#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kop n ASN -5 N 0.00 2.63 0.27 -1.84 3.02 -1.26 -4.95 115.26 113.13 3kop n ASN -5 Ca 0.00 0.97 -0.16 0.00 -0.03 0.00 0.00 54.58 55.37 3kop n ASN -5 Cb 0.00 -1.57 -0.08 0.00 -0.61 0.00 0.00 39.78 37.52 3kop n ASN -5 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 3kop h LEU -4 N 1.40 -0.55 0.00 3.41 5.85 -1.87 -3.44 115.31 120.12 3kop h LEU -4 Ca -0.51 -0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.19 3kop h LEU -4 Cb 1.31 0.14 0.00 0.00 0.37 0.00 0.00 40.66 42.48 3kop h LEU -4 CO 0.57 -0.32 0.00 -1.22 -0.34 0.00 0.00 178.44 177.13 3kop n TYR -3 N -5.33 0.00 -2.90 1.25 4.01 -1.26 -4.98 117.16 107.95 3kop n TYR -3 Ca -0.12 0.00 -0.41 0.00 -0.16 0.00 0.00 57.90 57.21 3kop n TYR -3 Cb 0.29 0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 39.28 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 0.00 3.44 -0.09 -0.72 5.36 -1.26 -4.90 117.98 119.81 3kop s PHE -2 Ca 0.00 1.26 0.08 0.00 -0.96 0.00 0.00 56.93 57.31 3kop s PHE -2 Cb 0.00 -3.00 0.14 0.00 -0.34 0.00 0.00 43.02 39.82 3kop s PHE -2 CO 0.00 -0.21 1.08 1.04 -1.46 0.00 0.00 175.22 175.67 3kop n GLN -1 N 5.09 2.30 0.00 10.12 6.02 -1.26 -4.75 117.38 134.90 3kop n GLN -1 Ca 0.04 -1.98 0.00 0.00 -0.01 0.00 0.00 57.00 55.04 3kop n GLN -1 Cb 0.49 -1.23 0.00 0.00 1.02 0.00 0.00 30.24 30.52 3kop n GLN -1 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3kop n GLY 0 N -0.85 0.86 3.74 1.08 0.00 -1.26 -4.98 105.19 103.78 3kop n GLY 0 Ca 0.07 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.69 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 -4.13 3.29 0.10 4.61 0.00 -1.26 -5.14 121.76 119.23 3kop s ALA 2 Ca 0.00 0.62 0.01 0.00 0.00 0.00 0.00 51.96 52.59 3kop s ALA 2 Cb 0.00 -3.26 -0.04 0.00 0.00 0.00 0.00 23.12 19.82 3kop s ALA 2 CO 0.00 0.04 0.22 1.03 0.00 0.00 0.00 175.76 177.05 3kop s ARG 3 N -0.49 3.36 0.05 0.00 0.52 -1.26 -5.05 118.95 116.08 3kop s ARG 3 Ca 0.45 -0.54 0.04 0.00 -0.52 0.00 0.00 55.73 55.16 3kop s ARG 3 Cb -0.25 -2.97 -0.02 0.00 0.52 0.00 0.00 34.95 32.23 3kop s ARG 3 CO 0.31 0.57 -0.12 0.71 0.02 0.00 0.00 175.30 176.79 3kop s TYR 4 N -1.59 1.03 -0.01 -0.53 2.02 -1.26 -1.08 117.35 115.93 3kop s TYR 4 Ca 0.34 -0.42 0.06 0.00 -0.37 0.00 0.00 57.07 56.68 3kop s TYR 4 Cb -0.12 -0.60 -0.03 0.00 -0.40 0.00 0.00 41.96 40.82 3kop s TYR 4 CO 0.27 0.01 -0.20 0.96 -1.57 0.00 0.00 175.55 175.02 3kop s ILE 5 N -1.13 2.59 0.08 2.71 -4.36 -0.41 -0.66 121.20 120.02 3kop s ILE 5 Ca -0.03 -1.02 -0.14 0.00 -0.26 0.00 0.00 60.65 59.21 3kop s ILE 5 Cb -0.09 -2.00 -0.06 0.00 1.25 0.00 0.00 42.46 41.56 3kop s ILE 5 CO 0.01 0.51 0.47 0.20 0.24 0.00 0.00 174.94 176.37 3kop s ASN 6 N -0.91 6.79 -0.15 4.36 0.01 -0.08 -0.93 114.94 124.03 3kop s ASN 6 Ca 0.12 0.98 -0.00 0.00 -0.71 0.00 0.00 52.86 53.25 3kop s ASN 6 Cb -0.10 -2.25 0.03 0.00 0.41 0.00 0.00 41.25 39.34 3kop s ASN 6 CO 0.01 0.20 -0.07 -0.63 -1.51 0.00 0.00 177.10 175.10 3kop s ILE 7 N -1.31 1.18 -0.05 0.60 1.01 0.16 -1.30 121.20 121.49 3kop s ILE 7 Ca 0.32 -0.55 0.03 0.00 0.00 0.00 0.00 60.65 60.45 3kop s ILE 7 Cb -0.16 -1.26 0.01 0.00 0.01 0.00 0.00 42.46 41.06 3kop s ILE 7 CO 0.17 0.25 -0.13 -0.89 0.00 0.00 0.00 174.94 174.34 3kop s THR 8 N 1.62 1.17 -0.40 2.92 2.01 0.57 -1.14 115.64 122.40 3kop s THR 8 Ca 0.02 -0.54 -0.18 0.00 0.31 0.00 0.00 61.69 61.30 3kop s THR 8 Cb -0.14 -1.04 0.01 0.00 0.01 0.00 0.00 72.50 71.34 3kop s THR 8 CO -0.08 0.35 0.50 -0.76 -0.69 0.00 0.00 174.62 173.94 3kop s LEU 9 N 0.34 4.59 0.15 4.42 1.43 -0.04 -0.34 118.68 129.24 3kop s LEU 9 Ca -0.08 -0.37 -0.09 0.00 -1.03 0.00 0.00 54.13 52.55 3kop s LEU 9 Cb -0.13 -2.52 -0.00 0.00 0.03 0.00 0.00 46.19 43.57 3kop s LEU 9 CO 0.03 -0.58 1.48 -0.33 0.23 0.00 0.00 176.35 177.18 3kop h GLU 10 N 8.66 0.85 -0.00 1.70 4.39 -1.54 0.31 114.58 128.95 3kop h GLU 10 Ca -0.27 -0.47 -0.02 0.00 0.34 0.00 0.00 59.36 58.94 3kop h GLU 10 Cb 1.11 0.03 0.00 0.00 -0.10 0.00 0.00 28.75 29.79 3kop h GLU 10 CO 0.80 1.11 -0.07 -0.22 -1.16 0.00 0.00 179.01 179.48 3kop h LYS 11 N 0.69 0.05 0.00 2.33 3.64 -1.82 -3.20 116.57 118.26 3kop h LYS 11 Ca 0.05 -0.05 -0.03 0.00 -1.27 0.00 0.00 60.65 59.34 3kop h LYS 11 Cb 1.02 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 32.84 3kop h LYS 11 CO 0.10 0.78 -0.15 0.00 -2.27 0.00 0.00 179.45 177.91 3kop h ARG 12 N -0.65 0.00 -4.33 1.90 3.08 -1.95 -3.47 114.38 108.95 3kop h ARG 12 Ca -0.01 0.00 -0.25 0.00 0.07 0.00 0.00 59.98 59.80 3kop h ARG 12 Cb 0.80 0.00 0.10 0.00 0.08 0.00 0.00 29.97 30.95 3kop h ARG 12 CO 0.01 0.15 -0.48 0.41 -1.07 0.00 0.00 179.97 179.00 3kop n GLY 13 N -0.03 -0.07 3.29 0.04 0.00 0.11 -5.03 105.19 103.49 3kop n GLY 13 Ca -0.00 -0.07 -0.32 0.00 0.00 0.00 0.00 46.02 45.63 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 -3.23 2.49 0.02 1.61 1.01 -0.95 -4.97 120.40 116.38 3kop s VAL 14 Ca 0.22 -0.87 0.06 0.00 0.00 0.00 0.00 61.98 61.39 3kop s VAL 14 Cb -0.10 -1.99 -0.02 0.00 0.00 0.00 0.00 36.38 34.27 3kop s VAL 14 CO 0.49 0.55 -0.18 -0.89 0.00 0.00 0.00 175.10 175.07 3kop s THR 15 N 0.27 1.43 0.33 3.92 2.01 -1.26 -0.86 115.64 121.48 3kop s THR 15 Ca -0.14 -0.98 0.04 