#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bys h HIS 1 N 0.00 -0.02 -0.27 -1.77 3.86 -2.06 -2.88 115.15 112.01 2bys h HIS 1 Ca 0.00 -0.00 -0.05 0.00 -1.16 0.00 0.00 60.37 59.16 2bys h HIS 1 Cb 0.00 0.01 -0.02 0.00 1.06 0.00 0.00 27.41 28.46 2bys h HIS 1 CO 0.00 0.47 -0.04 0.66 0.86 0.00 0.00 177.93 179.87 2bys h SER 2 N -0.51 0.40 -0.55 2.45 4.64 -1.98 -0.76 113.55 117.23 2bys h SER 2 Ca -0.00 -0.08 0.09 0.00 -0.47 0.00 0.00 61.79 61.33 2bys h SER 2 Cb 0.49 -0.10 -0.07 0.00 -0.31 0.00 0.00 62.40 62.41 2bys h SER 2 CO 0.00 0.50 0.17 -0.61 -0.87 0.00 0.00 176.83 176.02 2bys h GLN 3 N 0.41 0.33 -0.11 4.77 4.15 -2.00 -0.56 115.11 122.09 2bys h GLN 3 Ca 0.09 -0.02 -0.12 0.00 0.77 0.00 0.00 58.65 59.36 2bys h GLN 3 Cb 0.34 -0.07 -0.01 0.00 0.21 0.00 0.00 27.48 27.94 2bys h GLN 3 CO 0.01 0.22 -0.47 0.00 -1.93 0.00 0.00 178.83 176.66 2bys h ALA 4 N 1.39 0.99 -0.53 3.38 0.00 -1.09 -2.72 119.26 120.69 2bys h ALA 4 Ca 0.28 -0.46 -0.04 0.00 0.00 0.00 0.00 54.91 54.68 2bys h ALA 4 Cb 0.34 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 2bys h ALA 4 CO -0.30 0.64 0.14 -0.91 0.00 0.00 0.00 179.25 178.82 2bys h ASN 5 N 0.23 0.73 0.46 0.00 2.35 -0.44 -2.24 115.58 116.68 2bys h ASN 5 Ca 0.01 -0.12 -0.21 0.00 -0.55 0.00 0.00 56.30 55.43 2bys h ASN 5 Cb 0.92 -0.19 -0.00 0.00 0.05 0.00 0.00 38.32 39.09 2bys h ASN 5 CO 0.08 0.71 -0.91 0.25 -1.65 0.00 0.00 177.43 175.90 2bys h LEU 6 N 0.77 0.39 -0.60 1.61 5.85 -1.00 -2.40 115.31 119.93 2bys h LEU 6 Ca 0.17 -0.32 -0.14 0.00 0.84 0.00 0.00 57.88 58.43 2bys h LEU 6 Cb 0.26 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.16 2bys h LEU 6 CO -0.00 1.12 -0.41 0.24 -0.34 0.00 0.00 178.44 179.04 2bys h MET 7 N 0.17 0.64 -0.46 1.25 2.86 -1.40 -2.40 114.93 115.59 2bys h MET 7 Ca -0.06 -0.34 -0.13 0.00 -2.06 0.00 0.00 59.70 57.11 2bys h MET 7 Cb 1.55 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 33.21 2bys h MET 7 CO 0.15 0.94 -0.23 -0.09 1.06 0.00 0.00 176.91 178.74 2bys h ARG 8 N 0.52 0.97 0.22 1.72 2.43 -1.42 -2.16 114.38 116.67 2bys h ARG 8 Ca 0.04 -0.43 -0.01 0.00 -0.81 0.00 0.00 59.98 58.77 2bys h ARG 8 Cb 0.94 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.46 2bys h ARG 8 CO 0.08 1.09 -0.11 1.25 -1.51 0.00 0.00 179.97 180.78 2bys h LEU 9 N 0.81 -0.26 -0.62 3.80 5.85 -1.34 -0.02 115.31 123.54 2bys h LEU 9 Ca 0.10 -0.08 0.02 0.00 0.84 0.00 0.00 57.88 58.76 2bys h LEU 9 Cb 0.81 0.07 -0.04 0.00 0.37 0.00 0.00 40.66 41.87 2bys h LEU 9 CO 0.07 -0.08 0.40 0.11 -0.34 0.00 0.00 178.44 178.59 2bys h LYS 10 N -0.42 0.78 0.16 1.25 1.57 -1.50 0.13 116.57 118.54 2bys h LYS 10 Ca -0.03 -0.05 0.01 0.00 -1.87 0.00 0.00 60.65 58.71 2bys h LYS 10 Cb 0.32 -0.18 -0.03 0.00 0.08 0.00 0.00 32.23 32.42 2bys h LYS 10 CO 0.05 0.51 -0.41 1.03 -0.57 0.00 0.00 179.45 180.06 2bys h SER 11 N 0.80 -1.23 -1.00 0.86 0.87 -1.32 0.14 113.55 112.68 2bys h SER 11 Ca 0.24 0.12 0.15 0.00 -1.23 0.00 0.00 61.79 61.08 2bys h SER 11 Cb -0.04 0.44 -0.10 0.00 -0.44 0.00 0.00 62.40 62.27 2bys h SER 11 CO -0.08 -0.46 0.62 0.44 -0.53 0.00 0.00 176.83 176.82 2bys h ASP 12 N -0.64 0.86 0.08 6.23 3.32 -0.51 -1.82 116.42 123.95 2bys h ASP 12 Ca -0.01 0.07 -0.00 0.00 0.02 0.00 0.00 57.03 57.10 2bys h ASP 12 Cb 0.62 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 40.08 2bys h ASP 12 CO -0.19 0.39 -0.04 -0.07 -1.72 0.00 0.00 179.24 177.61 2bys h LEU 13 N 0.89 -0.09 0.00 1.55 3.38 -0.59 -3.30 115.31 117.15 2bys h LEU 13 Ca 0.53 -0.42 0.00 0.00 0.09 0.00 0.00 57.88 58.09 2bys h LEU 13 Cb 0.67 0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.45 2bys h LEU 13 CO -0.32 0.56 0.00 0.49 0.09 0.00 0.00 178.44 179.26 2bys n PHE 14 N -4.81 0.00 -1.96 1.13 0.99 0.49 -2.02 117.46 111.28 2bys n PHE 14 Ca -0.06 0.00 -0.22 0.00 -0.00 0.00 0.00 57.45 57.17 2bys n PHE 14 Cb 0.25 -0.31 0.04 0.00 -1.00 0.00 0.00 39.48 38.45 2bys n PHE 14 CO 0.00 0.00 0.00 -1.71 -0.00 0.00 0.00 176.76 175.05 2bys n ASN 15 N -1.31 4.79 0.00 4.37 4.05 -0.70 -5.06 115.26 121.41 2bys n ASN 15 Ca 0.10 -3.76 0.00 0.00 0.45 0.00 0.00 54.58 51.37 2bys n ASN 15 Cb 0.19 -0.38 0.00 0.00 1.23 0.00 0.00 39.78 40.82 2bys n ASN 15 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 177.26 174.75 2bys n ARG 16 N -0.75 0.00 -3.46 1.20 1.74 -0.86 -4.98 116.66 109.56 2bys n ARG 16 Ca 0.43 0.00 -0.10 0.00 -0.77 0.00 0.00 57.85 57.41 2bys n ARG 16 Cb 0.94 -0.34 -0.09 0.00 -1.02 0.00 0.00 32.46 31.95 2bys n ARG 16 CO 0.00 0.00 0.00 -0.47 -1.52 0.00 0.00 177.63 175.64 2bys s TYR 20 N -0.05 -0.73 -0.68 -1.55 6.14 -1.26 -5.12 117.35 114.11 2bys s TYR 20 Ca 0.00 0.92 0.05 0.00 0.64 0.00 0.00 57.07 58.68 2bys s TYR 20 Cb 0.00 0.03 0.29 0.00 0.42 0.00 0.00 41.96 42.70 2bys s TYR 20 CO 0.00 -0.63 0.98 -0.35 0.64 0.00 0.00 175.55 176.19 2bys n PRO 21 N 5.36 2.30 0.00 4.97 -0.04 -1.26 -4.99 135.00 141.35 2bys n PRO 21 Ca -0.05 -1.11 0.00 0.00 -0.04 0.00 0.00 63.50 62.30 2bys n PRO 21 Cb 0.50 -1.74 0.00 0.00 -0.04 0.00 0.00 33.50 32.22 2bys n PRO 21 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2bys n GLY 22 N 0.19 -2.00 3.76 0.55 0.00 -1.26 -4.97 105.19 101.46 2bys n GLY 22 Ca 0.11 -1.50 -0.36 0.00 0.00 0.00 0.00 46.02 44.27 2bys n GLY 22 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2bys s PRO 23 N -2.12 3.19 0.37 1.61 0.02 -1.26 -5.04 135.00 131.77 2bys s PRO 23 Ca 0.00 1.82 0.04 0.00 0.02 0.00 0.00 61.00 62.87 2bys s PRO 23 Cb 0.00 -2.05 -0.04 0.00 0.02 0.00 0.00 34.50 32.43 2bys s PRO 23 CO 0.00 -1.03 0.12 0.95 -0.33 0.00 0.00 177.00 176.71 2bys s THR 24 N -1.59 0.67 0.40 0.99 -4.23 -1.01 -4.98 115.64 105.89 2bys s THR 24 Ca 0.74 -2.00 0.19 0.00 -1.18 0.00 0.00 61.69 59.44 2bys s THR 24 Cb -0.30 -2.48 0.20 0.00 1.34 0.00 0.00 72.50 71.26 2bys s THR 24 CO 0.33 0.00 1.97 0.50 -0.54 0.00 0.00 174.62 176.88 2bys h LYS 25 N 1.95 0.00 0.24 3.99 3.64 -1.92 -1.79 116.57 122.69 2bys h LYS 25 Ca -0.36 0.00 -0.33 0.00 -1.27 0.00 0.00 60.65 58.69 2bys h LYS 25 Cb 1.26 0.00 0.03 0.00 -0.41 0.00 0.00 32.23 33.12 2bys h LYS 25 CO 0.59 0.21 -1.48 -0.44 -2.27 0.00 0.00 179.45 176.05 2bys h ASP 26 N 0.00 0.79 -2.24 4.20 3.32 -1.96 -3.39 116.42 117.14 2bys h ASP 26 Ca -0.00 -0.87 -0.61 0.00 0.02 0.00 0.00 57.03 55.58 2bys h ASP 26 Cb 0.43 -0.26 -0.42 0.00 0.22 0.00 0.00 39.33 39.31 2bys h ASP 26 CO 0.03 1.68 -0.54 0.47 -1.72 0.00 0.00 179.24 179.16 2bys n ASP 27 N -3.69 3.85 -4.55 6.45 9.92 -1.11 -5.10 116.55 122.32 2bys n ASP 27 Ca -0.17 -3.44 -0.29 0.00 -0.53 0.00 0.00 54.79 50.36 2bys n ASP 27 Cb 1.10 -0.69 0.17 0.00 -0.64 0.00 0.00 41.12 41.06 2bys n ASP 27 CO 0.00 0.00 0.00 -2.16 0.13 0.00 0.00 177.20 175.17 2bys s PRO 28 N -2.47 0.41 -0.02 -0.24 0.04 -0.69 -2.41 135.00 129.61 2bys s PRO 28 Ca 0.39 0.27 -0.02 0.00 0.04 0.00 0.00 61.00 61.68 2bys s PRO 28 Cb 0.14 -1.76 0.01 0.00 0.04 0.00 0.00 34.50 32.93 2bys s PRO 28 CO -0.01 -2.69 0.06 -1.17 0.04 0.00 0.00 177.00 173.24 2bys