.97 55.13 3kop s GLU 138 Cb 0.03 0.02 0.00 0.00 0.10 0.00 0.00 34.13 34.28 3kop s GLU 138 CO 0.15 -0.03 0.00 0.41 0.02 0.00 0.00 175.26 175.82 3kop n GLY 139 N 3.14 0.51 0.16 -1.39 0.00 -1.26 -1.43 105.19 104.92 3kop n GLY 139 Ca -0.14 -0.46 -0.07 0.00 0.00 0.00 0.00 46.02 45.35 3kop n GLY 139 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3kop h LEU 140 N 0.00 0.29 -0.71 0.99 5.85 -1.91 -2.86 115.31 116.97 3kop h LEU 140 Ca 0.00 0.01 0.06 0.00 0.84 0.00 0.00 57.88 58.79 3kop h LEU 140 Cb 0.00 -0.05 -0.06 0.00 0.37 0.00 0.00 40.66 40.93 3kop h LEU 140 CO 0.00 0.21 0.41 0.44 -0.34 0.00 0.00 178.44 179.17 3kop h ASP 141 N 0.39 0.63 0.00 1.25 3.32 -1.96 0.78 116.42 120.83 3kop h ASP 141 Ca 0.15 0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.22 3kop h ASP 141 Cb 0.04 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 39.48 3kop h ASP 141 CO -0.09 0.41 0.00 -0.62 -1.72 0.00 0.00 179.24 177.22 3kop n GLU 142 N -4.74 0.30 0.00 3.56 4.71 -1.08 -1.46 120.64 121.94 3kop n GLU 142 Ca 0.09 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.24 3kop n GLU 142 Cb 0.17 -1.27 0.00 0.00 -1.01 0.00 0.00 31.44 29.33 3kop n GLU 142 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 3kop n ALA 144 N 0.64 0.00 -0.22 0.62 0.00 0.27 -1.34 120.51 120.47 3kop n ALA 144 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.37 3kop n ALA 144 Cb 0.12 0.00 0.03 0.00 0.00 0.00 0.00 19.45 19.60 3kop n ALA 144 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3kop h ALA 145 N 0.00 0.80 -0.43 0.00 0.00 -1.51 -1.45 119.26 116.68 3kop h ALA 145 Ca 0.00 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 54.71 3kop h ALA 145 Cb 0.00 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 3kop h ALA 145 CO 0.00 0.38 0.07 0.00 0.00 0.00 0.00 179.25 179.70 3kop h ALA 146 N 1.12 1.32 -0.11 0.00 0.00 -1.48 -2.25 119.26 117.85 3kop h ALA 146 Ca 0.21 -0.20 -0.20 0.00 0.00 0.00 0.00 54.91 54.73 3kop h ALA 146 Cb 0.15 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.76 3kop h ALA 146 CO -0.02 0.48 -0.75 0.00 0.00 0.00 0.00 179.25 178.95 3kop h GLN 148 N 0.38 0.87 0.00 0.00 4.15 -1.12 0.10 115.11 119.48 3kop h GLN 148 Ca -0.04 -0.05 -0.09 0.00 0.77 0.00 0.00 58.65 59.23 3kop h GLN 148 Cb 1.35 -0.20 -0.01 0.00 0.21 0.00 0.00 27.48 28.83 3kop h GLN 148 CO 0.14 0.57 -0.45 0.22 -1.93 0.00 0.00 178.83 177.38 3kop h ASP 149 N 0.89 0.00 -0.27 -0.69 3.58 -0.75 -2.68 116.42 116.51 3kop h ASP 149 Ca 0.43 0.00 -0.16 0.00 0.42 0.00 0.00 57.03 57.73 3kop h ASP 149 Cb 0.38 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.43 3kop h ASP 149 CO -0.25 0.45 -0.44 0.40 -2.88 0.00 0.00 179.24 176.52 3kop h ILE 150 N 0.00 1.30 0.00 2.25 2.04 -0.34 0.74 117.51 123.49 3kop h ILE 150 Ca -0.00 -1.64 0.00 0.00 1.00 0.00 0.00 64.86 64.22 3kop h ILE 150 Cb 0.99 1.68 0.00 0.00 -0.74 0.00 0.00 36.82 38.75 3kop h ILE 150 CO 0.06 0.53 0.00 1.87 0.00 0.00 0.00 178.15 180.60 3kop n TRP 151 N -4.13 0.00 0.00 1.37 -0.00 -0.05 -0.80 117.44 113.83 3kop n TRP 151 Ca -0.05 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.45 3kop n TRP 151 Cb 0.57 0.00 0.00 0.00 -0.00 0.00 0.00 31.31 31.88 3kop n TRP 151 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 3kop n GLY 153 N -0.68 0.00 0.00 5.87 0.00 0.26 -5.04 105.19 105.60 3kop n GLY 153 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3kop