0.00 0.31 0.00 0.00 61.69 60.92 3kop s THR 15 Cb -0.17 -1.23 -0.06 0.00 0.01 0.00 0.00 72.50 71.04 3kop s THR 15 CO 0.07 0.23 0.05 0.00 -0.69 0.00 0.00 174.62 174.28 3kop s LYS 17 N -3.88 1.69 -0.03 0.00 2.20 -0.59 -0.66 119.74 118.47 3kop s LYS 17 Ca 0.36 -0.60 0.03 0.00 -0.36 0.00 0.00 55.97 55.41 3kop s LYS 17 Cb 0.09 -1.49 -0.00 0.00 -1.51 0.00 0.00 37.83 34.92 3kop s LYS 17 CO 0.16 0.26 -0.12 0.00 -0.36 0.00 0.00 175.35 175.28 3kop s ALA 18 N -0.02 1.11 0.09 3.13 0.00 -0.11 -0.38 121.76 125.58 3kop s ALA 18 Ca -0.02 -0.48 -0.31 0.00 0.00 0.00 0.00 51.96 51.15 3kop s ALA 18 Cb -0.11 -0.37 -0.08 0.00 0.00 0.00 0.00 23.12 22.57 3kop s ALA 18 CO 0.02 0.20 1.44 -1.17 0.00 0.00 0.00 175.76 176.25 3kop s LEU 19 N 0.06 4.36 -0.07 0.00 2.96 0.19 -1.29 118.68 124.89 3kop s LEU 19 Ca -0.02 2.33 -0.30 0.00 -0.22 0.00 0.00 54.13 55.93 3kop s LEU 19 Cb -0.09 -3.58 -0.02 0.00 0.50 0.00 0.00 46.19 43.00 3kop s LEU 19 CO 0.01 -0.71 1.00 -0.22 -1.32 0.00 0.00 176.35 175.11 3kop s LEU 20 N 1.52 4.29 -1.38 -0.68 2.96 -0.24 -1.13 118.68 124.01 3kop s LEU 20 Ca 0.66 1.57 -0.09 0.00 -0.22 0.00 0.00 54.13 56.05 3kop s LEU 20 Cb -0.37 -3.56 0.09 0.00 0.50 0.00 0.00 46.19 42.85 3kop s LEU 20 CO 0.30 -0.38 2.31 0.18 -1.32 0.00 0.00 176.35 177.43 3kop n LEU 21 N 4.64 7.59 0.29 -0.68 4.77 0.02 -4.66 117.00 128.98 3kop n LEU 21 Ca 0.08 -4.63 0.15 0.00 -0.03 0.00 0.00 56.01 51.58 3kop n LEU 21 Cb 0.49 -1.47 0.89 0.00 -2.33 0.00 0.00 43.42 41.01 3kop n LEU 21 CO 0.52 1.73 1.09 0.44 -1.33 0.00 0.00 177.39 179.84 3kop h ASP 22 N 5.21 0.00 0.06 -1.43 3.32 -1.84 0.57 116.42 122.30 3kop h ASP 22 Ca 0.62 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.67 3kop h ASP 22 Cb 0.45 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.00 3kop h ASP 22 CO 1.64 0.03 -0.03 -2.24 -1.72 0.00 0.00 179.24 176.91 3kop h ASP 23 N 0.00 -0.07 0.00 6.45 2.03 -1.90 -3.31 116.42 119.62 3kop h ASP 23 Ca -0.00 -0.55 0.00 0.00 -0.73 0.00 0.00 57.03 55.75 3kop h ASP 23 Cb 0.08 0.02 0.00 0.00 -0.83 0.00 0.00 39.33 38.60 3kop h ASP 23 CO 0.00 0.64 -1.48 1.33 -1.03 0.00 0.00 179.24 178.70 3kop n VAL 24 N -4.78 0.00 -3.10 4.15 0.24 -1.19 -4.45 118.33 109.21 3kop n VAL 24 Ca -0.07 -0.29 -0.25 0.00 -2.04 0.00 0.00 64.34 61.69 3kop n VAL 24 Cb 0.30 0.43 -0.05 0.00 -1.47 0.00 0.00 33.84 33.05 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 -1.88 3.75 -0.25 2.33 0.00 0.18 -4.44 120.51 120.21 3kop n ALA 25 Ca -0.01 -4.30 -0.06 0.00 0.00 0.00 0.00 53.44 49.08 3kop n ALA 25 Cb 0.42 -0.81 0.05 0.00 0.00 0.00 0.00 19.45 19.10 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 3.27 0.97 -0.22 0.00 0.13 -1.66 -1.28 132.00 133.20 3kop h PRO 26 Ca 0.13 -0.12 -0.12 0.00 -0.87 0.00 0.00 66.00 65.02 3kop h PRO 26 Cb 0.67 -0.18 -0.00 0.00 0.13 0.00 0.00 31.00 31.62 3kop h PRO 26 CO 0.72 0.74 -0.32 0.00 -0.23 0.00 0.00 178.00 178.91 3kop h ARG 27 N 0.94 0.60 -0.35 0.86 3.08 -1.92 -1.86 114.38 115.74 3kop h ARG 27 Ca 0.24 -0.35 -0.09 0.00 0.07 0.00 0.00 59.98 59.85 3kop h ARG 27 Cb 0.07 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.14 3kop h ARG 27 CO -0.04 0.96 -0.13 1.15 -1.07 0.00 0.00 179.97 180.85 3kop h THR 28 N 0.29 1.28 -0.76 2.04 2.02 -1.90 -1.22 112.91 114.66 3kop h THR 28 Ca 0.02 -1.22 0.01 0.00 0.77 0.00 0.00 66.41 65.99 3kop h THR 28 Cb 0.90 1.35 -0.04 0.00 -1.74 0.00 0.00 68.15 68.61 3kop h THR 28 CO 0.07 0.40 0.50 0.28 0.37 0.00 0.00 175.52 177.14 3kop h SER 29 N 0.49 0.85 -0.19 4.18 0.02 -1.21 -1.24 113.55 116.45 3kop h SER 29 Ca 0.08 -0.02 -0.17 0.00 -0.84 0.00 0.00 61.79 60.85 3kop h SER 29 Cb 0.65 -0.21 0.00 0.00 0.14 0.00 0.00 62.40 62.99 3kop h SER 29 CO 0.04 0.61 -0.54 0.50 -1.14 0.00 0.00 176.83 176.30 3kop h LYS 30 N 1.01 0.70 -0.43 3.45 3.64 -1.19 0.37 116.57 124.11 3kop h LYS 30 Ca 0.29 -0.50 0.05 0.00 -1.27 0.00 0.00 60.65 59.21 3kop h LYS 30 Cb -0.08 0.08 -0.04 0.00 -0.41 0.00 0.00 32.23 31.78 3kop h LYS 30 CO -0.08 1.12 0.18 0.00 -2.27 0.00 0.00 179.45 178.40 3kop h ALA 31 N 0.58 0.52 0.05 5.00 0.00 -1.00 -0.04 119.26 124.37 3kop h ALA 31 Ca -0.01 0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 3kop h ALA 31 Cb 1.16 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.94 3kop h ALA 31 CO 0.12 -0.20 -0.02 0.28 0.00 0.00 0.00 179.25 179.42 3kop h VAL 32 N 0.36 1.27 -0.33 0.00 2.07 -1.19 -3.19 116.25 115.25 3kop h VAL 32 Ca 0.20 -1.11 0.06 0.00 0.82 0.00 0.00 66.70 66.66 3kop h VAL 32 Cb 0.16 2.00 -0.05 0.00 -1.52 0.00 0.00 31.29 31.87 3kop h VAL 32 CO -0.18 0.28 -0.01 -0.25 0.02 0.00 0.00 177.57 177.43 3kop h TRP 33 N -0.56 -0.04 -0.20 1.57 2.91 -0.70 -0.81 115.95 118.11 3kop h TRP 33 Ca -0.01 0.02 0.06 0.00 1.13 0.00 0.00 58.89 60.10 3kop h TRP 33 Cb 0.50 0.07 -0.01 0.00 -0.51 0.00 0.00 29.16 29.21 3kop h TRP 33 CO 0.09 -0.07 0.20 -0.44 -1.03 0.00 0.00 178.44 177.19 3kop h ASP 34 N 0.08 0.00 -0.02 2.65 3.32 -1.10 -2.56 116.42 118.78 3kop h ASP 34 Ca 0.16 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.21 3kop h ASP 34 Cb 0.22 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.77 3kop h ASP 34 CO -0.28 0.00 -0.26 0.00 -1.72 0.00 0.00 179.24 176.99 3kop n ALA 35 N -2.38 3.05 -1.77 3.45 0.00 -0.36 -4.99 120.51 117.50 3kop n ALA 35 Ca 0.02 -0.66 -0.36 0.00 0.00 0.00 0.00 53.44 52.43 3kop n ALA 35 Cb 0.34 -0.80 -0.01 0.00 0.00 0.00 0.00 19.45 18.97 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 -2.26 3.97 0.49 0.00 1.43 -0.91 -4.27 118.68 117.13 3kop s LEU 36 Ca 0.23 2.23 -0.18 0.00 -1.03 0.00 0.00 54.13 55.38 3kop s LEU 36 Cb 0.19 -4.32 -0.08 0.00 0.03 0.00 0.00 46.19 42.01 3kop s LEU 36 CO 0.45 -0.92 0.99 -2.16 0.23 0.00 0.00 176.35 174.93 3kop s PRO 37 N -2.82 3.96 -0.10 1.29 0.04 -1.26 -4.93 135.00 131.18 3kop s PRO 37 Ca 0.65 1.06 0.02 0.00 0.04 0.00 0.00 61.00 62.77 3kop s PRO 37 Cb -0.26 -2.14 0.01 0.00 0.04 0.00 0.00 34.50 32.16 3kop s PRO 37 CO 0.31 -0.26 -0.15 -0.65 0.04 0.00 0.00 177.00 176.30 3kop s GLN 38 N -3.74 2.12 -0.09 4.56 -1.52 -0.56 -5.00 119.66 115.43 3kop s GLN 38 Ca 0.61 -0.53 -0.04 0.00 -1.95 0.00 0.00 55.36 53.45 3kop s GLN 38 Cb -0.11 -1.79 0.05 0.00 -0.22 0.00 0.00 33.01 30.94 3kop s GLN 38 CO 0.25 -0.04 0.21 0.45 -0.25 0.00 0.00 175.29 175.91 3kop s SER 39 N 0.93 -0.08 0.23 5.90 0.15 -1.26 -0.75 113.70 118.82 3kop s SER 39 Ca -0.08 0.44 -0.22 0.00 0.70 0.00 0.00 55.95 56.78 3kop s SER 39 Cb -0.15 0.35 0.04 0.00 -1.71 0.00 0.00 66.02 64.54 3kop s SER 39 CO -0.00 -0.17 0.75 -0.55 1.20 0.00 0.00 173.24 174.46 3kop s SER 40 N 1.41 -0.30 0.02 5.45 0.15 -0.81 -4.99 113.70 114.64 3kop s SER 40 Ca -0.07 -0.45 -0.39 0.00 0.70 0.00 0.00 55.95 55.74 3kop s SER 40 Cb -0.11 0.65 -0.19 0.00 -1.71 0.00 0.00 66.02 64.66 3kop s SER 40 CO -0.07 -1.18 1.06 1.67 1.20 0.00 0.00 173.24 175.92 3kop n GLN 41 N -0.44 0.12 -3.03 5.44 -0.06 -1.26 -0.72 117.38 117.43 3kop n GLN 41 Ca -0.07 0.04 -0.31 0.00 -2.00 0.00 0.00 57.00 54.67 3kop n GLN 41 Cb 0.60 -1.53 -0.04 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 -0.02 4.78 0.02 1.69 0.11 -0.94 -4.34 120.40 121.71 3kop s VAL 42 Ca 0.88 0.67 0.03 0.00 -2.93 0.00 0.00 61.98 60.63 3kop s VAL 42 Cb -1.21 -3.68 -0.01 0.00 -1.53 0.00 0.00 36.38 29.94 3kop s VAL 42 CO 0.56 -0.36 -0.09 -0.36 -3.33 0.00 0.00 175.10 171.52 3kop s PHE 43 N -2.17 0.81 0.08 1.54 0.08 0.09 -4.88 117.98 113.53 3kop s PHE 43 Ca 0.51 -0.28 -0.21 0.00 0.12 0.00 0.00 56.93 57.08 3kop s PHE 43 Cb -0.10 -0.50 -0.07 0.00 -0.57 0.00 0.00 43.02 41.78 3kop s PHE 43 CO 0.26 -0.02 0.63 -1.58 -0.10 0.00 0.00 175.22 174.41 3kop s HIS 44 N -0.65 3.81 0.48 0.36 5.65 -1.26 -1.19 115.29 122.50 3kop s HIS 44 Ca -0.01 1.36 -0.24 0.00 0.25 0.00 0.00 55.06 56.42 3kop s HIS 44 Cb -0.06 -2.59 -0.07 0.00 -1.18 0.00 0.00 32.58 28.68 3kop s HIS 44 CO 0.00 0.53 1.38 0.41 -0.65 0.00 0.00 174.74 176.41 3kop n GLY 45 N 1.81 0.85 0.01 1.59 0.00 -0.07 -4.95 105.19 104.43 3kop n GLY 45 Ca -0.08 0.13 0.08 0.00 0.00 0.00 0.00 46.02 46.14 3kop n GLY 45 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3kop n LYS 46 N -0.42 0.55 0.00 1.61 5.02 -1.26 -4.69 118.16 118.96 3kop n LYS 46 Ca 0.07 -0.15 0.00 0.00 -2.02 0.00 0.00 58.31 56.22 3kop n LYS 46 Cb 0.42 -1.40 0.00 0.00 -0.02 0.00 0.00 35.03 34.04 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 -2.10 0.00 1.59 2.13 0.18 -1.26 -4.78 117.16 112.92 3kop n TYR 47 Ca -0.04 0.00 0.12 0.00 1.88 0.00 0.00 57.90 59.86 3kop n TYR 47 Cb 0.46 0.00 0.54 0.00 -0.38 0.00 0.00 39.34 39.96 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 -2.05 2.58 0.00 -3.48 0.00 -1.26 -4.69 120.51 111.61 3kop n ALA 48 Ca 0.00 -0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.08 3kop n ALA 48 Cb 0.45 -1.22 0.00 0.00 0.00 0.00 0.00 19.45 18.68 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 -0.17 0.00 -2.17 0.00 0.63 -1.26 -4.24 116.66 109.45 3kop n ARG 49 Ca 0.17 0.00 -0.42 0.00 -0.92 0.00 0.00 57.85 56.68 3kop n ARG 49 Cb 0.24 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.15 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 7.88 4.71 -3.83 6.15 3.02 -1.26 -4.57 115.26 127.36 3kop n ASN 50 Ca 0.00 -3.02 -0.14 0.00 -0.03 0.00 0.00 54.58 51.39 3kop n ASN 50 Cb 0.00 -1.54 -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 1.35 0.04 0.24 3.52 2.12 -1.26 -1.24 118.70 123.47 3kop s GLU 51 Ca 0.42 0.07 0.11 0.00 0.36 0.00 0.00 54.97 55.93 3kop s GLU 51 Cb 0.11 -0.18 -0.05 0.00 0.26 0.00 0.00 34.13 34.27 3kop s GLU 51 CO -0.02 -0.07 -0.19 0.96 -0.54 0.00 0.00 175.26 175.39 3kop s ILE 52 N 0.53 2.21 0.20 -3.70 -4.36 -0.41 -0.89 121.20 114.78 3kop s ILE 52 Ca -0.05 -2.25 -0.22 0.00 -0.26 0.00 0.00 60.65 57.88 3kop s ILE 52 Cb -0.07 -2.16 0.05 0.00 1.25 0.00 0.00 42.46 41.53 3kop s ILE 52 CO -0.01 -0.39 0.63 -0.72 0.24 0.00 0.00 174.94 174.68 3kop s TYR 53 N -2.44 -0.38 0.39 1.37 1.13 -0.33 -0.46 117.35 116.63 3kop s TYR 53 Ca 0.25 0.08 0.05 0.00 -1.41 0.00 0.00 57.07 56.04 3kop s TYR 53 Cb -0.05 0.58 -0.07 0.00 -1.10 0.00 0.00 41.96 41.33 3kop s TYR 53 CO 0.11 -0.98 0.03 0.54 -2.51 0.00 0.00 175.55 172.75 3kop s ASN 54 N -2.82 3.32 -0.12 -0.18 2.20 -0.33 -0.73 114.94 116.28 3kop s ASN 54 Ca 0.05 -1.40 0.00 0.00 -0.94 0.00 0.00 52.86 50.57 3kop s ASN 54 Cb -0.02 -0.20 0.02 0.00 -2.00 0.00 0.00 41.25 39.04 3kop s ASN 54 CO -0.06 -0.55 -0.11 -0.76 -2.94 0.00 0.00 177.10 172.69 3kop s LEU 55 N -3.64 