s LEU 29 N -6.35 1.71 -0.20 -3.56 2.96 -0.00 -4.91 118.68 108.32 2bys s LEU 29 Ca 0.66 0.13 -0.04 0.00 -0.22 0.00 0.00 54.13 54.65 2bys s LEU 29 Cb -0.15 0.20 -0.02 0.00 0.50 0.00 0.00 46.19 46.72 2bys s LEU 29 CO 0.55 -0.03 -0.02 -0.89 -1.32 0.00 0.00 176.35 174.64 2bys s THR 30 N 0.11 3.77 -0.20 3.68 2.01 -1.26 -0.82 115.64 122.93 2bys s THR 30 Ca -0.01 -0.38 -0.04 0.00 0.31 0.00 0.00 61.69 61.58 2bys s THR 30 Cb -0.01 -2.69 -0.02 0.00 0.01 0.00 0.00 72.50 69.78 2bys s THR 30 CO -0.00 0.44 -0.03 -0.69 -0.69 0.00 0.00 174.62 173.64 2bys s VAL 31 N 1.02 3.64 -0.15 3.82 1.01 -0.32 -4.40 120.40 125.02 2bys s VAL 31 Ca 0.01 -0.42 -0.13 0.00 0.00 0.00 0.00 61.98 61.44 2bys s VAL 31 Cb -0.14 -2.63 -0.05 0.00 0.00 0.00 0.00 36.38 33.55 2bys s VAL 31 CO 0.01 0.44 0.28 -0.89 0.00 0.00 0.00 175.10 174.94 2bys s THR 32 N 1.05 5.31 0.08 3.92 2.01 -0.04 -1.83 115.64 126.14 2bys s THR 32 Ca 0.01 0.53 0.09 0.00 0.31 0.00 0.00 61.69 62.63 2bys s THR 32 Cb -0.15 -3.61 -0.03 0.00 0.01 0.00 0.00 72.50 68.72 2bys s THR 32 CO 0.01 0.42 -0.25 -0.76 -0.69 0.00 0.00 174.62 173.35 2bys s LEU 33 N 0.27 2.24 -0.07 4.42 1.43 -0.44 -1.39 118.68 125.13 2bys s LEU 33 Ca 0.16 -0.65 -0.16 0.00 -1.03 0.00 0.00 54.13 52.46 2bys s LEU 33 Cb -0.13 -1.14 0.03 0.00 0.03 0.00 0.00 46.19 44.98 2bys s LEU 33 CO 0.04 0.18 0.38 -0.83 0.23 0.00 0.00 176.35 176.35 2bys s GLY 34 N -1.60 -0.25 -0.06 -3.19 0.00 -0.89 -4.47 107.32 96.86 2bys s GLY 34 Ca 0.11 0.74 0.04 0.00 0.00 0.00 0.00 44.72 45.61 2bys s GLY 34 CO 0.04 0.54 -0.19 -1.36 0.00 0.00 0.00 173.10 172.13 2bys s PHE 35 N -0.68 2.59 -0.33 1.90 0.08 -1.26 -1.04 117.98 119.23 2bys s PHE 35 Ca -0.08 -0.42 -0.02 0.00 0.12 0.00 0.00 56.93 56.54 2bys s PHE 35 Cb -0.04 -1.63 0.07 0.00 -0.57 0.00 0.00 43.02 40.85 2bys s PHE 35 CO 0.03 -0.01 0.06 0.99 -0.10 0.00 0.00 175.22 176.19 2bys s THR 36 N -0.41 3.02 -0.25 0.64 2.01 -0.23 -1.20 115.64 119.23 2bys s THR 36 Ca 0.04 -1.63 -0.27 0.00 0.31 0.00 0.00 61.69 60.14 2bys s THR 36 Cb -0.12 -2.86 0.00 0.00 0.01 0.00 0.00 72.50 69.53 2bys s THR 36 CO 0.02 -0.30 0.94 -0.22 -0.69 0.00 0.00 174.62 174.37 2bys s LEU 37 N 1.20 4.08 -0.14 4.42 2.96 -0.94 -1.29 118.68 128.96 2bys s LEU 37 Ca -0.00 1.17 0.08 0.00 -0.22 0.00 0.00 54.13 55.15 2bys s LEU 37 Cb -0.20 -3.37 -0.23 0.00 0.50 0.00 0.00 46.19 42.88 2bys s LEU 37 CO -0.02 -0.62 0.30 0.00 -1.32 0.00 0.00 176.35 174.68 2bys n GLN 38 N 6.23 0.68 -3.64 1.98 6.02 0.27 -3.45 117.38 125.47 2bys n GLN 38 Ca 0.09 0.19 -0.11 0.00 -0.01 0.00 0.00 57.00 57.16 2bys n GLN 38 Cb 0.47 -1.66 -0.07 0.00 1.02 0.00 0.00 30.24 30.00 2bys n GLN 38 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 2bys s ASP 39 N -6.23 -0.61 -0.47 1.08 2.15 -0.65 0.45 116.67 112.40 2bys s ASP 39 Ca -0.15 1.14 -0.21 0.00 0.43 0.00 0.00 52.55 53.76 2bys s ASP 39 Cb 0.07 1.17 0.03 0.00 -0.30 0.00 0.00 42.92 43.90 2bys s ASP 39 CO 0.78 -0.20 0.69 -0.63 -0.17 0.00 0.00 175.17 175.65 2bys s ILE 40 N 0.46 4.76 0.01 4.11 1.01 -1.26 -0.11 121.20 130.17 2bys s ILE 40 Ca 0.00 0.06 -0.14 0.00 0.00 0.00 0.00 60.65 60.58 2bys s ILE 40 Cb -0.05 -4.28 -0.34 0.00 0.01 0.00 0.00 42.46 37.80 2bys s ILE 40 CO -0.05 -0.71 0.90 0.58 0.00 0.00 0.00 174.94 175.65 2bys h VAL 41 N 5.91 1.17 -2.19 2.92 2.07 -1.55 -3.41 116.25 121.17 2bys h VAL 41 Ca -0.26 -2.65 -0.04 0.00 0.82 0.00 0.00 66.70 64.57 2bys h VAL 41 Cb 1.09 2.95 -0.22 0.00 -1.52 0.00 0.00 31.29 33.59 2bys h VAL 41 CO 0.94 0.83 -0.01 -0.75 0.02 0.00 0.00 177.57 178.60 2bys s LYS 42 N -2.59 0.69 -0.19 1.57 2.20 -1.23 -4.91 119.74 115.27 2bys s LYS 42 Ca -0.11 0.98 0.01 0.00 -0.36 0.00 0.00 55.97 56.49 2bys s LYS 42 Cb 0.05 0.25 0.03 0.00 -1.51 0.00 0.00 37.83 36.64 2bys s LYS 42 CO 0.92 -0.11 -0.18 0.00 -0.36 0.00 0.00 175.35 175.61 2bys s ALA 43 N 0.85 2.36 -0.40 3.13 0.00 -1.26 -0.94 121.76 125.50 2bys s ALA 43 Ca -0.04 -1.32 -0.08 0.00 0.00 0.00 0.00 51.96 50.52 2bys s ALA 43 Cb -0.05 -1.25 0.07 0.00 0.00 0.00 0.00 23.12 21.89 2bys s ALA 43 CO -0.07 -0.51 0.23 0.34 0.00 0.00 0.00 175.76 175.75 2bys s ASP 44 N 1.26 5.57 0.00 0.00 -1.08 0.38 -4.94 116.67 117.86 2bys s ASP 44 Ca 0.02 -1.45 0.29 0.00 -0.52 0.00 0.00 52.55 50.89 2bys s ASP 44 Cb -0.14 -1.96 1.26 0.00 -1.46 0.00 0.00 42.92 40.62 2bys s ASP 44 CO -0.11 -0.50 1.90 -1.54 0.52 0.00 0.00 175.17 175.44 2bys n SER 45 N 4.89 0.20 0.15 -0.34 3.41 -1.26 0.13 113.62 120.80 2bys n SER 45 Ca -0.10 -0.14 0.11 0.00 -0.26 0.00 0.00 58.87 58.47 2bys n SER 45 Cb 0.43 -0.21 0.07 0.00 -0.26 0.00 0.00 64.21 64.23 2bys n SER 45 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 2bys h SER 46 N 0.19 0.00 0.00 4.04 4.64 -1.96 -3.37 113.55 117.08 2bys h SER 46 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2bys h SER 46 Cb 0.38 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.47 2bys h SER 46 CO 0.00 0.05 0.00 0.35 -0.87 0.00 0.00 176.83 176.36 2bys n THR 47 N -2.88 0.00 -3.62 2.95 -2.24 -1.18 -5.04 114.28 102.26 2bys n THR 47 Ca 0.01 -0.40 -0.27 0.00 -2.27 0.00 0.00 64.05 61.12 2bys n THR 47 Cb 0.56 1.05 0.04 0.00 -2.10 0.00 0.00 70.33 69.89 2bys n THR 47 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2bys n ASN 48 N -0.58 -4.85 -4.08 3.42 3.02 0.12 -4.93 115.26 107.38 2bys n ASN 48 Ca 0.00 -0.94 -0.24 0.00 -0.03 0.00 0.00 54.58 53.36 2bys n ASN 48 Cb 0.01 -3.74 -0.16 0.00 -0.61 0.00 0.00 39.78 35.28 2bys n ASN 48 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 2bys s GLU 49 N -5.74 1.56 0.01 3.52 2.02 -0.94 -1.41 118.70 117.72 2bys s GLU 49 Ca 0.40 -0.50 0.08 0.00 0.02 0.00 0.00 54.97 54.97 2bys s GLU 49 Cb -0.12 -1.36 -0.02 0.00 0.10 0.00 0.00 34.13 32.73 2bys s GLU 49 CO 0.84 0.18 -0.24 0.08 0.02 0.00 0.00 175.26 176.13 2bys s VAL 50 N 0.17 1.90 -0.18 2.63 1.01 -0.66 -0.47 120.40 124.81 2bys s VAL 50 Ca -0.05 -1.13 -0.04 0.00 0.00 0.00 0.00 61.98 60.75 2bys s VAL 50 Cb -0.11 -1.60 -0.02 0.00 0.00 0.00 0.00 36.38 34.64 2bys s VAL 50 CO 0.02 0.44 -0.02 -1.81 0.00 0.00 0.00 175.10 173.72 2bys s ASP 51 N -0.82 4.77 0.07 3.32 1.01 -0.11 -1.43 116.67 123.47 2bys s ASP 51 Ca 0.10 -0.18 0.08 0.00 0.71 0.00 0.00 52.55 53.26 2bys s ASP 51 Cb -0.09 -1.79 -0.03 0.00 1.01 0.00 0.00 42.92 42.01 2bys s ASP 51 CO 0.00 0.12 -0.18 -0.76 0.21 0.00 0.00 175.17 174.56 2bys s LEU 52 N 0.67 2.65 -0.16 1.23 1.43 0.07 -1.29 118.68 123.29 2bys s LEU 52 Ca -0.02 -0.46 -0.01 0.00 -1.03 0.00 0.00 54.13 52.61 2bys s LEU 52 Cb -0.14 -1.54 -0.01 0.00 0.03 0.00 0.00 46.19 44.53 2bys s LEU 52 CO 0.02 0.23 -0.10 -0.69 0.23 0.00 0.00 176.35 176.04 2bys s VAL 53 N -1.00 3.16 0.16 -1.59 1.01 0.84 -1.34 120.40 121.63 2bys s VAL 53 Ca 0.16 -0.61 -0.13 0.00 0.00 0.00 0.00 61.98 61.40 2bys s VAL 53 Cb -0.11 -2.36 0.01 0.00 0.00 0.00 0.00 36.38 33.93 2bys s VAL 53 CO 0.07 0.50 0.38 -0.72 0.00 0.00 0.00 175.10 175.33 2bys s TYR 54 N 0.67 0.09 0.11 5.22 -0.85 -0.97 -0.57 117.35 121.06 2bys s TYR 54 Ca -0.05 -0.45 0.09 0.00 -0.52 0.00 0.00 57.07 56.13 2bys s TYR 54 Cb -0.15 0.15 -0.04 0.00 0.38 0.00 0.00 41.96 42.30 2bys s TYR 54 CO 0.02 -0.77 -0.19 1.52 -1.52 0.00 0.00 175.55 174.62 2bys s TYR 55 N -3.90 2.51 -0.28 -3.49 -0.85 -0.41 -0.62 117.35 110.31 2bys s TYR 55 Ca 0.11 -0.27 0.03 0.00 -0.52 0.00 0.00 57.07 56.41 2bys s TYR 55 Cb 0.02 -1.35 0.08 0.00 0.38 0.00 0.00 41.96 41.09 2bys s TYR 55 CO -0.04 0.37 -0.03 -2.00 -1.52 0.00 0.00 175.55 172.33 2bys s GLU 56 N -2.07 1.73 -0.23 -3.49 2.12 -0.50 -1.06 118.70 115.20 2bys s GLU 56 Ca 0.17 -1.42 -0.29 0.00 0.36 0.00 0.00 54.97 53.79 2bys s GLU 56 Cb -0.10 -2.86 0.00 0.00 0.26 0.00 0.00 34.13 31.43 2bys s GLU 56 CO 0.09 -0.73 1.13 -1.14 -0.54 0.00 0.00 175.26 174.07 2bys s GLN 57 N 1.14 4.20 -0.11 4.30 0.74 -0.20 -3.39 119.66 126.33 2bys s GLN 57 Ca -0.00 1.39 0.01 0.00 0.05 0.00 0.00 55.36 56.81 2bys s GLN 57 Cb -0.19 -3.71 -0.02 0.00 1.10 0.00 0.00 33.01 30.19 2bys s GLN 57 CO -0.08 -0.73 -0.13 -0.65 -0.55 0.00 0.00 175.29 173.15 2bys s GLN 58 N 3.43 3.21 -0.02 1.67 -0.21 0.48 -2.10 119.66 126.11 2bys s GLN 58 Ca 0.48 -0.69 0.03 0.00 0.02 0.00 0.00 55.36 55.20 2bys s GLN 58 Cb -0.17 -2.58 0.00 0.00 1.00 0.00 0.00 33.01 31.26 2bys s GLN 58 CO 0.11 0.30 -0.09 1.03 -2.12 0.00 0.00 175.29 174.52 2bys s ARG 59 N 0.13 0.87 0.31 2.91 0.52 -0.49 -1.58 118.95 121.63 2bys s ARG 59 Ca -0.07 -0.30 -0.12 0.00 -0.52 0.00 0.00 55.73 54.72 2bys s ARG 59 Cb -0.15 -0.83 0.02 0.00 0.52 0.00 0.00 34.95 34.51 2bys s ARG 59 CO 0.05 0.13 0.59 1.67 0.02 0.00 0.00 175.30 177.76 2bys s TRP 60 N 0.08 0.40 -0.08 -0.53 -2.14 -1.00 -0.86 118.94 114.81 2bys s TRP 60 Ca -0.01 -0.82 -0.03 0.00 2.66 0.00 0.00 56.10 57.90 2bys s TRP 60 Cb -0.07 0.36 0.04 0.00 -3.10 0.00 0.00 33.47 30.70 2bys s TRP 60 CO 0.00 -1.21 0.16 0.21 -2.66 0.00 0.00 176.95 173.45 2bys s LYS 61 N -3.34 0.07 -0.11 3.25 2.20 -1.26 -0.17 119.74 120.39 2bys s LYS 61 Ca 0.21 0.48 0.02 0.00 -0.36 0.00 0.00 55.97 56.32 2bys s LYS 61 Cb -0.02 -0.21 -0.01 0.00 -1.51 0.00 0.00 37.83 36.07 2bys s LYS 61 CO 0.12 -0.23 -0.17 -0.51 -0.36 0.00 0.00 175.35 174.20 2bys s LEU 62 N 1.72 2.49 0.50 5.43 1.43 -0.35 -4.92 118.68 124.98 2bys s LEU 62 Ca -0.03 -0.39 0.24 0.00 -1.03 0.00 0.00 54.13 52.91 2bys s LEU 62 Cb -0.12 -1.53 1.34 0.00 0.03 0.00 0.00 46.19 45.92 2bys s LEU 62 CO -0.06 0.19 2.06 0.78 0.23 0.00 0.00 176.35 179.55 2bys h ASN 63 N 6.48 0.00 0.54 2.29 4.21 -1.88 -2.32 115.58 124.90 2bys h ASN 63 Ca -0.27 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.24 2bys h ASN 63 Cb 1.21 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.41 2bys h ASN 63 CO 0.52 0.13 0.00 -1.54 -1.29 0.00 0.00 177.43 175.25 2bys n SER 64 N -3.85 0.08 -1.04 5.81 3.41 -1.26 -2.45 113.62 114.32 2bys n SER 64 Ca -0.02 0.52 0.08 0.00 -0.26 0.00 0.00 58.87 59.19 2bys n SER 64 Cb 0.23 -0.54 0.26 0.00 -0.26 0.00 0.00 64.21 63.90 2bys n SER 64 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2bys n LEU 65 N -1.59 3.89 -4.82 1.04 4.77 -0.87 -5.01 117.00 114.41 2bys n LEU 65 Ca 0.03 -2.52 -0.35 0.00 -0.03 0.00 0.00 56.01 53.15 2bys n LEU 65 Cb 0.18 -0.46 -0.06 0.00 -2.33 0.00 0.00 43.42 40.75 2bys n LEU 65 CO 0.15 0.73 0.52 -0.04 -1.33 0.00 0.00 177.39 177.42 2bys s MET 66 N -1.95 4.25 0.21 3.23 -1.94 -1.02 -3.66 119.30 118.41 2bys s MET 66 Ca 0.39 0.97 -0.16 0.00 -1.71 0.00 0.00 55.69 55.18 2bys s MET 66 Cb 0.27 -2.57 0.02 0.00 2.01 0.00 0.00 34.83 34.56 2bys s MET 66 CO 0.16 0.20 0.50 1.67 -0.01 0.00 0.00 175.02 177.54 2bys s TRP 67 N -1.83 0.03 -0.35 -0.03 -2.14 -0.22 -4.95 118.94 109.44 2bys s TRP 67 Ca 0.52 -0.39 -0.13 0.00 2.66 0.00 0.00 56.10 58.76 2bys s TRP 67 Cb -0.13 0.33 -0.00 0.00 -3.10 0.00 0.00 33.47 30.56 2bys s TRP 67 CO 0.19 -0.94 0.24 0.34 -2.66 0.00 0.00 176.95 174.11 2bys s ASP 68 N -2.92 5.96 0.54 -2.66 2.15 -1.26 -4.62 116.67 113.86 2bys s ASP 68 Ca 0.13 -0.59 0.29 0.00 0.43 0.00 0.00 52.55 52.81 2bys s ASP 68 Cb -0.01 -2.11 1.45 0.00 -0.30 0.00 0.00 42.92 41.95 2bys s ASP 68 CO 0.01 -0.29 1.93 -0.65 -0.17 0.00 0.00 175.17 176.00 2bys h PRO 69 N 8.49 0.00 0.00 4.34 0.11 -1.93 -0.80 132.00 142.21 2bys h PRO 69 Ca -0.30 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 65.74 2bys h PRO 69 Cb 1.14 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.24 2bys h PRO 69 CO 0.65 0.00 -0.35 -0.91 -0.21 0.00 0.00 178.00 177.19 2bys h ASN 70 N 0.00 0.00 1.17 -2.05 -0.26 -1.93 0.86 115.58 113.37 2bys h ASN 70 Ca 0.34 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 56.08 2bys h ASN 70 Cb 1.40 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.66 2bys h ASN 70 CO -0.00 0.35 -0.04 -0.62 -1.06 0.00 0.00 177.43 176.05 2bys n GLU 71 N -3.87 0.12 -2.53 0.81 1.02 -0.31 -4.09 120.64 111.79 2bys n GLU 71 Ca -0.01 0.09 -0.13 0.00 -0.02 0.00 0.00 57.16 57.08 2bys n GLU 71 Cb 0.42 -1.63 0.03 0.00 -0.02 0.00 0.00 31.44 30.23 2bys n GLU 71 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 2bys n TYR 72 N -1.83 2.01 -2.89 -0.32 4.02 -0.82 -5.00 117.16 112.33 2bys n TYR 72 Ca 0.06 -2.52 -0.19 0.00 -0.01 0.00 0.00 57.90 55.25 2bys n TYR 72 Cb 0.38 -0.27 0.03 0.00 -0.02 0.00 0.00 39.34 39.47 2bys n TYR 72 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2bys n GLY 73 N -0.46 -0.32 2.51 2.72 0.00 -0.98 -2.55 105.19 106.11 2bys n GLY 73 Ca 0.23 -0.02 -0.18 0.00 0.00 0.00 0.00 46.02 46.04 2bys n GLY 73 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2bys n ASN 74 N -1.81 -5.21 -4.68 1.61 2.85 0.29 -4.98 115.26 103.33 2bys n ASN 74 Ca -0.10 0.40 -0.42 0.00 -0.11 0.00 0.00 54.58 54.35 2bys n ASN 74 Cb 0.60 -4.32 -0.03 0.00 1.24 0.00 0.00 39.78 37.28 2bys n ASN 74 CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 2bys s ILE 75 N -2.70 3.85 -0.35 -1.44 1.01 -1.06 -4.90 121.20 115.62 2bys s ILE 75 Ca 0.00 1.15 0.20 0.00 0.00 0.00 0.00 60.65 62.01 2bys s ILE 75 Cb 0.00 -3.74 -0.28 0.00 0.01 0.00 0.00 42.46 38.45 2bys s ILE 75 CO 0.00 -0.04 0.59 0.35 0.00 0.00 0.00 174.94 175.83 2bys n THR 76 N 4.98 0.00 -3.79 2.92 -2.24 -1.26 -4.33 114.28 110.56 2bys n THR 76 Ca 0.14 -0.31 -0.04 0.00 -2.27 0.00 0.00 64.05 61.56 2bys n THR 76 Cb 0.44 0.38 -0.01 0.00 -2.10 0.00 0.00 70.33 69.04 2bys n THR 76 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 2bys s ASP 77 N -3.83 -0.16 -0.01 3.42 1.47 -1.26 -0.01 116.67 116.29 2bys s ASP 77 Ca -0.02 -0.51 -0.29 0.00 1.18 0.00 0.00 52.55 52.90 2bys s ASP 77 Cb 0.14 0.55 0.07 0.00 -0.34 0.00 0.00 42.92 43.34 2bys s ASP 77 CO 0.84 -1.03 0.68 0.72 0.68 0.00 0.00 175.17 177.06 2bys s PHE 78 N -3.19 -0.62 0.19 2.11 -0.12 -0.18 -5.00 117.98 111.17 2bys s PHE 78 Ca 0.13 0.94 -0.29 0.00 -0.05 0.00 0.00 56.93 57.66 2bys s PHE 78 Cb -0.02 0.44 -0.08 0.00 -0.63 0.00 0.00 43.02 42.73 2bys s PHE 78 CO 0.04 -0.64 0.93 1.03 -0.05 0.00 0.00 175.22 176.53 2bys s ARG 79 N -1.70 4.78 -0.03 1.99 3.00 -1.26 -1.18 118.95 124.56 2bys s ARG 79 Ca -0.08 1.44 -0.09 0.00 0.00 0.00 0.00 55.73 57.00 2bys s ARG 79 Cb -0.00 -3.31 0.01 0.00 0.00 0.00 0.00 34.95 31.65 2bys s ARG 79 CO 0.05 0.43 0.19 -0.08 0.00 0.00 0.00 175.30 175.90 2bys s THR 80 N -0.83 0.05 0.35 0.02 -1.32 -0.04 -4.96 115.64 108.91 2bys s THR 80 Ca 0.42 -0.44 -0.27 0.00 -1.21 0.00 0.00 61.69 60.18 2bys s THR 80 Cb -0.25 -0.43 -0.12 0.00 -1.51 0.00 0.00 72.50 70.19 2bys s THR 80 CO 0.31 -0.24 1.23 -0.24 -2.21 0.00 0.00 174.62 173.46 2bys n SER 81 N 1.87 2.43 0.28 8.08 2.88 -1.26 -0.17 113.62 127.73 2bys n SER 81 Ca -0.19 1.18 0.15 0.00 -1.33 0.00 0.00 58.87 58.68 2bys n SER 81 Cb 0.56 -1.45 0.84 0.00 -0.75 0.00 0.00 64.21 63.41 2bys n SER 81 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2bys h ALA 82 N 2.35 1.24 0.00 -1.46 0.00 -1.36 -1.64 119.26 118.39 2bys h ALA 82 Ca -0.45 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 54.34 2bys h ALA 82 Cb 1.30 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.07 2bys h ALA 82 CO 0.62 0.08 -0.25 0.00 0.00 0.00 0.00 179.25 179.70 2bys h ALA 83 N 1.93 0.96 0.00 0.00 0.00 -1.90 -3.11 119.26 117.14 2bys h ALA 83 Ca -0.00 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.68 2bys h ALA 83 Cb 0.24 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.99 2bys h ALA 83 CO 0.01 0.31 0.00 -0.25 0.00 0.00 0.00 179.25 179.32 2bys n ASP 84 N -3.33 0.06 -4.39 0.00 8.00 -0.62 -4.85 116.55 111.43 2bys n ASP 84 Ca 0.01 0.51 -0.19 0.00 0.71 0.00 0.00 54.79 55.82 2bys n ASP 84 Cb 0.48 -0.52 -0.10 0.00 -0.02 0.00 0.00 41.12 40.96 2bys n ASP 84 CO 0.00 0.00 0.00 0.27 -0.39 0.00 0.00 177.20 177.08 2bys s ILE 85 N -3.01 1.10 0.19 0.53 -4.36 -1.18 -4.98 121.20 109.49 2bys s ILE 85 Ca 0.13 -2.03 -0.30 0.00 -0.26 0.00 0.00 60.65 58.19 2bys s ILE 85 Cb 0.17 -2.57 -0.08 0.00 1.25 0.00 0.00 42.46 41.23 2bys s ILE 85 CO 0.50 -0.15 1.12 0.86 0.24 0.00 0.00 174.94 177.51 2bys s TRP 86 N -3.37 3.56 0.08 1.37 -0.00 -1.26 -4.93 118.94 114.39 2bys s TRP 86 Ca 0.33 1.58 0.06 0.00 -0.00 0.00 0.00 56.10 58.07 2bys s TRP 86 Cb 0.07 -3.31 -0.03 0.00 -0.00 0.00 0.00 33.47 30.20 2bys s TRP 86 CO 0.12 -0.72 -0.17 0.95 -0.00 0.00 0.00 176.95 177.13 2bys s THR 87 N -0.32 1.38 0.42 5.86 -4.23 -1.26 -5.10 115.64 112.38 2bys s THR 87 Ca 0.49 -1.41 -0.23 0.00 -1.18 0.00 0.00 61.69 59.36 2bys s THR 87 Cb -0.30 -1.28 -0.09 0.00 1.34 0.00 0.00 72.50 72.17 2bys s THR 87 CO 0.36 -0.15 1.06 -2.16 -0.54 0.00 0.00 174.62 173.19 2bys s PRO 88 N -1.81 4.05 -0.51 3.99 0.04 -1.26 -4.94 135.00 134.56 2bys s PRO 88 Ca 0.02 1.52 -0.05 0.00 0.04 0.00 0.00 61.00 62.53 2bys s PRO 88 Cb -0.10 -2.45 -0.01 0.00 0.04 0.00 0.00 34.50 31.98 2bys s PRO 88 CO 0.03 -0.24 2.93 -0.40 0.04 0.00 0.00 177.00 179.36 2bys n ASP 89 N -0.27 6.49 -4.66 6.66 5.75 -1.26 -4.94 116.55 124.32 2bys n ASP 89 Ca 0.06 -3.01 -0.43 0.00 -0.01 0.00 0.00 54.79 51.41 2bys n ASP 89 Cb 0.50 -1.31 -0.02 0.00 -1.03 0.00 0.00 41.12 39.26 2bys n ASP 89 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 2bys s ILE 90 N -1.19 4.05 -0.01 2.12 -1.09 -1.26 -2.62 121.20 121.20 2bys s ILE 90 Ca 0.61 1.26 0.04 0.00 -2.23 0.00 0.00 60.65 60.33 2bys s ILE 90 Cb 0.34 -3.83 -0.01 0.00 -1.58 0.00 0.00 42.46 37.38 2bys s ILE 90 CO -0.15 -0.13 -0.13 -0.89 -1.23 0.00 0.00 174.94 172.41 2bys s THR 91 N 3.74 1.03 0.01 2.92 2.01 0.33 -4.88 115.64 120.80 2bys s THR 91 Ca 0.61 -0.54 -0.30 0.00 0.31 0.00 0.00 61.69 61.76 2bys s THR 91 Cb -0.25 -0.86 -0.04 0.00 0.01 0.00 0.00 72.50 71.35 2bys s THR 91 CO 0.20 0.29 1.20 0.00 -0.69 0.00 0.00 174.62 175.62 2bys s ALA 92 N -0.22 3.43 0.21 7.40 0.00 -1.26 -1.69 121.76 129.63 2bys s ALA 92 Ca 0.03 0.74 -0.07 0.00 0.00 0.00 0.00 51.96 52.67 2bys s ALA 92 Cb -0.06 -3.48 0.15 0.00 0.00 0.00 0.00 23.12 19.74 2bys s ALA 92 CO -0.00 -0.59 1.68 -0.92 0.00 0.00 0.00 175.76 175.93 2bys h TYR 93 N 7.14 1.07 -0.55 0.00 5.03 -1.07 -3.28 116.97 125.30 2bys h TYR 93 Ca -0.38 -0.17 -0.33 0.00 2.58 0.00 0.00 58.73 60.43 2bys h TYR 93 Cb 1.19 -0.28 -0.20 0.00 1.55 0.00 0.00 36.73 38.99 2bys h TYR 93 CO 0.70 0.95 0.01 -1.13 -1.32 0.00 0.00 178.16 177.38 2bys n SER 94 N -4.19 3.49 -4.77 -2.11 3.41 -1.26 -5.02 113.62 103.18 2bys n SER 94 Ca 0.03 -3.77 -0.36 0.00 -0.26 0.00 0.00 58.87 54.50 2bys n SER 94 Cb 0.34 -0.66 0.00 0.00 -0.26 0.00 0.00 64.21 63.62 2bys n SER 94 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2bys s SER 95 N -2.45 5.90 -0.00 4.04 1.04 -1.24 -1.36 113.70 119.62 2bys s SER 95 Ca 0.49 2.30 0.06 0.00 0.48 0.00 0.00 55.95 59.28 2bys s SER 95 Cb 0.43 -2.60 -0.08 0.00 0.10 0.00 0.00 66.02 63.87 2bys s SER 95 CO 0.01 -1.10 0.17 0.35 0.98 0.00 0.00 173.24 173.65 2bys n THR 96 N -0.86 0.00 -4.21 2.02 -2.24 -0.11 -4.86 114.28 104.02 2bys n THR 96 Ca 0.09 -0.23 -0.15 0.00 -2.27 0.00 0.00 64.05 61.49 2bys n THR 96 Cb 0.49 0.63 -0.11 0.00 -2.10 0.00 0.00 70.33 69.24 2bys n THR 96 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2bys s ARG 97 N -2.04 0.94 0.42 -0.78 3.00 -1.24 -5.05 118.95 114.19 2bys s ARG 97 Ca -0.00 -1.24 -0.26 0.00 0.00 0.00 0.00 55.73 54.23 2bys s ARG 97 Cb 0.04 -0.66 -0.10 0.00 0.00 0.00 0.00 34.95 34.23 2bys s ARG 97 CO 0.24 0.11 1.29 -2.30 0.00 0.00 0.00 175.30 174.63 2bys n PRO 98 N 0.41 1.98 -2.07 3.54 -0.02 -1.26 -4.68 135.00 132.90 2bys n PRO 98 Ca -0.15 0.70 -0.42 0.00 -2.02 0.00 0.00 63.50 61.62 2bys n PRO 98 Cb 0.58 -2.40 -0.03 0.00 -0.02 0.00 0.00 33.50 31.63 2bys n PRO 98 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2bys s VAL 99 N -1.19 2.90 -0.29 -1.45 1.01 -1.26 -4.87 120.40 115.25 2bys s VAL 99 Ca 0.60 0.71 -0.11 0.00 0.00 0.00 0.00 61.98 63.18 2bys s VAL 99 Cb -0.51 -3.45 -0.04 0.00 0.00 0.00 0.00 36.38 32.39 2bys s VAL 99 CO 0.58 0.09 0.18 -1.10 0.00 0.00 0.00 175.10 174.85 2bys s GLN 100 N 0.28 3.74 -0.13 2.72 -0.21 -0.89 -4.98 119.66 120.19 2bys s GLN 100 Ca 0.62 -0.46 -0.26 0.00 0.02 0.00 0.00 55.36 55.28 2bys s GLN 100 Cb -0.40 -3.64 -0.02 0.00 1.00 0.00 0.00 33.01 29.96 2bys s GLN 100 CO 0.37 -0.27 0.87 0.08 -2.12 0.00 0.00 175.29 174.23 2bys s VAL 101 N 1.72 4.87 -0.99 1.09 1.01 -1.26 -1.15 120.40 125.68 2bys s VAL 101 Ca 0.06 1.74 0.17 0.00 0.00 0.00 0.00 61.98 63.95 2bys s VAL 101 Cb -0.16 -4.18 -0.13 0.00 0.00 0.00 0.00 36.38 31.90 2bys s VAL 101 CO 0.09 0.05 0.75 0.18 0.00 0.00 0.00 175.10 176.17 2bys n LEU 102 N 4.95 1.02 -4.39 3.92 4.77 -0.04 -4.98 117.00 122.25 2bys n LEU 102 Ca 0.05 -0.57 -0.20 0.00 -0.03 0.00 0.00 56.01 55.26 2bys n LEU 102 Cb 0.49 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.48 2bys n LEU 102 CO 0.49 0.23 -0.40 -0.94 -1.33 0.00 0.00 177.39 175.44 2bys s SER 103 N -2.40 2.72 0.34 -1.43 1.04 -1.24 -4.92 113.70 107.81 2bys s SER 103 Ca 0.08 -1.11 -0.29 0.00 0.48 0.00 0.00 55.95 55.12 2bys s SER 103 Cb 0.13 -0.16 -0.11 0.00 0.10 0.00 0.00 66.02 65.97 2bys s SER 103 CO 0.61 -0.25 1.54 -2.65 0.98 0.00 0.00 173.24 173.48 2bys n PRO 104 N -0.50 2.70 -2.38 4.02 -0.02 -1.26 -4.88 135.00 132.70 2bys n PRO 104 Ca -0.06 0.95 -0.43 0.00 -2.02 0.00 0.00 63.50 61.94 2bys n PRO 104 Cb 0.62 -2.71 0.00 0.00 -0.02 0.00 0.00 33.50 31.39 2bys n PRO 104 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 2bys n GLN 105 N 1.25 3.51 -4.52 -0.52 1.13 -1.26 -4.89 117.38 112.08 2bys n GLN 105 Ca 0.05 -3.49 -0.25 0.00 -1.94 0.00 0.00 57.00 51.37 2bys n GLN 105 Cb 0.38 -2.99 -0.17 0.00 0.11 0.00 0.00 30.24 27.58 2bys n GLN 105 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 2bys s ILE 106 N 0.89 1.14 0.42 5.09 1.01 -1.26 -0.93 121.20 127.56 2bys s ILE 106 Ca 0.41 -0.47 0.08 0.00 0.00 0.00 0.00 60.65 60.67 2bys s ILE 106 Cb 0.08 -1.05 -0.02 0.00 0.01 0.00 0.00 42.46 41.48 2bys s ILE 106 CO -0.00 0.36 0.36 0.00 0.00 0.00 0.00 174.94 175.65 2bys s ALA 107 N 0.77 4.02 -0.14 9.38 0.00 0.76 -4.68 121.76 131.87 2bys s ALA 107 Ca -0.13 -1.90 0.01 0.00 0.00 0.00 0.00 51.96 49.94 2bys s ALA 107 Cb -0.15 -0.93 0.02 0.00 0.00 0.00 0.00 23.12 22.06 2bys s ALA 107 CO 0.02 -0.23 -0.16 0.08 0.00 0.00 0.00 175.76 175.47 2bys s VAL 108 N -2.50 1.66 -0.20 0.00 1.01 -0.67 -0.86 120.40 118.84 2bys s VAL 108 Ca 0.47 -0.71 -0.09 0.00 0.00 0.00 0.00 61.98 61.65 2bys s VAL 108 Cb -0.02 -1.53 -0.04 0.00 0.00 0.00 0.00 36.38 34.79 2bys s VAL 108 CO 0.27 0.47 0.10 -0.69 0.00 0.00 0.00 175.10 175.26 2bys s VAL 109 N 1.23 5.07 0.16 2.92 1.01 -0.33 -1.80 120.40 128.66 2bys s VAL 109 Ca -0.00 0.07 0.03 0.00 0.00 0.00 0.00 61.98 62.08 2bys s VAL 109 Cb -0.14 -3.31 -0.04 0.00 0.00 0.00 0.00 36.38 32.90 2bys s VAL 109 CO -0.07 0.43 0.25 -0.89 0.00 0.00 0.00 175.10 174.82 2bys s THR 110 N 0.54 5.07 0.63 3.92 2.01 -0.05 -1.01 115.64 126.74 2bys s THR 110 Ca 0.06 -0.84 0.37 0.00 0.31 0.00 0.00 61.69 61.58 2bys s THR 110 Cb -0.12 -3.62 0.40 0.00 0.01 0.00 0.00 72.50 69.16 2bys s THR 110 CO 0.00 -0.12 2.31 1.12 -0.69 0.00 0.00 174.62 177.24 2bys h HIS 111 N 2.11 0.00 -0.02 4.92 2.07 -0.73 0.16 115.15 123.68 2bys h HIS 111 Ca -0.49 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.03 2bys h HIS 111 Cb 1.20 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.18 2bys h HIS 111 CO 0.54 0.00 0.00 -0.40 -3.07 0.00 0.00 177.93 175.00 2bys n ASP 112 N -3.50 0.19 0.00 3.10 5.75 -1.26 -1.06 116.55 119.77 2bys n ASP 112 Ca -0.03 -1.38 0.00 0.00 -0.01 0.00 0.00 54.79 53.37 2bys n ASP 112 Cb 0.08 -0.01 0.00 0.00 -1.03 0.00 0.00 41.12 40.16 2bys n ASP 112 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2bys n GLY 113 N 0.87 0.87 3.78 6.12 0.00 0.58 -4.71 105.19 112.69 2bys n GLY 113 Ca 0.16 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.81 2bys n GLY 113 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2bys s SER 114 N -3.01 6.68 -0.01 1.61 1.04 -1.24 -1.21 113.70 117.56 2bys s SER 114 Ca 0.00 2.07 0.06 0.00 0.48 0.00 0.00 55.95 58.55 2bys s SER 114 Cb 0.00 -2.59 -0.02 0.00 0.10 0.00 0.00 66.02 63.52 2bys s SER 114 CO 0.00 -0.55 -0.18 -0.69 0.98 0.00 0.00 173.24 172.80 2bys s VAL 115 N -1.65 1.44 -0.03 5.02 1.01 0.76 -0.87 120.40 126.07 2bys s VAL 115 Ca 0.59 -0.83 0.05 0.00 0.00 0.00 0.00 61.98 61.79 2bys s VAL 115 Cb -0.23 -1.21 -0.01 0.00 0.00 0.00 0.00 36.38 34.94 2bys s VAL 115 CO 0.28 0.37 -0.17 -0.32 0.00 0.00 0.00 175.10 175.26 2bys s MET 116 N -0.53 1.61 -0.04 2.72 0.00 -0.75 -2.37 119.30 119.94 2bys s MET 116 Ca 0.07 -0.60 -0.01 0.00 0.00 0.00 0.00 55.69 55.14 2bys s MET 116 Cb -0.07 -1.45 0.03 0.00 0.00 0.00 0.00 34.83 33.34 2bys s MET 116 CO -0.00 0.29 0.07 0.12 0.00 0.00 0.00 175.02 175.50 2bys s PHE 117 N -0.13 -0.05 -0.48 4.11 5.36 -0.61 -1.67 117.98 124.51 2bys s PHE 117 Ca 0.00 0.26 0.06 0.00 -0.96 0.00 0.00 56.93 56.30 2bys s PHE 117 Cb -0.10 -0.16 0.22 0.00 -0.34 0.00 0.00 43.02 42.64 2bys s PHE 117 CO 0.01 -0.11 0.53 -0.89 -1.46 0.00 0.00 175.22 173.29 2bys n ILE 118 N 4.12 0.08 -2.32 3.12 5.41 -1.26 -0.39 119.36 128.13 2bys n ILE 118 Ca -0.26 -4.23 -0.42 0.00 1.00 0.00 0.00 62.75 58.84 2bys n ILE 118 Cb 0.51 -1.94 -0.03 0.00 -0.71 0.00 0.00 39.64 37.47 2bys n ILE 118 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 2bys s PRO 119 N -1.21 4.41 0.12 0.38 0.04 -1.22 -4.69 135.00 132.83 2bys s PRO 119 Ca 0.35 1.92 -0.24 0.00 0.04 0.00 0.00 61.00 63.07 2bys s PRO 119 Cb 0.11 -3.27 -0.07 0.00 0.04 0.00 0.00 34.50 31.31 2bys s PRO 119 CO -0.12 -0.26 0.72 0.00 0.04 0.00 0.00 177.00 177.38 2bys s ALA 120 N 0.66 3.47 -0.01 8.56 0.00 -1.26 -1.41 121.76 131.77 2bys s ALA 120 Ca 0.58 0.25 -0.02 0.00 0.00 0.00 0.00 51.96 52.77 2bys s ALA 120 Cb -0.33 -2.87 -0.00 0.00 0.00 0.00 0.00 23.12 19.91 2bys s ALA 120 CO 0.33 0.28 0.05 -0.65 0.00 0.00 0.00 175.76 175.76 2bys s GLN 121 N -0.92 0.20 -0.23 0.00 -0.21 0.21 -0.86 119.66 117.85 2bys s GLN 121 Ca 0.34 -0.17 -0.09 0.00 0.02 0.00 0.00 55.36 55.46 2bys s GLN 121 Cb -0.22 0.08 -0.04 0.00 1.00 0.00 0.00 33.01 33.83 2bys s GLN 121 CO 0.24 -0.04 0.12 0.50 -2.12 0.00 0.00 175.29 173.99 2bys s ARG 122 N -0.58 3.98 -0.10 2.91 3.52 -0.30 -2.29 118.95 126.08 2bys s ARG 122 Ca -0.06 -0.32 0.02 0.00 -0.13 0.00 0.00 55.73 55.23 2bys s ARG 122 Cb -0.04 -3.43 0.01 0.00 -1.56 0.00 0.00 34.95 29.93 2bys s ARG 122 CO 0.00 0.06 -0.15 -1.17 -0.81 0.00 0.00 175.30 173.23 2bys s LEU 123 N 1.01 1.72 -0.17 -0.88 2.96 -0.45 -2.10 118.68 120.77 2bys s LEU 123 Ca 0.06 -0.42 -0.14 0.00 -0.22 0.00 0.00 54.13 53.41 2bys s LEU 123 Cb -0.14 -1.08 -0.04 0.00 0.50 0.00 0.00 46.19 45.43 2bys s LEU 123 CO 0.04 0.02 0.32 -0.44 -1.32 0.00 0.00 176.35 174.96 2bys s SER 124 N 0.95 6.43 0.16 3.68 0.01 -1.26 -0.75 113.70 122.92 2bys s SER 124 Ca -0.07 0.51 -0.01 0.00 1.31 0.00 0.00 55.95 57.68 2bys s SER 124 Cb -0.15 -2.19 -0.04 0.00 0.21 0.00 0.00 66.02 63.84 2bys s SER 124 CO -0.01 0.06 0.07 0.72 0.41 0.00 0.00 173.24 174.49 2bys s PHE 125 N 0.68 0.99 -0.18 2.43 -0.12 -0.51 -0.93 117.98 120.34 2bys s PHE 125 Ca 0.17 -1.25 -0.29 0.00 -0.05 0.00 0.00 56.93 55.51 2bys s PHE 125 Cb -0.13 -0.54 -0.01 0.00 -0.63 0.00 0.00 43.02 41.71 2bys s PHE 125 CO 0.05 -0.51 1.23 -1.64 -0.05 0.00 0.00 175.22 174.30 2bys s MET 126 N -4.06 4.23 -0.26 1.99 -1.94 -0.47 -1.65 119.30 117.14 2bys s MET 126 Ca 0.28 1.60 -0.10 0.00 -1.71 0.00 0.00 55.69 55.76 2bys s MET 126 Cb 0.07 -3.75 0.11 0.00 2.01 0.00 0.00 34.83 33.27 2bys s MET 126 CO 0.05 -0.71 0.59 0.00 -0.01 0.00 0.00 175.02 174.94 2bys s ASP 128 N 2.52 6.37 -0.00 0.00 2.15 -1.26 -3.11 116.67 123.33 2bys s ASP 128 Ca -0.06 -0.25 0.02 0.00 0.43 0.00 0.00 52.55 52.69 2bys s ASP 128 Cb -0.11 -2.43 0.06 0.00 -0.30 0.00 0.00 42.92 40.14 2bys s ASP 128 CO -0.17 -1.15 0.98 -0.81 -0.17 0.00 0.00 175.17 173.85 2bys n PRO 129 N 7.28 1.17 -1.58 4.34 -0.04 -1.26 -4.65 135.00 140.26 2bys n PRO 129 Ca 0.02 -0.23 -0.49 0.00 -0.04 0.00 0.00 63.50 62.76 2bys n PRO 129 Cb 0.48 -1.13 -0.04 0.00 -0.04 0.00 0.00 33.50 32.77 2bys n PRO 129 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 2bys n THR 130 