n GLY 153 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kop n GLY 154 N 0.00 -0.42 0.30 -0.02 0.00 0.02 -4.79 105.19 100.28 3kop n GLY 154 Ca 0.00 -1.74 0.05 0.00 0.00 0.00 0.00 46.02 44.33 3kop n GLY 154 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kop n ALA 155 N -0.39 2.25 -1.72 4.61 0.00 -1.26 -4.43 120.51 119.57 3kop n ALA 155 Ca 0.00 -1.62 -0.42 0.00 0.00 0.00 0.00 53.44 51.40 3kop n ALA 155 Cb 0.00 -0.30 -0.03 0.00 0.00 0.00 0.00 19.45 19.12 3kop n ALA 155 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3kop n ARG 156 N -0.49 2.78 -1.39 0.00 5.12 -1.26 -1.60 116.66 119.81 3kop n ARG 156 Ca 0.10 1.00 -0.14 0.00 -1.93 0.00 0.00 57.85 56.88 3kop n ARG 156 Cb 0.48 -2.84 -0.06 0.00 -1.16 0.00 0.00 32.46 28.88 3kop n ARG 156 CO 0.00 0.00 0.00 -0.25 -1.93 0.00 0.00 177.63 175.45 3kop n ASP 157 N 3.80 -5.33 -4.83 0.55 8.00 -1.26 -4.96 116.55 112.52 3kop n ASP 157 Ca 0.15 0.35 -0.35 0.00 0.71 0.00 0.00 54.79 55.65 3kop n ASP 157 Cb 0.35 -4.24 -0.07 0.00 -0.02 0.00 0.00 41.12 37.14 3kop n ASP 157 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 3kop s GLU 158 N -3.15 3.27 -0.04 -1.24 2.56 -0.63 -4.60 118.70 114.87 3kop s GLU 158 Ca 0.00 -0.29 0.02 0.00 0.00 0.00 0.00 54.97 54.70 3kop s GLU 158 Cb 0.00 -3.03 0.01 0.00 2.00 0.00 0.00 34.13 33.11 3kop s GLU 158 CO 0.00 0.72 -0.08 0.99 -0.56 0.00 0.00 175.26 176.33 3kop s THR 159 N -1.08 0.81 -0.25 -1.70 2.01 -1.26 -2.31 115.64 111.86 3kop s THR 159 Ca 0.18 -0.32 -0.12 0.00 0.31 0.00 0.00 61.69 61.74 3kop s THR 159 Cb -0.12 -0.76 -0.05 0.00 0.01 0.00 0.00 72.50 71.59 3kop s THR 159 CO 0.08 0.27 0.25 -0.22 -0.69 0.00 0.00 174.62 174.31 3kop s LEU 160 N 0.58 4.09 -0.12 4.42 2.96 -0.06 -1.65 118.68 128.90 3kop s LEU 160 Ca -0.10 0.19 0.01 0.00 -0.22 0.00 0.00 54.13 54.01 3kop s LEU 160 Cb -0.13 -2.24 0.02 0.00 0.50 0.00 0.00 46.19 44.34 3kop s LEU 160 CO 0.01 -0.03 -0.15 -0.89 -1.32 0.00 0.00 176.35 173.98 3kop s THR 161 N 1.41 1.53 -0.22 3.68 2.01 -0.03 -2.32 115.64 121.71 3kop s THR 161 Ca 0.11 -0.64 -0.10 0.00 0.31 0.00 0.00 61.69 61.37 3kop s THR 161 Cb -0.15 -1.41 -0.05 0.00 0.01 0.00 0.00 72.50 70.90 3kop s THR 161 CO 0.07 0.45 0.14 -0.36 -0.69 0.00 0.00 174.62 174.23 3kop s PHE 162 N 1.16 3.37 0.05 4.92 0.40 0.52 -1.34 117.98 127.06 3kop s PHE 162 Ca -0.03 0.29 -0.01 0.00 -0.60 0.00 0.00 56.93 56.58 3kop s PHE 162 Cb -0.14 -2.20 -0.04 0.00 0.51 0.00 0.00 43.02 41.15 3kop s PHE 162 CO -0.05 0.20 -0.03 -1.54 0.70 0.00 0.00 175.22 174.50 3kop s SER 163 N 0.64 0.47 0.20 1.36 1.04 -0.42 -1.53 113.70 115.46 3kop s SER 163 Ca 0.08 -0.90 -0.30 0.00 0.48 0.00 0.00 55.95 55.30 3kop s SER 163 Cb -0.12 0.18 -0.09 0.00 0.10 0.00 0.00 66.02 66.09 3kop s SER 163 CO 0.01 -0.54 1.32 -0.13 0.98 0.00 0.00 173.24 174.88 3kop s ARG 164 N -3.44 4.38 -0.18 4.02 0.52 -1.26 -0.26 118.95 122.73 3kop s ARG 164 Ca 0.03 2.07 -0.16 0.00 -0.52 0.00 0.00 55.73 57.15 3kop s ARG 164 Cb 0.04 -3.19 -0.04 0.00 0.52 0.00 0.00 34.95 32.29 3kop s ARG 164 CO -0.08 -0.26 0.39 0.00 0.02 0.00 0.00 175.30 175.37 3kop s ALA 165 N 0.08 3.55 0.00 2.13 0.00 -0.38 -4.65 121.76 122.49 3kop s ALA 165 Ca 0.57 -0.46 0.00 0.00 0.00 0.00 0.00 51.96 52.07 3kop s ALA 165 Cb -0.37 -2.58 0.00 0.00 0.00 0.00 0.00 23.12 20.17 3kop s ALA 165 CO 0.39 -0.17 0.00 0.39 0.00 0.00 0.00 175.76 176.37