1.44 0.11 3.54 1.43 -1.26 -2.04 118.68 118.27 3kop s LEU 55 Ca 0.33 -0.37 0.06 0.00 -1.03 0.00 0.00 54.13 53.12 3kop s LEU 55 Cb 0.09 -0.98 -0.04 0.00 0.03 0.00 0.00 46.19 45.30 3kop s LEU 55 CO 0.16 -0.07 -0.14 0.68 0.23 0.00 0.00 176.35 177.21 3kop s VAL 56 N 1.46 1.30 0.45 -1.59 -7.23 0.24 -4.86 120.40 110.18 3kop s VAL 56 Ca 0.02 -1.64 -0.25 0.00 -1.81 0.00 0.00 61.98 58.30 3kop s VAL 56 Cb -0.13 -1.46 -0.09 0.00 0.56 0.00 0.00 36.38 35.26 3kop s VAL 56 CO -0.07 -0.37 1.28 -2.65 -0.31 0.00 0.00 175.10 172.97 3kop n PRO 57 N 0.68 1.89 -1.60 4.82 -0.02 -1.26 -0.06 135.00 139.45 3kop n PRO 57 Ca -0.17 0.67 -0.43 0.00 -2.02 0.00 0.00 63.50 61.55 3kop n PRO 57 Cb 0.56 -2.41 -0.01 0.00 -0.02 0.00 0.00 33.50 31.62 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 -0.36 -0.08 0.00 3.55 0.00 -0.62 -4.63 120.51 118.37 3kop n ALA 58 Ca 0.07 0.34 0.00 0.00 0.00 0.00 0.00 53.44 53.85 3kop n ALA 58 Cb 0.41 -2.04 0.00 0.00 0.00 0.00 0.00 19.45 17.82 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 -0.01 0.00 -2.83 0.00 1.16 -1.26 -5.03 117.46 109.49 3kop n PHE 59 Ca 0.09 0.00 -0.31 0.00 -1.87 0.00 0.00 57.45 55.36 3kop n PHE 59 Cb 0.34 0.00 -0.04 0.00 -1.61 0.00 0.00 39.48 38.17 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 -1.44 3.27 0.40 1.98 0.00 -1.26 -4.96 121.76 119.75 3kop s ALA 60 Ca 0.00 -0.04 0.06 0.00 0.00 0.00 0.00 51.96 51.99 3kop s ALA 60 Cb 0.00 -2.82 0.81 0.00 0.00 0.00 0.00 23.12 21.11 3kop s ALA 60 CO 0.00 0.03 2.03 -1.35 0.00 0.00 0.00 175.76 176.47 3kop h PRO 61 N 1.45 0.55 -3.32 0.00 0.11 -1.97 -3.41 132.00 125.41 3kop h PRO 61 Ca -0.47 -0.04 -0.14 0.00 0.11 0.00 0.00 66.00 65.45 3kop h PRO 61 Cb 1.18 -0.12 -0.21 0.00 0.11 0.00 0.00 31.00 31.96 3kop h PRO 61 CO 0.64 0.39 -0.42 -1.59 -0.21 0.00 0.00 178.00 176.80 3kop s LYS 62 N -5.43 0.49 0.46 1.05 -2.85 -1.26 -5.14 119.74 107.05 3kop s LYS 62 Ca -0.08 -0.20 -0.23 0.00 -1.00 0.00 0.00 55.97 54.45 3kop s LYS 62 Cb 0.17 0.21 -0.07 0.00 -2.06 0.00 0.00 37.83 36.08 3kop s LYS 62 CO 0.74 -0.12 1.22 -1.21 0.10 0.00 0.00 175.35 176.08 3kop s GLU 63 N -1.07 3.72 0.51 1.78 0.41 -1.26 -4.92 118.70 117.87 3kop s GLU 63 Ca -0.11 1.91 0.29 0.00 -0.41 0.00 0.00 54.97 56.65 3kop s GLU 63 Cb -0.06 -2.47 1.26 0.00 -1.78 0.00 0.00 34.13 31.09 3kop s GLU 63 CO 0.02 -0.62 1.96 -1.00 -0.49 0.00 0.00 175.26 175.13 3kop h PRO 64 N 2.12 0.00 0.00 0.39 0.13 -1.98 -3.49 132.00 129.16 3kop h PRO 64 Ca -0.50 0.00 0.07 0.00 -0.87 0.00 0.00 66.00 64.70 3kop h PRO 64 Cb 1.25 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.37 3kop h PRO 64 CO 0.60 0.12 -0.09 0.41 -0.23 0.00 0.00 178.00 178.81 3kop n GLY 65 N -0.13 -2.00 3.72 1.56 0.00 -1.26 -4.81 105.19 102.28 3kop n GLY 65 Ca -0.00 -1.37 -0.42 0.00 0.00 0.00 0.00 46.02 44.22 3kop n GLY 65 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kop s ALA 66 N -1.33 3.88 -0.29 4.61 0.00 -1.26 -4.99 121.76 122.38 3kop s ALA 66 Ca 0.00 1.53 -0.13 0.00 0.00 0.00 0.00 51.96 53.36 3kop s ALA 66 Cb 0.00 -3.67 0.10 0.00 0.00 0.00 0.00 23.12 19.55 3kop s ALA 66 CO 0.00 -0.89 0.66 -2.00 0.00 0.00 0.00 175.76 173.53 3kop s GLU 67 N 0.96 0.64 -1.46 0.00 2.12 -1.26 -4.94 118.70 114.76 3kop s GLU 67 Ca 0.72 1.32 -0.01 0.00 0.36 0.00 0.00 54.97 57.36 3kop s GLU 67 Cb -0.48 0.46 0.01 0.00 0.26 0.00 0.00 34.13 34.39 3kop s GLU 67 CO 0.34 -0.17 0.36 -1.71 -0.54 0.00 0.00 175.26 173.53 3kop n ASN 68 N 4.83 -0.26 -4.84 -1.70 5.15 -1.26 -3.89 115.26 113.29 3kop n ASN 68 Ca -0.16 -1.06 -0.32 0.00 -0.60 0.00 0.00 54.58 52.43 3kop n ASN 68 Cb 0.54 -2.74 -0.04 0.00 -0.53 0.00 0.00 39.78 37.01 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 -4.00 4.52 0.03 -0.44 -4.23 -1.26 -1.29 115.64 108.97 3kop s THR 69 Ca 0.06 1.24 0.01 0.00 -1.18 0.00 0.00 61.69 61.81 3kop s THR 69 Cb -0.03 -3.71 -0.02 0.00 1.34 0.00 0.00 72.50 70.08 3kop s THR 69 CO 0.91 -0.65 -0.04 0.28 -0.54 0.00 0.00 174.62 174.58 3kop s THR 70 N -2.57 0.25 -0.81 3.99 -1.32 -0.36 -4.89 115.64 109.93 3kop s THR 70 Ca 0.59 -1.01 0.07 0.00 -1.21 0.00 0.00 61.69 60.14 3kop s THR 70 Cb -0.10 -0.43 0.11 0.00 -1.51 0.00 0.00 72.50 70.57 3kop s THR 70 CO 0.29 -0.49 0.88 1.33 -2.21 0.00 0.00 174.62 174.43 3kop n VAL 71 N 1.48 0.35 -3.35 5.08 0.24 -1.26 -1.59 118.33 119.28 3kop n VAL 71 Ca -0.23 -0.68 -0.26 0.00 -2.04 0.00 0.00 64.34 61.13 3kop n VAL 71 Cb 0.55 0.92 -0.08 0.00 -1.47 0.00 0.00 33.84 33.77 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 0.33 1.67 -2.36 3.34 -2.24 -1.26 -0.75 114.28 113.01 3kop n THR 72 Ca 0.05 -4.96 -0.37 0.00 -2.27 0.00 0.00 64.05 56.50 3kop n THR 72 Cb 0.25 -2.03 -0.02 0.00 -2.10 0.00 0.00 70.33 66.42 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 -2.22 4.03 0.34 -0.78 0.04 -1.26 -4.98 135.00 130.17 3kop s PRO 73 Ca 0.39 1.72 0.09 0.00 0.04 0.00 0.00 61.00 63.24 3kop s PRO 73 Cb 0.16 -2.58 -0.05 0.00 0.04 0.00 0.00 34.50 32.07 3kop s PRO 73 CO -0.04 -0.31 0.08 0.96 0.04 0.00 0.00 177.00 177.73 3kop s ILE 74 N -1.51 2.85 0.15 0.56 -4.36 -1.26 -4.31 121.20 113.31 3kop s ILE 74 Ca 0.59 -1.83 -0.34 0.00 -0.26 0.00 0.00 60.65 58.80 3kop s ILE 74 Cb -0.28 -2.89 -0.14 0.00 1.25 0.00 0.00 42.46 