N -0.26 0.84 0.00 0.52 -1.04 -1.26 -1.74 114.28 111.33 2bys n THR 130 Ca 0.02 -0.21 0.00 0.00 -2.04 0.00 0.00 64.05 61.82 2bys n THR 130 Cb 0.10 -0.85 0.00 0.00 -1.82 0.00 0.00 70.33 67.76 2bys n THR 130 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2bys n GLY 131 N 2.05 1.44 0.31 3.41 0.00 -1.26 -4.34 105.19 106.79 2bys n GLY 131 Ca 0.15 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.31 2bys n GLY 131 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 2bys h VAL 132 N 0.00 0.88 -0.33 1.61 3.04 -1.51 0.11 116.25 120.05 2bys h VAL 132 Ca 0.00 0.00 -0.09 0.00 -1.01 0.00 0.00 66.70 65.60 2bys h VAL 132 Cb 0.00 0.88 -0.05 0.00 -2.01 0.00 0.00 31.29 30.11 2bys h VAL 132 CO 0.00 0.00 0.11 -0.90 -1.01 0.00 0.00 177.57 175.77 2bys n ASP 133 N -4.46 3.20 -4.41 3.17 5.75 -1.26 -1.24 116.55 117.29 2bys n ASP 133 Ca 0.03 -2.53 -0.20 0.00 -0.01 0.00 0.00 54.79 52.07 2bys n ASP 133 Cb 0.32 -0.61 -0.10 0.00 -1.03 0.00 0.00 41.12 39.69 2bys n ASP 133 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 2bys s SER 134 N -0.21 2.48 0.46 -1.12 1.04 0.38 -5.02 113.70 111.71 2bys s SER 134 Ca 0.25 -1.24 0.24 0.00 0.48 0.00 0.00 55.95 55.67 2bys s SER 134 Cb 0.20 -0.11 1.11 0.00 0.10 0.00 0.00 66.02 67.31 2bys s SER 134 CO 0.06 -0.44 1.93 -0.08 0.98 0.00 0.00 173.24 175.69 2bys h GLU 135 N 2.28 0.00 0.00 4.02 4.81 -1.89 -1.99 114.58 121.81 2bys h GLU 135 Ca -0.40 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 58.82 2bys h GLU 135 Cb 1.23 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.61 2bys h GLU 135 CO 0.67 0.21 -0.30 1.05 -0.73 0.00 0.00 179.01 179.92 2bys h GLU 136 N 0.00 0.00 0.00 1.92 9.09 -1.96 -3.50 114.58 120.13 2bys h GLU 136 Ca -0.00 0.00 0.05 0.00 0.05 0.00 0.00 59.36 59.46 2bys h GLU 136 Cb 0.57 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.66 2bys h GLU 136 CO 0.03 0.03 -0.06 0.41 0.05 0.00 0.00 179.01 179.46 2bys n GLY 137 N 1.13 -1.93 3.97 1.06 0.00 -0.75 -4.82 105.19 103.86 2bys n GLY 137 Ca 0.03 -1.35 -0.21 0.00 0.00 0.00 0.00 46.02 44.49 2bys n GLY 137 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bys s ALA 138 N -1.32 4.02 -0.02 4.61 0.00 0.30 -4.23 121.76 125.13 2bys s ALA 138 Ca 0.00 -1.28 0.01 0.00 0.00 0.00 0.00 51.96 50.69 2bys s ALA 138 Cb 0.00 -1.81 0.02 0.00 0.00 0.00 0.00 23.12 21.32 2bys s ALA 138 CO 0.00 -0.03 -0.02 0.99 0.00 0.00 0.00 175.76 176.71 2bys s THR 139 N -2.21 0.27 0.09 0.00 2.01 -1.26 -1.09 115.64 113.45 2bys s THR 139 Ca 0.42 -0.01 -0.07 0.00 0.31 0.00 0.00 61.69 62.34 2bys s THR 139 Cb -0.09 -0.32 -0.01 0.00 0.01 0.00 0.00 72.50 72.09 2bys s THR 139 CO 0.32 0.14 0.16 0.00 -0.69 0.00 0.00 174.62 174.56 2bys s ALA 141 N -3.89 -0.34 -0.12 0.00 0.00 -1.26 -0.29 121.76 115.86 2bys s ALA 141 Ca 0.08 0.10 -0.06 0.00 0.00 0.00 0.00 51.96 52.07 2bys s ALA 141 Cb 0.05 -0.05 0.05 0.00 0.00 0.00 0.00 23.12 23.17 2bys s ALA 141 CO -0.09 -0.15 0.29 0.54 0.00 0.00 0.00 175.76 176.35 2bys s VAL 142 N -0.76 -0.03 -0.02 0.00 0.11 -0.50 -4.89 120.40 114.30 2bys s VAL 142 Ca -0.08 0.13 0.00 0.00 -2.93 0.00 0.00 61.98 59.09 2bys s VAL 142 Cb -0.05 -0.44 -0.04 0.00 -1.53 0.00 0.00 36.38 34.33 2bys s VAL 142 CO 0.01 0.05 0.04 -1.59 -3.33 0.00 0.00 175.10 170.28 2bys s LYS 143 N 1.24 2.93 -0.01 1.54 -2.85 -1.26 -1.16 119.74 120.17 2bys s LYS 143 Ca -0.09 -0.52 0.08 0.00 -1.00 0.00 0.00 55.97 54.44 2bys s LYS 143 Cb -0.09 -2.77 -0.02 0.00 -2.06 0.00 0.00 37.83 32.88 2bys s LYS 143 CO -0.09 0.65 -0.26 -0.06 0.10 0.00 0.00 175.35 175.69 2bys s PHE 144 N -1.10 2.28 0.06 1.78 0.08 -0.30 -0.36 117.98 120.43 2bys s PHE 144 Ca 0.20 -0.43 -0.27 0.00 0.12 0.00 0.00 56.93 56.55 2bys s PHE 144 Cb -0.12 -1.46 0.09 0.00 -0.57 0.00 0.00 43.02 40.97 2bys s PHE 144 CO 0.10 -0.02 1.16 0.20 -0.10 0.00 0.00 175.22 176.56 2bys s GLY 145 N -0.67 -0.22 0.24 4.36 0.00 -0.68 -0.78 107.32 109.57 2bys s GLY 145 Ca 0.10 0.25 -0.30 0.00 0.00 0.00 0.00 44.72 44.77 2bys s GLY 145 CO -0.01 1.41 1.50 -0.45 0.00 0.00 0.00 173.10 175.55 2bys s SER 146 N -3.19 6.58 0.09 1.64 0.15 -1.26 -0.51 113.70 117.21 2bys s SER 146 Ca 0.18 2.72 -0.15 0.00 0.70 0.00 0.00 55.95 59.40 2bys s SER 146 Cb 0.01 -2.62 -0.09 0.00 -1.71 0.00 0.00 66.02 61.61 2bys s SER 146 CO -0.00 -0.77 1.41 -0.25 1.20 0.00 0.00 173.24 174.82 2bys h TRP 147 N 5.29 0.80 -0.01 3.44 2.91 -1.86 -3.38 115.95 123.15 2bys h TRP 147 Ca -0.46 -0.25 0.00 0.00 1.13 0.00 0.00 58.89 59.32 2bys h TRP 147 Cb 1.22 -0.17 0.00 0.00 -0.51 0.00 0.00 29.16 29.70 2bys h TRP 147 CO 0.61 0.98 -0.02 1.33 -1.03 0.00 0.00 178.44 180.31 2bys n VAL 148 N -4.29 0.00 -4.33 2.65 0.24 -1.26 -4.98 118.33 106.36 2bys n VAL 148 Ca -0.04 -0.49 -0.34 0.00 -2.04 0.00 0.00 64.34 61.43 2bys n VAL 148 Cb 0.47 1.12 -0.15 0.00 -1.47 0.00 0.00 33.84 33.81 2bys n VAL 148 CO 0.00 0.00 0.00 -0.31 -2.14 0.00 0.00 176.83 174.38 2bys s TYR 149 N -0.59 2.85 0.98 6.34 2.02 -1.26 -5.10 117.35 122.59 2bys s TYR 149 Ca 0.07 -0.99 -0.16 0.00 -0.37 0.00 0.00 57.07 55.62 2bys s TYR 149 Cb 0.05 -1.95 0.19 0.00 -0.40 0.00 0.00 41.96 39.85 2bys s TYR 149 CO 0.09 -0.48 1.24 -1.54 -1.57 0.00 0.00 175.55 173.28 2bys s SER 150 N 0.98 2.92 0.63 2.29 1.04 -1.26 -4.52 113.70 115.77 2bys s SER 150 Ca -0.02 0.51 0.38 0.00 0.48 0.00 0.00 55.95 57.30 2bys s SER 150 Cb -0.15 -0.72 2.09 0.00 0.10 0.00 0.00 66.02 67.34 2bys s SER 150 CO -0.02 -2.88 2.17 1.23 0.98 0.00 0.00 173.24 174.73 2bys h GLY 151 N -1.73 0.00 2.00 7.32 0.00 -0.89 0.78 103.07 110.55 2bys h GLY 151 Ca -0.46 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.87 2bys h GLY 151 CO 0.44 0.00 0.00 0.69 0.00 0.00 0.00 176.54 177.67 2bys n PHE 152 N -2.93 0.57 -0.00 5.60 3.01 -1.26 -4.37 117.46 118.07 2bys n PHE 152 Ca -0.03 0.18 -0.01 0.00 1.01 0.00 0.00 57.45 58.60 2bys n PHE 152 Cb 0.15 -0.79 -0.00 0.00 -0.01 0.00 0.00 39.48 38.83 2bys n PHE 152 CO 0.00 0.00 0.00 0.39 1.01 0.00 0.00 176.76 178.16 2bys n GLU 153 N -1.97 0.02 -4.24 -1.08 1.02 0.05 -4.22 120.64 110.21 2bys n GLU 153 Ca 0.05 0.01 -0.29 0.00 -0.02 0.00 0.00 57.16 56.91 2bys n GLU 153 Cb 0.36 -0.77 -0.17 0.00 -0.02 0.00 0.00 31.44 30.84 2bys n GLU 153 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 2bys s ILE 154 N -2.01 1.49 0.10 -3.67 1.01 0.02 -0.82 121.20 117.33 2bys s ILE 154 Ca -0.01 -0.61 0.02 0.00 0.00 0.00 0.00 60.65 60.05 2bys s ILE 154 Cb 0.00 -1.39 -0.04 0.00 0.01 0.00 0.00 42.46 41.05 2bys s ILE 154 CO 0.01 0.44 0.19 -0.62 0.00 0.00 0.00 174.94 174.97 2bys s ASP 155 N 1.24 6.07 0.05 3.58 2.15 -0.00 -3.78 116.67 125.97 2bys s ASP 155 Ca -0.01 0.13 0.07 0.00 0.43 0.00 0.00 52.55 53.17 2bys s ASP 155 Cb -0.14 -1.78 -0.03 0.00 -0.30 0.00 0.00 42.92 40.67 2bys s ASP 155 CO -0.06 0.13 -0.16 -0.76 -0.17 0.00 0.00 175.17 174.15 2bys s LEU 156 N -2.75 2.71 0.06 -1.34 1.43 -1.26 -1.17 118.68 116.35 2bys s LEU 156 Ca 0.33 -0.40 0.00 0.00 -1.03 0.00 0.00 54.13 53.03 2bys s LEU 156 Cb -0.12 -1.58 -0.04 0.00 0.03 0.00 0.00 46.19 44.49 2bys s LEU 156 CO 0.26 0.25 -0.05 -0.75 0.23 0.00 0.00 176.35 176.30 2bys s LYS 157 N -1.53 0.64 0.11 1.70 2.20 -0.76 -4.95 119.74 117.15 2bys s LYS 157 Ca 0.16 -1.16 0.06 0.00 -0.36 0.00 0.00 55.97 54.67 2bys s LYS 157 Cb -0.11 0.03 -0.04 0.00 -1.51 0.00 0.00 37.83 36.21 2bys s LYS 157 CO 0.06 -0.06 -0.14 0.95 -0.36 0.00 0.00 175.35 175.80 2bys s THR 158 N -3.36 1.30 -0.22 3.43 -4.23 -1.26 -1.33 115.64 109.97 2bys s THR 158 Ca 0.05 -1.61 0.19 0.00 -1.18 0.00 0.00 61.69 59.14 2bys s THR 158 Cb 0.04 -1.42 0.03 0.00 1.34 0.00 0.00 72.50 72.48 2bys s THR 158 CO -0.07 -0.35 1.15 0.44 -0.54 0.00 0.00 174.62 175.25 2bys h ASP 159 N 3.73 0.00 -5.09 3.99 3.32 -1.99 -3.48 116.42 116.91 2bys h ASP 159 Ca -0.40 0.00 -0.08 0.00 0.02 0.00 0.00 57.03 56.56 2bys h ASP 159 Cb 1.19 0.00 -0.15 0.00 0.22 0.00 0.00 39.33 40.59 2bys h ASP 159 CO 0.47 0.28 -0.24 0.28 -1.72 0.00 0.00 179.24 178.31 2bys s THR 160 N -3.12 0.10 -2.79 0.35 -1.32 -1.26 -5.03 115.64 102.56 2bys s THR 160 Ca 0.01 -0.80 0.25 0.00 -1.21 0.00 0.00 61.69 59.94 2bys s THR 160 Cb 0.08 -1.10 0.31 0.00 -1.51 0.00 0.00 72.50 70.28 2bys s THR 160 CO 0.77 -0.44 1.39 -0.90 -2.21 0.00 0.00 174.62 173.23 2bys n ASP 161 N 0.22 2.72 -4.63 8.08 5.75 -1.26 -4.80 116.55 122.63 2bys n ASP 161 Ca -0.17 -1.89 -0.38 0.00 -0.01 0.00 0.00 54.79 52.34 2bys n ASP 161 Cb 0.61 -0.04 -0.09 0.00 -1.03 0.00 0.00 41.12 40.57 2bys n ASP 161 CO 0.00 0.00 0.00 -1.10 -0.11 0.00 0.00 177.20 175.99 2bys s GLN 162 N -1.91 4.06 0.29 0.11 -1.52 -1.26 -0.32 119.66 119.11 2bys s GLN 162 Ca 0.32 -0.01 -0.29 0.00 -1.95 0.00 0.00 55.36 53.42 2bys s GLN 162 Cb 0.21 -3.61 -0.10 0.00 -0.22 0.00 0.00 33.01 29.29 2bys s GLN 162 CO 0.31 -0.15 1.36 0.08 -0.25 0.00 0.00 175.29 176.64 2bys s VAL 163 N 1.68 2.71 -0.29 1.09 1.01 -0.86 -4.84 120.40 120.90 2bys s VAL 163 Ca 0.14 0.66 -0.29 0.00 0.00 0.00 0.00 61.98 62.49 2bys s VAL 163 Cb -0.15 -3.42 -0.01 0.00 0.00 0.00 0.00 36.38 32.80 2bys s VAL 163 CO 0.09 0.13 1.40 -0.62 0.00 0.00 0.00 175.10 176.10 2bys s ASP 164 N -0.11 6.56 0.00 3.32 3.68 -0.34 -4.86 116.67 124.91 2bys s ASP 164 Ca 0.53 1.30 0.13 0.00 2.13 0.00 0.00 52.55 56.64 2bys s ASP 164 Cb -0.40 -2.54 0.31 0.00 -1.45 0.00 0.00 42.92 38.84 2bys s ASP 164 CO 0.49 -1.16 1.22 0.18 0.13 0.00 0.00 175.17 176.03 2bys n LEU 165 N 7.97 2.90 0.20 -1.34 4.77 -1.26 -2.22 117.00 128.01 2bys n LEU 165 Ca 0.16 -1.74 0.14 0.00 -0.03 0.00 0.00 56.01 54.54 2bys n LEU 165 Cb 0.46 -0.21 0.64 0.00 -2.33 0.00 0.00 43.42 41.98 2bys n LEU 165 CO 0.64 0.69 0.92 0.77 -1.33 0.00 0.00 177.39 179.08 2bys h SER 166 N 2.58 0.00 -0.41 -1.43 4.64 -1.89 -2.05 113.55 114.99 2bys h SER 166 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2bys h SER 166 Cb 0.73 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.82 2bys h SER 166 CO 0.00 0.00 0.00 -1.20 -0.87 0.00 0.00 176.83 174.76 2bys n SER 167 N -2.56 3.29 -4.73 4.97 7.64 -1.26 -5.03 113.62 115.94 2bys n SER 167 Ca 0.01 -2.14 -0.42 0.00 1.01 0.00 0.00 58.87 57.33 2bys n SER 167 Cb 0.20 -0.32 -0.03 0.00 -1.01 0.00 0.00 64.21 63.05 2bys n SER 167 CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 2bys s TYR 168 N -1.25 3.19 0.00 1.43 5.04 -0.77 -4.54 117.35 120.45 2bys s TYR 168 Ca 0.30 1.08 -0.31 0.00 -2.44 0.00 0.00 57.07 55.71 2bys s TYR 168 Cb 0.18 -3.69 -0.09 0.00 0.35 0.00 0.00 41.96 38.70 2bys s TYR 168 CO 0.18 -2.26 1.97 0.98 -1.34 0.00 0.00 175.55 175.08 2bys n TYR 169 N 2.96 2.45 0.35 4.97 9.36 0.17 -4.86 117.16 132.57 2bys n TYR 169 Ca 0.08 -0.30 0.14 0.00 3.32 0.00 0.00 57.90 61.14 2bys n TYR 169 Cb 0.42 -2.78 0.57 0.00 -0.63 0.00 0.00 39.34 36.92 2bys n TYR 169 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2bys h ALA 170 N 10.57 1.00 -0.33 2.98 0.00 -1.90 -2.83 119.26 128.75 2bys h ALA 170 Ca -0.49 0.00 -0.24 0.00 0.00 0.00 0.00 54.91 54.18 2bys h ALA 170 Cb 1.25 0.00 -0.18 0.00 0.00 0.00 0.00 17.79 18.85 2bys h ALA 170 CO 0.94 0.00 -0.61 0.43 0.00 0.00 0.00 179.25 180.01 2bys n SER 171 N -2.65 3.10 -4.74 0.00 7.64 -1.26 -5.05 113.62 110.66 2bys n SER 171 Ca 0.02 -3.84 -0.32 0.00 1.01 0.00 0.00 58.87 55.74 2bys n SER 171 Cb 0.28 -0.46 0.10 0.00 -1.01 0.00 0.00 64.21 63.12 2bys n SER 171 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2bys s SER 172 N -3.36 4.19 0.48 6.43 0.15 -1.07 -4.92 113.70 115.60 2bys s SER 172 Ca 0.44 2.06 0.24 0.00 0.70 0.00 0.00 55.95 59.38 2bys s SER 172 Cb 0.39 -2.55 1.21 0.00 -1.71 0.00 0.00 66.02 63.36 2bys s SER 172 CO -0.02 -2.25 1.98 0.11 1.20 0.00 0.00 173.24 174.25 2bys h LYS 173 N -0.89 0.00 -5.20 5.44 1.79 -1.91 -3.43 116.57 112.37 2bys h LYS 173 Ca -0.45 0.00 -0.67 0.00 -2.18 0.00 0.00 60.65 57.35 2bys h LYS 173 Cb 1.26 0.00 -0.34 0.00 -1.58 0.00 0.00 32.23 31.57 2bys h LYS 173 CO 0.49 0.18 -0.87 0.71 -1.08 0.00 0.00 179.45 178.89 2bys s TYR 174 N -4.09 2.67 0.01 -1.35 1.51 -1.26 0.68 117.35 115.50 2bys s TYR 174 Ca -0.02 -1.35 -0.17 0.00 -1.01 0.00 0.00 57.07 54.53 2bys s TYR 174 Cb 0.13 -1.81 -0.06 0.00 -0.11 0.00 0.00 41.96 40.11 2bys s TYR 174 CO 0.62 -0.61 0.47 -2.00 -1.11 0.00 0.00 175.55 172.92 2bys s GLU 175 N 0.81 4.07 -0.28 -0.62 2.12 0.89 -4.77 118.70 120.92 2bys s GLU 175 Ca -0.07 0.52 -0.19 0.00 0.36 0.00 0.00 54.97 55.58 2bys s GLU 175 Cb -0.16 -3.26 -0.02 0.00 0.26 0.00 0.00 34.13 30.96 2bys s GLU 175 CO -0.02 0.60 0.58 0.42 -0.54 0.00 0.00 175.26 176.30 2bys s ILE 176 N -0.84 5.01 -0.02 -3.70 -1.09 -1.26 -1.70 121.20 117.60 2bys s ILE 176 Ca 0.26 0.91 -0.17 0.00 -2.23 0.00 0.00 60.65 59.42 2bys s ILE 176 Cb -0.17 -3.91 -0.33 0.00 -1.58 0.00 0.00 42.46 36.47 2bys s ILE 176 CO 0.15 -0.01 0.86 -0.07 -1.23 0.00 0.00 174.94 174.64 2bys h LEU 177 N 8.95 0.65 -7.00 2.97 3.38 -1.41 -3.49 115.31 119.36 2bys h LEU 177 Ca -0.28 -0.93 0.04 0.00 0.09 0.00 0.00 57.88 56.80 2bys h LEU 177 Cb 1.13 -0.21 -0.16 0.00 0.09 0.00 0.00 40.66 41.50 2bys h LEU 177 CO 0.76 1.62 0.36 -0.94 0.09 0.00 0.00 178.44 180.34 2bys s SER 178 N -7.30 -0.48 -0.19 -0.43 1.04 -1.05 -4.99 113.70 100.30 2bys s SER 178 Ca -0.13 0.20 -0.05 0.00 0.48 0.00 0.00 55.95 56.45 2bys s SER 178 Cb 0.03 0.46 0.09 0.00 0.10 0.00 0.00 66.02 66.71 2bys s SER 178 CO 0.88 -0.68 0.35 0.00 0.98 0.00 0.00 173.24 174.77 2bys s ALA 179 N -2.62 -0.91 0.21 5.32 0.00 -1.26 -0.60 121.76 121.90 2bys s ALA 179 Ca -0.00 1.11 0.09 0.00 0.00 0.00 0.00 51.96 53.15 2bys s ALA 179 Cb -0.01 -1.33 -0.05 0.00 0.00 0.00 0.00 23.12 21.73 2bys s ALA 179 CO -0.05 -0.89 -0.17 0.95 0.00 0.00 0.00 175.76 175.60 2bys s THR 180 N 2.52 1.93 -0.14 0.00 -4.23 -0.76 -2.03 115.64 112.93 2bys s THR 180 Ca 0.03 -2.18 -0.02 0.00 -1.18 0.00 0.00 61.69 58.35 2bys s THR 180 Cb -0.13 -2.05 0.04 0.00 1.34 0.00 0.00 72.50 71.70 2bys s THR 180 CO -0.12 -0.48 -0.00 0.00 -0.54 0.00 0.00 174.62 173.48 2bys s GLN 181 N -3.39 0.85 -0.06 3.99 -2.07 0.57 -1.51 119.66 118.04 2bys s GLN 181 