40.40 3kop s ILE 74 CO 0.34 -0.20 1.51 -2.65 0.24 0.00 0.00 174.94 174.18 3kop n PRO 75 N -1.05 1.92 0.00 0.37 -0.02 -1.18 -1.46 135.00 133.57 3kop n PRO 75 Ca -0.04 0.69 0.00 0.00 -2.02 0.00 0.00 63.50 62.13 3kop n PRO 75 Cb 0.62 -2.42 0.00 0.00 -0.02 0.00 0.00 33.50 31.68 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 3.10 2.07 3.77 -1.23 0.00 0.65 -4.92 105.19 108.63 3kop n GLY 76 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 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 -1.67 6.54 -0.16 1.61 1.01 -0.54 -0.62 116.67 122.83 3kop s ASP 77 Ca 0.00 2.86 0.01 0.00 0.71 0.00 0.00 52.55 56.13 3kop s ASP 77 Cb 0.00 -2.65 0.01 0.00 1.01 0.00 0.00 42.92 41.29 3kop s ASP 77 CO 0.00 -0.74 -0.19 -0.69 0.21 0.00 0.00 175.17 173.76 3kop s VAL 78 N -0.79 2.28 0.13 -1.27 1.01 -0.31 -1.37 120.40 120.08 3kop s VAL 78 Ca 0.54 -0.89 0.10 0.00 0.00 0.00 0.00 61.98 61.73 3kop s VAL 78 Cb -0.44 -1.94 -0.04 0.00 0.00 0.00 0.00 36.38 33.96 3kop s VAL 78 CO 0.55 0.53 -0.22 0.00 0.00 0.00 0.00 175.10 175.96 3kop s TYR 80 N -1.17 2.50 -0.03 0.00 6.14 -0.46 -0.66 117.35 123.67 3kop s TYR 80 Ca 0.17 -0.94 0.04 0.00 0.64 0.00 0.00 57.07 56.97 3kop s TYR 80 Cb -0.10 -1.66 -0.00 0.00 0.42 0.00 0.00 41.96 40.61 3kop s TYR 80 CO 0.09 -0.36 -0.14 -0.06 0.64 0.00 0.00 175.55 175.72 3kop s PHE 81 N 0.19 1.35 -0.31 4.97 0.40 -0.22 -1.50 117.98 122.86 3kop s PHE 81 Ca -0.14 -0.34 -0.17 0.00 -0.60 0.00 0.00 56.93 55.68 3kop s PHE 81 Cb -0.17 -0.91 -0.02 0.00 0.51 0.00 0.00 43.02 42.43 3kop s PHE 81 CO 0.07 -0.11 0.47 0.99 0.70 0.00 0.00 175.22 177.35 3kop s THR 82 N -0.00 5.08 0.33 0.64 2.01 -1.26 -1.02 115.64 121.41 3kop s THR 82 Ca -0.01 0.51 0.09 0.00 0.31 0.00 0.00 61.69 62.59 3kop s THR 82 Cb -0.09 -3.86 -0.06 0.00 0.01 0.00 0.00 72.50 68.50 3kop s THR 82 CO 0.01 -0.04 -0.10 -0.36 -0.69 0.00 0.00 174.62 173.43 3kop s PHE 83 N 2.27 2.34 0.37 4.92 0.08 0.40 -5.00 117.98 123.36 3kop s PHE 83 Ca 0.18 -0.50 0.07 0.00 0.12 0.00 0.00 56.93 56.80 3kop s PHE 83 Cb -0.16 -1.31 -0.01 0.00 -0.57 0.00 0.00 43.02 40.97 3kop s PHE 83 CO 0.11 0.57 0.46 0.95 -0.10 0.00 0.00 175.22 177.21 3kop s THR 84 N -2.64 3.50 0.26 0.64 -4.23 -1.26 -0.35 115.64 111.55 3kop s THR 84 Ca 0.32 -1.10 -0.02 0.00 -1.18 0.00 0.00 61.69 59.71 3kop s THR 84 Cb 0.02 -3.20 0.24 0.00 1.34 0.00 0.00 72.50 70.89 3kop s THR 84 CO 0.16 -0.10 1.78 -1.28 -0.54 0.00 0.00 174.62 174.64 3kop h SER 85 N 0.90 0.60 -0.46 3.99 0.87 -1.74 -1.77 113.55 115.93 3kop h SER 85 Ca -0.43 0.08 0.06 0.00 -1.23 0.00 0.00 61.79 60.26 3kop h SER 85 Cb 1.26 -0.03 -0.03 0.00 -0.44 0.00 0.00 62.40 63.17 3kop h SER 85 CO 0.52 0.28 0.31 0.78 -0.53 0.00 0.00 176.83 178.19 3kop h ASN 86 N 0.69 0.33 -0.17 6.23 -0.26 -1.88 0.19 115.58 120.71 3kop h ASN 86 Ca 0.45 0.00 -0.07 0.00 -0.56 0.00 0.00 56.30 56.12 3kop h ASN 86 Cb 0.58 -0.07 -0.02 0.00 -1.06 0.00 0.00 38.32 37.75 3kop h ASN 86 CO -0.33 0.22 -0.10 0.44 -1.06 0.00 0.00 177.43 176.60 3kop h ASP 87 N 0.38 0.51 0.00 5.81 3.32 -1.71 -3.38 116.42 121.34 3kop h ASP 87 Ca 0.20 -0.13 -0.18 0.00 0.02 0.00 0.00 57.03 56.94 3kop h ASP 87 Cb 0.31 -0.14 -0.03 0.00 0.22 0.00 0.00 39.33 39.69 3kop h ASP 87 CO -0.05 0.65 -1.67 0.18 -1.72 0.00 0.00 179.24 176.63 3kop n LEU 88 N -4.21 2.56 -4.27 1.55 4.77 -0.77 -4.76 117.00 111.87 3kop n LEU 88 Ca 0.01 -0.06 -0.43 0.00 -0.03 0.00 0.00 56.01 55.50 3kop n LEU 88 Cb 0.32 -0.33 0.00 0.00 -2.33 0.00 0.00 43.42 41.08 3kop n LEU 88 CO 0.40 0.63 2.03 1.17 -1.33 0.00 0.00 177.39 180.30 3kop n LYS 89 N -2.78 3.20 -4.01 3.23 4.81 0.59 -4.66 118.16 118.54 3kop n LYS 89 Ca -0.20 -3.26 -0.09 0.00 -0.87 0.00 0.00 58.31 53.88 3kop n LYS 89 Cb 0.74 -3.29 -0.11 0.00 0.02 0.00 0.00 35.03 32.39 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 3.01 0.20 0.27 3.15 -4.23 -1.26 -4.84 115.64 111.94 3kop s THR 90 Ca 0.48 -1.09 0.00 0.00 -1.18 0.00 0.00 61.69 59.91 3kop s THR 90 Cb 0.06 -0.52 0.26 0.00 1.34 0.00 0.00 72.50 73.63 3kop s THR 90 CO 0.02 -0.56 1.74 -0.65 -0.54 0.00 0.00 174.62 174.63 3kop h PRO 91 N 4.37 0.55 -0.38 3.99 0.11 -1.99 -1.66 132.00 137.00 3kop h PRO 91 Ca -0.33 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 65.75 3kop h PRO 91 Cb 1.20 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 32.17 3kop h PRO 91 CO 0.45 0.36 0.23 0.66 -0.21 0.00 0.00 178.00 179.50 3kop h SER 92 N 0.57 0.44 0.05 -2.05 4.64 -1.96 -2.68 113.55 112.55 3kop h SER 92 Ca 0.49 -0.02 -0.14 0.00 -0.47 0.00 0.00 61.79 61.66 3kop h SER 92 Cb 0.77 -0.11 0.01 0.00 -0.31 0.00 0.00 62.40 62.77 3kop h SER 92 CO -0.41 0.33 -0.58 0.45 -0.87 0.00 0.00 176.83 175.76 3kop h HIS 93 N 0.51 0.49 -3.66 4.77 3.86 -1.62 -3.49 115.15 116.01 3kop h HIS 93 Ca 0.14 -0.30 -0.24 0.00 -1.16 0.00 0.00 60.37 58.81 3kop h HIS 93 Cb -0.03 -0.04 0.07 0.00 1.06 0.00 0.00 27.41 28.47 3kop h HIS 93 CO 0.00 1.16 -0.39 0.41 0.86 0.00 0.00 177.93 179.96 3kop n GLY 94 N 1.29 0.04 3.76 2.45 0.00 -0.70 -4.99 105.19 107.05 3kop n GLY 94 Ca -0.11 -0.15 -0.39 0.00 0.00 0.00 0.00 46.02 45.37 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 -3.13 2.69 -1.87 1.61 2.02 -1.26 -5.13 117.35 112.28 3kop s TYR 95 Ca 0.31 1.41 