Ca 0.22 -0.22 0.01 0.00 -1.82 0.00 0.00 55.36 53.55 2bys s GLN 181 Cb -0.03 -1.62 0.02 0.00 -1.09 0.00 0.00 33.01 30.29 2bys s GLN 181 CO 0.09 -0.44 -0.08 0.99 -1.32 0.00 0.00 175.29 174.52 2bys s THR 182 N 1.85 0.85 0.17 3.63 2.01 -0.26 -4.21 115.64 119.67 2bys s THR 182 Ca 0.02 -0.29 -0.30 0.00 0.31 0.00 0.00 61.69 61.43 2bys s THR 182 Cb -0.15 -0.82 -0.08 0.00 0.01 0.00 0.00 72.50 71.47 2bys s THR 182 CO -0.07 0.30 1.26 -0.60 -0.69 0.00 0.00 174.62 174.82 2bys s ARG 183 N 0.90 4.43 0.09 4.92 3.52 -1.26 0.08 118.95 131.63 2bys s ARG 183 Ca -0.11 1.95 0.02 0.00 -0.13 0.00 0.00 55.73 57.46 2bys s ARG 183 Cb -0.15 -3.24 -0.04 0.00 -1.56 0.00 0.00 34.95 29.96 2bys s ARG 183 CO 0.01 -0.21 -0.06 -0.65 -0.81 0.00 0.00 175.30 173.57 2bys s GLN 184 N 0.12 0.81 -0.13 5.12 -0.21 0.63 -4.94 119.66 121.06 2bys s GLN 184 Ca 0.56 -1.30 -0.00 0.00 0.02 0.00 0.00 55.36 54.64 2bys s GLN 184 Cb -0.34 -0.19 0.03 0.00 1.00 0.00 0.00 33.01 33.51 2bys s GLN 184 CO 0.36 -0.02 -0.08 0.08 -2.12 0.00 0.00 175.29 173.51 2bys s VAL 185 N -3.53 1.08 0.05 1.09 1.01 -1.26 -1.22 120.40 117.61 2bys s VAL 185 Ca 0.10 -0.38 -0.02 0.00 0.00 0.00 0.00 61.98 61.69 2bys s VAL 185 Cb 0.05 -1.12 -0.03 0.00 0.00 0.00 0.00 36.38 35.27 2bys s VAL 185 CO -0.05 0.33 -0.01 -1.10 0.00 0.00 0.00 175.10 174.27 2bys s GLN 186 N 1.68 0.60 0.19 2.72 -0.21 -0.94 -4.98 119.66 118.72 2bys s GLN 186 Ca 0.04 -1.12 -0.05 0.00 0.02 0.00 0.00 55.36 54.25 2bys s GLN 186 Cb -0.13 0.21 -0.06 0.00 1.00 0.00 0.00 33.01 34.04 2bys s GLN 186 CO -0.08 -0.12 0.44 -1.01 -2.12 0.00 0.00 175.29 172.40 2bys s HIS 187 N -3.63 3.47 0.02 0.91 3.76 -1.26 -1.25 115.29 117.31 2bys s HIS 187 Ca 0.04 0.59 0.04 0.00 -0.15 0.00 0.00 55.06 55.58 2bys s HIS 187 Cb 0.06 -2.04 -0.02 0.00 1.11 0.00 0.00 32.58 31.69 2bys s HIS 187 CO -0.09 0.35 -0.13 0.71 -0.85 0.00 0.00 174.74 174.73 2bys s TYR 188 N -1.80 1.15 0.32 1.40 1.51 -1.26 -4.98 117.35 113.69 2bys s TYR 188 Ca 0.42 -0.29 0.09 0.00 -1.01 0.00 0.00 57.07 56.28 2bys s TYR 188 Cb -0.12 -0.71 0.91 0.00 -0.11 0.00 0.00 41.96 41.94 2bys s TYR 188 CO 0.26 0.01 1.69 0.77 -1.11 0.00 0.00 175.55 177.17 2bys h SER 189 N 5.31 0.49 -0.58 2.29 0.02 -2.00 -2.23 113.55 116.85 2bys h SER 189 Ca -0.36 0.16 0.07 0.00 -0.84 0.00 0.00 61.79 60.82 2bys h SER 189 Cb 1.18 0.11 -0.03 0.00 0.14 0.00 0.00 62.40 63.79 2bys h SER 189 CO 0.46 -0.02 0.39 0.00 -1.14 0.00 0.00 176.83 176.51 2bys h PRO 192 N 5.70 0.42 -5.95 0.00 0.11 -1.89 -3.40 132.00 126.98 2bys h PRO 192 Ca -0.27 -0.21 -0.60 0.00 0.11 0.00 0.00 66.00 65.03 2bys h PRO 192 Cb 1.21 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 32.26 2bys h PRO 192 CO 0.48 0.77 -0.17 -1.83 -0.21 0.00 0.00 178.00 177.04 2bys s GLU 193 N -4.17 4.07 0.62 1.05 1.03 -1.26 -4.98 118.70 115.05 2bys s GLU 193 Ca -0.06 0.45 -0.16 0.00 0.03 0.00 0.00 54.97 55.23 2bys s GLU 193 Cb 0.13 -3.28 -0.02 0.00 -0.80 0.00 0.00 34.13 30.15 2bys s GLU 193 CO 0.80 0.54 1.09 -1.25 -1.33 0.00 0.00 175.26 175.11 2bys s PRO 194 N -0.62 3.10 0.08 -4.83 0.04 -1.26 -4.75 135.00 126.75 2bys s PRO 194 Ca 0.25 1.34 0.05 0.00 0.04 0.00 0.00 61.00 62.68 2bys s PRO 194 Cb -0.17 -1.99 -0.04 0.00 0.04 0.00 0.00 34.50 32.34 2bys s PRO 194 CO 0.13 -1.01 -0.04 0.71 0.04 0.00 0.00 177.00 176.83 2bys s TYR 195 N -2.31 2.90 -0.01 0.56 2.02 -0.38 -0.51 117.35 119.62 2bys s TYR 195 Ca 0.66 -0.07 -0.13 0.00 -0.37 0.00 0.00 57.07 57.17 2bys s TYR 195 Cb -0.19 -1.51 -0.05 0.00 -0.40 0.00 0.00 41.96 39.80 2bys s TYR 195 CO 0.37 0.45 0.36 0.42 -1.57 0.00 0.00 175.55 175.58 2bys s ILE 196 N -1.25 5.12 0.10 2.71 -1.09 -1.26 -2.22 121.20 123.31 2bys s ILE 196 Ca 0.23 0.68 0.02 0.00 -2.23 0.00 0.00 60.65 59.35 2bys s ILE 196 Cb -0.11 -3.65 -0.04 0.00 -1.58 0.00 0.00 42.46 37.08 2bys s ILE 196 CO 0.16 0.55 -0.07 1.51 -1.23 0.00 0.00 174.94 175.86 2bys s ASP 197 N -1.15 1.16 -0.25 3.58 -4.77 -0.36 -4.36 116.67 110.52 2bys s ASP 197 Ca 0.23 -0.96 -0.04 0.00 -3.30 0.00 0.00 52.55 48.49 2bys s ASP 197 Cb -0.16 0.08 0.01 0.00 -1.09 0.00 0.00 42.92 41.76 2bys s ASP 197 CO 0.12 -0.43 -0.02 -0.69 0.70 0.00 0.00 175.17 174.85 2bys s VAL 198 N -3.36 3.33 -0.30 2.11 1.01 0.04 -0.27 120.40 122.96 2bys s VAL 198 Ca 0.10 -0.71 -0.16 0.00 0.00 0.00 0.00 61.98 61.20 2bys s VAL 198 Cb 0.03 -2.61 -0.02 0.00 0.00 0.00 0.00 36.38 33.78 2bys s VAL 198 CO -0.04 0.28 0.44 0.21 0.00 0.00 0.00 175.10 175.99 2bys s ASN 199 N 1.43 6.30 -0.41 3.32 2.47 0.11 -1.14 114.94 127.02 2bys s ASN 199 Ca 0.03 0.20 -0.18 0.00 0.42 0.00 0.00 52.86 53.33 2bys s ASN 199 Cb -0.16 -2.24 0.02 0.00 -1.45 0.00 0.00 41.25 37.42 2bys s ASN 199 CO -0.03 -0.30 0.47 -0.22 -3.72 0.00 0.00 177.10 173.30 2bys s LEU 200 N 2.20 4.73 -0.28 3.21 2.96 -0.31 -1.11 118.68 130.09 2bys s LEU 200 Ca 0.17 -0.54 -0.05 0.00 -0.22 0.00 0.00 54.13 53.50 2bys s LEU 200 Cb -0.16 -2.45 0.02 0.00 0.50 0.00 0.00 46.19 44.10 2bys s LEU 200 CO 0.11 -0.58 0.03 -0.69 -1.32 0.00 0.00 176.35 173.90 2bys s VAL 201 N 2.25 3.54 -0.17 1.68 1.01 -0.57 -1.42 120.40 126.72 2bys s VAL 201 Ca 0.14 -0.85 -0.03 0.00 0.00 0.00 0.00 61.98 61.24 2bys s VAL 201 Cb -0.16 -2.83 -0.02 0.00 0.00 0.00 0.00 36.38 33.36 2bys s VAL 201 CO 0.14 0.10 -0.05 -0.69 0.00 0.00 0.00 175.10 174.61 2bys s VAL 202 N 1.43 3.66 -0.14 2.92 1.01 0.60 -1.84 120.40 128.05 2bys s VAL 202 Ca 0.01 -0.43 -0.04 0.00 0.00 0.00 0.00 61.98 61.52 2bys s VAL 202 Cb -0.17 -2.62 -0.03 0.00 0.00 0.00 0.00 36.38 33.56 2bys s VAL 202 CO -0.00 0.47 0.02 -0.54 0.00 0.00 0.00 175.10 175.05 2bys s LYS 203 N 0.69 3.51 0.09 2.72 1.02 0.23 -1.05 119.74 126.95 2bys s LYS 203 Ca -0.03 -0.40 -0.25 0.00 0.02 0.00 0.00 55.97 55.32 2bys s LYS 203 Cb -0.15 -2.99 0.07 0.00 -0.52 0.00 0.00 37.83 34.25 2bys s LYS 203 CO 0.02 0.46 0.60 -0.59 -0.92 0.00 0.00 175.35 174.92 2bys s PHE 204 N -0.18 -0.54 0.20 3.18 -0.12 -0.25 -0.96 117.98 119.30 2bys s PHE 204 Ca 0.06 0.53 -0.07 0.00 -0.05 0.00 0.00 56.93 57.40 2bys s PHE 204 Cb -0.12 0.48 -0.02 0.00 -0.63 0.00 0.00 43.02 42.73 2bys s PHE 204 CO 0.02 -0.76 0.28 -0.98 -0.05 0.00 0.00 175.22 173.73 2bys s ARG 205 N -2.95 1.30 0.09 1.99 1.70 -0.69 0.11 118.95 120.50 2bys s ARG 205 Ca -0.03 -1.39 -0.31 0.00 -0.47 0.00 0.00 55.73 53.53 2bys s ARG 205 Cb -0.01 0.36 -0.09 0.00 -0.57 0.00 0.00 34.95 34.65 2bys s ARG 205 CO -0.06 -0.48 1.65 -1.21 -1.08 0.00 0.00 175.30 174.12 2bys s GLU 206 N -4.06 4.20 -0.39 3.89 2.02 -0.37 -0.07 118.70 123.91 2bys s GLU 206 Ca 0.28 2.35 -0.33 0.00 0.02 0.00 0.00 54.97 57.29 2bys s GLU 206 Cb 0.04 -3.53 -0.11 0.00 0.10 0.00 0.00 34.13 30.63 2bys s GLU 206 CO 0.08 -0.72 2.26 -2.13 0.02 0.00 0.00 175.26 174.77 2bys n ARG 207 N 5.34 1.12 0.00 1.61 3.00 0.21 -4.70 116.66 123.24 2bys n ARG 207 Ca 0.16 0.27 0.09 0.00 -0.00 0.00 0.00 57.85 58.37 2bys n ARG 207 Cb 0.40 -2.63 0.55 0.00 0.00 0.00 0.00 32.46 30.79 2bys n ARG 207 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17