0.00 0.00 -0.37 0.00 0.00 57.07 58.43 3kop s TYR 95 Cb -0.14 -3.66 0.00 0.00 -0.40 0.00 0.00 41.96 37.76 3kop s TYR 95 CO 0.39 -2.22 0.38 0.39 -1.57 0.00 0.00 175.55 172.92 3kop n GLU 96 N -0.26 0.41 -0.46 -0.62 1.02 -1.26 -5.08 120.64 114.39 3kop n GLU 96 Ca 0.06 0.00 0.06 0.00 -0.02 0.00 0.00 57.16 57.26 3kop n GLU 96 Cb 0.45 -1.03 -0.02 0.00 -0.02 0.00 0.00 31.44 30.82 3kop n GLU 96 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3kop n GLN 105 N -0.40 -0.93 -3.58 3.49 10.64 -1.26 -5.23 117.38 120.11 3kop n GLN 105 Ca 0.00 0.63 -0.36 0.00 -1.83 0.00 0.00 57.00 55.44 3kop n GLN 105 Cb 0.01 -1.13 -0.08 0.00 -0.86 0.00 0.00 30.24 28.18 3kop n GLN 105 CO 0.00 0.00 0.00 0.99 -1.83 0.00 0.00 177.06 176.22 3kop s THR 106 N -1.59 5.32 -0.03 -0.39 2.01 -1.26 -1.81 115.64 117.89 3kop s THR 106 Ca 0.00 0.42 0.07 0.00 0.31 0.00 0.00 61.69 62.48 3kop s THR 106 Cb 0.00 -3.59 -0.02 0.00 0.01 0.00 0.00 72.50 68.90 3kop s THR 106 CO 0.00 0.36 -0.22 -0.63 -0.69 0.00 0.00 174.62 173.44 3kop s ILE 107 N 0.74 2.39 -0.13 1.82 1.01 0.52 -1.59 121.20 125.97 3kop s ILE 107 Ca 0.13 -0.99 -0.05 0.00 0.00 0.00 0.00 60.65 59.74 3kop s ILE 107 Cb -0.13 -1.87 -0.04 0.00 0.01 0.00 0.00 42.46 40.43 3kop s ILE 107 CO 0.03 0.58 0.03 -0.69 0.00 0.00 0.00 174.94 174.89 3kop s VAL 108 N -0.66 4.54 -0.24 2.92 1.01 0.92 -0.46 120.40 128.43 3kop s VAL 108 Ca 0.11 -0.14 -0.07 0.00 0.00 0.00 0.00 61.98 61.87 3kop s VAL 108 Cb -0.10 -2.97 -0.03 0.00 0.00 0.00 0.00 36.38 33.27 3kop s VAL 108 CO -0.00 0.54 0.06 -0.62 0.00 0.00 0.00 175.10 175.08 3kop s ASP 109 N -0.30 5.12 -0.24 3.32 -1.08 -0.19 -0.59 116.67 122.71 3kop s ASP 109 Ca 0.07 -0.19 -0.05 0.00 -0.52 0.00 0.00 52.55 51.86 3kop s ASP 109 Cb -0.12 -1.91 -0.01 0.00 -1.46 0.00 0.00 42.92 39.42 3kop s ASP 109 CO 0.02 -0.01 0.00 -0.76 0.52 0.00 0.00 175.17 174.94 3kop s LEU 110 N 1.45 3.15 0.05 -1.34 1.43 -0.86 -1.06 118.68 121.51 3kop s LEU 110 Ca 0.05 -0.38 0.06 0.00 -1.03 0.00 0.00 54.13 52.84 3kop s LEU 110 Cb -0.15 -1.80 -0.03 0.00 0.03 0.00 0.00 46.19 44.24 3kop s LEU 110 CO 0.03 -0.04 -0.18 0.00 0.23 0.00 0.00 176.35 176.39 3kop s ALA 111 N 1.52 1.51 -0.11 4.21 0.00 0.16 -1.18 121.76 127.87 3kop s ALA 111 Ca 0.05 -1.00 0.04 0.00 0.00 0.00 0.00 51.96 51.05 3kop s ALA 111 Cb -0.15 -0.25 0.00 0.00 0.00 0.00 0.00 23.12 22.72 3kop s ALA 111 CO -0.01 0.31 -0.23 0.08 0.00 0.00 0.00 175.76 175.91 3kop s VAL 112 N -0.90 2.03 -0.26 0.00 1.01 0.39 -0.29 120.40 122.39 3kop s VAL 112 Ca 0.05 -0.99 -0.10 0.00 0.00 0.00 0.00 61.98 60.94 3kop s VAL 112 Cb -0.09 -1.76 -0.04 0.00 0.00 0.00 0.00 36.38 34.49 3kop s VAL 112 CO 0.02 0.55 0.14 -0.36 0.00 0.00 0.00 175.10 175.45 3kop s PHE 113 N 0.47 3.19 -1.17 5.22 0.08 -0.47 -1.29 117.98 124.00 3kop s PHE 113 Ca -0.16 -0.05 0.11 0.00 0.12 0.00 0.00 56.93 56.95 3kop s PHE 113 Cb -0.17 -2.31 0.03 0.00 -0.57 0.00 0.00 43.02 40.00 3kop s PHE 113 CO 0.06 -0.19 0.74 2.48 -0.10 0.00 0.00 175.22 178.21 3kop n TYR 114 N 4.86 0.00 -3.90 0.36 0.18 -0.37 -0.26 117.16 118.03 3kop n TYR 114 Ca -0.15 0.00 -0.08 0.00 1.88 0.00 0.00 57.90 59.55 3kop n TYR 114 Cb 0.52 0.00 -0.02 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 0.86 2.79 2.68 -7.48 0.00 -1.24 -4.77 105.19 98.03 3kop n GLY 115 Ca 0.05 -1.57 -0.20 0.00 0.00 0.00 0.00 46.02 44.30 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 -0.31 0.98 -3.54 1.61 1.85 -1.26 -3.10 116.66 112.89 3kop n ARG 116 Ca 0.01 -2.51 -0.20 0.00 -1.00 0.00 0.00 57.85 54.15 3kop n ARG 116 Cb 0.31 0.40 0.08 0.00 -1.05 0.00 0.00 32.46 32.20 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 -1.67 -2.95 -4.73 2.89 3.02 -1.26 -4.78 115.26 105.77 3kop n ASN 117 Ca -0.06 -0.64 -0.33 0.00 -0.03 0.00 0.00 54.58 53.52 3kop n ASN 117 Cb 0.45 -4.87 -0.08 0.00 -0.61 0.00 0.00 39.78 34.67 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 -4.09 5.41 -0.09 6.41 0.01 -1.26 -4.93 114.94 116.40 3kop s ASN 118 Ca 0.16 0.06 0.02 0.00 -0.71 0.00 0.00 52.86 52.39 3kop s ASN 118 Cb -0.07 -1.48 0.01 0.00 0.41 0.00 0.00 41.25 40.12 3kop s ASN 118 CO 0.75 0.27 -0.15 -0.76 -1.51 0.00 0.00 177.10 175.70 3kop s LEU 119 N -1.69 1.73 -1.30 0.60 1.43 -1.26 -4.20 118.68 113.99 3kop s LEU 119 Ca 0.22 -0.40 -0.15 0.00 -1.03 0.00 0.00 54.13 52.77 3kop s LEU 119 Cb -0.12 -1.04 0.11 0.00 0.03 0.00 0.00 46.19 45.17 3kop s LEU 119 CO 0.13 0.04 1.76 0.18 0.23 0.00 0.00 176.35 178.68 3kop n LEU 120 N 4.00 5.66 -3.71 1.79 4.77 0.08 -4.25 117.00 125.34 3kop n LEU 120 Ca -0.20 -4.24 -0.12 0.00 -0.03 0.00 0.00 56.01 51.42 3kop n LEU 120 Cb 0.52 -1.65 -0.12 0.00 -2.33 0.00 0.00 43.42 39.83 3kop n LEU 120 CO 0.25 0.70 -0.05 -0.22 -1.33 0.00 0.00 177.39 176.73 3kop s LEU 121 N 2.34 0.16 0.17 2.23 2.96 -1.26 -0.45 118.68 124.83 3kop s LEU 121 Ca 0.47 0.67 -0.01 0.00 -0.22 0.00 0.00 54.13 55.05 3kop s LEU 121 Cb 0.05 0.97 -0.04 0.00 0.50 0.00 0.00 46.19 47.67 3kop s LEU 121 CO 0.01 -0.18 0.09 0.54 -1.32 0.00 0.00 176.35 175.49 3kop s ASN 122 N 1.42 0.26 0.00 3.68 2.20 -0.17 -4.77 114.94 117.55 3kop s ASN 122 Ca -0.09 -1.30 0.16 0.00 -0.94 0.00 0.00 52.86 50.70 3kop s ASN 122 Cb -0.10 0.33 0.75 0.00 -2.00 0.00 0.00 41.25 40.23 3kop s ASN 122 CO -0.10 -0.78 1.51 0.61 -2.94 0.00 0.00 177.10 175.40 3kop n GLY 123 N -0.19 -0.31 0.09 0.45 0.00 -1.26 -1.30 105.19 102.67 3kop n GLY 123 Ca -0.02 -0.25 -0.16 0.00 0.00 0.00 0.00 46.02 45.59 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 1.10 0.12 0.00 1.61 3.32 -2.00 -3.44 116.42 117.14 3kop h ASP 124 Ca 0.00 -0.94 0.00 0.00 0.02 0.00 0.00 57.03 56.11 3kop h ASP 124 Cb 0.24 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 39.75 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 -4.45 0.00 -0.30 0.35 5.66 -1.24 -5.14 114.28 109.16 3kop n THR 125 Ca -0.14 -0.03 0.00 0.00 -3.05 0.00 0.00 64.05 60.84 3kop n THR 125 Cb 0.60 1.43 0.00 0.00 -1.55 0.00 0.00 70.33 70.80 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 0.03 0.86 3.76 1.09 0.00 -0.42 -4.96 105.19 105.55 3kop n GLY 126 Ca 0.00 -1.31 -0.41 0.00 0.00 0.00 0.00 46.02 44.31 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 3.36 -0.53 1.61 0.52 -1.26 -1.00 118.94 121.64 3kop s TRP 127 Ca 0.00 1.56 0.04 0.00 0.02 0.00 0.00 56.10 57.72 3kop s TRP 127 Cb 0.00 -3.45 0.16 0.00 -1.15 0.00 0.00 33.47 29.03 3kop s TRP 127 CO 0.00 -1.11 0.36 0.54 0.02 0.00 0.00 176.95 176.76 3kop s VAL 128 N -1.05 1.61 0.43 4.03 0.11 0.41 -4.94 120.40 121.00 3kop s VAL 128 Ca 0.47 -3.21 -0.25 0.00 -2.93 0.00 0.00 61.98 56.06 3kop s VAL 128 Cb -0.35 -2.09 -0.08 0.00 -1.53 0.00 0.00 36.38 32.33 3kop s VAL 128 CO 0.45 -1.04 1.33 -2.84 -3.33 0.00 0.00 175.10 169.67 3kop s PRO 129 N -0.39 3.83 0.01 1.54 0.02 -1.26 -4.80 135.00 133.95 3kop s PRO 129 Ca 0.25 2.21 0.06 0.00 0.02 0.00 0.00 61.00 63.54 3kop s PRO 129 Cb -0.08 -2.68 -0.03 0.00 0.02 0.00 0.00 34.50 31.72 3kop s PRO 129 CO -0.12 -0.63 -0.16 0.20 -0.33 0.00 0.00 177.00 175.96 3kop s GLY 130 N -0.72 1.57 -0.12 0.52 0.00 -0.62 -4.90 107.32 103.05 3kop s GLY 130 Ca 0.59 -1.12 -0.29 0.00 0.00 0.00 0.00 44.72 43.90 3kop s GLY 130 CO 0.50 -0.98 1.35 -1.31 0.00 0.00 0.00 173.10 172.66 3kop s ASN 131 N -1.24 6.89 -0.37 1.64 -0.87 -0.56 -1.22 114.94 119.20 3kop s ASN 131 Ca 0.14 1.84 -0.24 0.00 -1.57 0.00 0.00 52.86 53.03 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 0.04 -0.78 0.84 -0.69 -2.57 0.00 0.00 177.10 173.94 3kop s VAL 132 N 3.42 4.68 0.00 1.60 1.01 -0.41 -1.36 120.40 129.34 3kop s VAL 132 Ca 0.59 0.99 0.00 0.00 0.00 0.00 0.00 61.98 63.56 3kop s VAL 132 Cb -0.25 -4.26 0.00 0.00 0.00 0.00 0.00 36.38 31.87 3kop s VAL 132 CO 0.19 -0.48 0.23 2.22 0.00 0.00 0.00 175.10 177.26 3kop n PHE 133 N 6.56 0.00 -3.75 5.22 -1.74 -0.28 -4.68 117.46 118.79 3kop n PHE 133 Ca 0.04 0.00 -0.10 0.00 -0.56 0.00 0.00 57.45 56.83 3kop n PHE 133 Cb 0.48 0.00 -0.07 0.00 1.52 0.00 0.00 39.48 41.42 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 -0.50 -0.62 -0.09 1.98 0.00 -1.16 -0.80 121.76 120.57 3kop s ALA 134 Ca 0.00 -0.18 -0.01 0.00 0.00 0.00 0.00 51.96 51.77 3kop s ALA 134 Cb 0.00 0.46 0.03 0.00 0.00 0.00 0.00 23.12 23.60 3kop s ALA 134 CO 0.00 -0.50 -0.05 0.99 0.00 0.00 0.00 175.76 176.20 3kop s THR 135 N -3.23 0.78 0.06 0.00 2.01 -0.28 -1.16 115.64 113.82 3kop s THR 135 Ca -0.00 -0.14 -0.31 0.00 0.31 0.00 0.00 61.69 61.55 3kop s THR 135 Cb 0.01 -0.85 -0.07 0.00 0.01 0.00 0.00 72.50 71.61 3kop s THR 135 CO -0.08 0.32 1.47 -0.63 -0.69 0.00 0.00 174.62 175.02 3kop s ILE 136 N 1.74 3.37 -0.08 1.82 1.01 0.21 -0.64 121.20 128.63 3kop s ILE 136 Ca 0.04 0.86 0.05 0.00 0.00 0.00 0.00 60.65 61.59 3kop s ILE 136 Cb -0.13 -3.55 -0.06 0.00 0.01 0.00 0.00 42.46 38.73 3kop s ILE 136 CO -0.06 0.02 0.13 1.33 0.00 0.00 0.00 174.94 176.36 3kop n VAL 137 N 4.47 0.00 -3.89 2.92 0.24 0.49 -4.90 118.33 117.66 3kop n VAL 137 Ca 0.13 -0.21 -0.13 0.00 -2.04 0.00 0.00 64.34 62.10 3kop n VAL 137 Cb 0.42 0.61 -0.14 0.00 -1.47 0.00 0.00 33.84 33.26 3kop n VAL 137 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 3kop s GLU 138 N -1.99 0.05 0.00 7.34 2.12 -0.93 -4.89 118.70 120.40 3kop s GLU 138 Ca -0.00 0.01 0.00 0.00 0.36 0.00 0.00 54.97 55.33 3kop s GLU 138 Cb 0.03 -0.10 0.00 0.00 0.26 0.00 0.00 34.13 34.32 3kop s GLU 138 CO 0.19 -0.02 0.00 0.41 -0.54 0.00 0.00 175.26 175.30 3kop n GLY 139 N 3.25 0.51 0.28 -1.50 0.00 -1.26 -1.55 105.19 104.93 3kop n GLY 139 Ca -0.15 -0.26 -0.04 0.00 0.00 0.00 0.00 46.02 45.57 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 0.79 -0.64 0.99 5.85 -1.91 -2.87 115.31 117.51 3kop h LEU 140 Ca 0.00 -0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.67 3kop h LEU 140 Cb 0.00 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 40.81 3kop h LEU 140 CO 0.00 0.56 0.28 0.44 -0.34 0.00 0.00 178.44 179.38 3kop h ASP 141 N 0.93 0.87 0.00 1.25 3.32 -1.96 -0.14 116.42 120.69 3kop h ASP 141 Ca 0.27 -0.15 0.00 0.00 0.02 0.00 0.00 57.03 57.16 3kop h ASP 141 Cb -0.07 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 39.26 3kop h ASP 141 CO -0.07 0.78 0.00 -0.62 -1.72 0.00 0.00 179.24 177.61 3kop n GLU 142 N -4.45 0.36 0.00 3.56 4.71 -1.08 -1.79 120.64 121.95 3kop n GLU 142 Ca 0.04 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.19 3kop n GLU 142 Cb 0.15 -1.31 0.00 0.00 -1.01 0.00 0.00 31.44 29.27 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 0.80 0.00 -0.24 0.62 0.00 -0.07 -1.26 120.51 120.36 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 0.18 0.00 0.04 0.00 0.00 0.00 0.00 19.45 19.67 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 0.88 -0.56 0.00 0.00 -1.61 -0.66 119.26 117.31 3kop h ALA 145 Ca 0.00 -0.22 -0.05 0.00 0.00 0.00 0.00 54.91 54.64 3kop h ALA 145 Cb 0.00 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.51 3kop h ALA 145 CO 0.00 0.57 0.15 0.00 0.00 0.00 0.00 179.25 179.96 3kop h ALA 146 N 1.08 1.21 -0.30 0.00 0.00 -1.46 -2.18 119.26 117.62 3kop h ALA 146 Ca 0.22 -0.20 -0.15 0.00 0.00 0.00 0.00 54.91 54.77 3kop h ALA 146 Cb 0.31 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 3kop h ALA 146 CO -0.00 0.55 -0.42 0.00 0.00 0.00 0.00 179.25 179.37 3kop h GLN 148 N 0.60 1.25 -0.04 0.00 4.15 -0.87 -1.54 115.11 118.66 3kop h GLN 148 Ca 0.04 -0.08 -0.11 0.00 0.77 0.00 0.00 58.65 59.28 3kop h GLN 148 Cb 0.98 -0.28 -0.01 0.00 0.21 0.00 0.00 27.48 28.37 3kop h GLN 148 CO 0.09 0.83 -0.50 0.22 -1.93 0.00 0.00 178.83 177.54 3kop h ASP 149 N 1.29 0.11 -0.32 -0.69 3.58 -0.90 -2.91 116.42 116.58 3kop h ASP 149 Ca 0.40 -0.05 -0.06 0.00 0.42 0.00 0.00 57.03 57.73 3kop h ASP 149 Cb -0.02 -0.03 -0.01 0.00 1.72 0.00 0.00 39.33 40.99 3kop h ASP 149 CO -0.12 0.60 -0.03 0.40 -2.88 0.00 0.00 179.24 177.21 3kop h ILE 150 N 0.09 1.27 0.00 2.25 2.04 -0.48 0.36 117.51 123.03 3kop h ILE 150 Ca 0.00 -1.02 0.00 0.00 1.00 0.00 0.00 64.86 64.84 3kop h ILE 150 Cb 0.91 1.29 0.00 0.00 -0.74 0.00 0.00 36.82 38.28 3kop h ILE 150 CO 0.07 0.33 0.00 1.87 0.00 0.00 0.00 178.15 180.42 3kop n TRP 151 N -4.51 0.00 0.00 1.37 -0.00 -0.63 -0.31 117.44 113.37 3kop n TRP 151 Ca -0.02 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.48 3kop n TRP 151 Cb 0.29 0.00 0.00 0.00 -0.00 0.00 0.00 31.31 31.60 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 -0.66 0.00 0.00 5.87 0.00 0.13 -5.04 105.19 105.49 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 0.32 0.19 -0.02 0.00 0.58 -4.82 105.19 101.44 3kop n GLY 154 Ca 0.00 -1.85 0.03 0.00 0.00 0.00 0.00 46.02 44.19 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 0.63 2.10 -1.84 4.61 0.00 -1.26 -4.41 120.51 120.34 3kop n ALA 155 Ca 0.00 -1.23 -0.42 0.00 0.00 0.00 0.00 53.44 51.79 3kop n ALA 155 Cb 0.00 -0.16 -0.03 0.00 0.00 0.00 0.00 19.45 19.26 3kop n ALA 155 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3kop s ARG 156 N -1.24 4.17 -0.96 0.00 1.81 -1.26 -1.28 118.95 120.19 3kop s ARG 156 Ca 0.10 2.47 0.00 0.00 -1.72 0.00 0.00 55.73 56.58 3kop s ARG 156 Cb 0.07 -3.11 0.00 0.00 -0.45 0.00 0.00 34.95 31.45 3kop s ARG 156 CO 0.04 -0.66 0.00 -0.25 -0.68 0.00 0.00 175.30 173.75 3kop n ASP 157 N 3.84 -5.66 -4.88 0.23 8.00 -1.26 -4.97 116.55 111.85 3kop n ASP 157 Ca 0.14 0.22 -0.36 0.00 0.71 0.00 0.00 54.79 55.51 3kop n ASP 157 Cb 0.37 -3.96 -0.06 0.00 -0.02 0.00 0.00 41.12 37.46 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 -2.72 3.50 -0.05 -1.24 2.56 -0.40 -4.63 118.70 115.72 3kop s GLU 158 Ca 0.00 -0.12 0.02 0.00 0.00 0.00 0.00 54.97 54.87 3kop s GLU 158 Cb 0.00 -3.16 0.01 0.00 2.00 0.00 0.00 34.13 32.99 3kop s GLU 158 CO 0.00 0.73 -0.09 0.99 -0.56 0.00 0.00 175.26 176.33 3kop s THR 159 N -1.13 0.87 -0.24 -1.70 2.01 -1.26 -2.20 115.64 111.98 3kop s THR 159 Ca 0.20 -0.35 -0.10 0.00 0.31 0.00 0.00 61.69 61.76 3kop s THR 159 Cb -0.13 -0.81 -0.04 0.00 0.01 0.00 0.00 72.50 71.52 3kop s THR 159 CO 0.09 0.29 0.14 -0.22 -0.69 0.00 0.00 174.62 174.23 3kop s LEU 160 N 0.61 3.91 -0.09 4.42 2.96 0.10 -1.43 118.68 129.17 3kop s LEU 160 Ca -0.11 0.01 0.04 0.00 -0.22 0.00 0.00 54.13 53.85 3kop s LEU 160 Cb -0.14 -2.05 0.00 0.00 0.50 0.00 0.00 46.19 44.50 3kop s LEU 160 CO 0.02 0.03 -0.21 -0.89 -1.32 0.00 0.00 176.35 173.98 3kop s THR 161 N 1.26 1.85 -0.15 3.68 2.01 0.54 -1.92 115.64 122.91 3kop s THR 161 Ca 0.06 -0.90 -0.04 0.00 0.31 0.00 0.00 61.69 61.13 3kop s THR 161 Cb -0.14 -1.61 -0.03 0.00 0.01 0.00 0.00 72.50 70.72 3kop s THR 161 CO 0.06 0.51 -0.00 -0.36 -0.69 0.00 0.00 174.62 174.14 3kop s PHE 162 N 0.43 3.11 0.14 4.92 0.40 0.07 -0.31 117.98 126.74 3kop s PHE 162 Ca -0.18 -0.09 -0.09 0.00 -0.60 0.00 0.00 56.93 55.97 3kop s PHE 162 Cb -0.17 -1.95 -0.01 0.00 0.51 0.00 0.00 43.02 41.39 3kop s PHE 162 CO 0.08 0.12 0.25 -1.54 0.70 0.00 0.00 175.22 174.82 3kop s SER 163 N 0.10 0.07 0.17 1.36 1.04 -0.42 -1.50 113.70 114.52 3kop s SER 163 Ca 0.01 -0.80 -0.30 0.00 0.48 0.00 0.00 55.95 55.34 3kop s SER 163 Cb -0.13 0.40 -0.07 0.00 0.10 0.00 0.00 66.02 66.32 3kop s SER 163 CO 0.02 -0.83 1.05 -0.13 0.98 0.00 0.00 173.24 174.33 3kop s ARG 164 N -3.93 4.64 -0.34 4.02 0.52 -1.26 -0.90 118.95 121.70 3kop s ARG 164 Ca 0.13 1.63 -0.12 0.00 -0.52 0.00 0.00 55.73 56.86 3kop s ARG 164 Cb 0.04 -3.30 -0.00 0.00 0.52 0.00 0.00 34.95 32.21 3kop s ARG 164 CO -0.04 0.15 0.21 0.00 0.02 0.00 0.00 175.30 175.64 3kop s ALA 165 N -0.28 3.38 0.00 2.13 0.00 0.17 -4.67 121.76 122.49 3kop s ALA 165 Ca 0.48 -1.48 0.00 0.00 0.00 0.00 0.00 51.96 50.96 3kop s ALA 165 Cb -0.28 -2.57 0.00 0.00 0.00 0.00 0.00 23.12 20.27 3kop s ALA 165 CO 0.33 -1.07 0.00 0.39 0.00 0.00 0.00 175.76 175.42