#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bys h SER 2 N 0.00 0.56 -0.57 0.26 0.02 -1.99 -2.29 113.55 109.54 2bys h SER 2 Ca 0.00 -0.61 0.04 0.00 -0.84 0.00 0.00 61.79 60.38 2bys h SER 2 Cb 0.00 -0.16 -0.04 0.00 0.14 0.00 0.00 62.40 62.33 2bys h SER 2 CO 0.00 1.08 0.32 1.56 -1.14 0.00 0.00 176.83 178.65 2bys h GLN 3 N 0.07 0.60 -0.29 3.45 4.20 -2.01 -1.16 115.11 119.98 2bys h GLN 3 Ca -0.02 -0.04 -0.03 0.00 0.06 0.00 0.00 58.65 58.63 2bys h GLN 3 Cb 1.04 -0.14 -0.02 0.00 0.30 0.00 0.00 27.48 28.66 2bys h GLN 3 CO 0.09 0.40 0.06 0.00 -0.67 0.00 0.00 178.83 178.70 2bys h ALA 4 N 1.28 1.56 -0.34 3.87 0.00 -2.00 -2.49 119.26 121.15 2bys h ALA 4 Ca 0.25 -0.13 -0.09 0.00 0.00 0.00 0.00 54.91 54.93 2bys h ALA 4 Cb 0.10 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 2bys h ALA 4 CO -0.14 0.33 -0.14 -0.91 0.00 0.00 0.00 179.25 178.39 2bys h ASN 5 N 0.41 0.71 -0.15 0.00 2.35 -0.74 -2.72 115.58 115.45 2bys h ASN 5 Ca 0.10 -0.39 -0.01 0.00 -0.55 0.00 0.00 56.30 55.44 2bys h ASN 5 Cb 0.19 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.35 2bys h ASN 5 CO -0.00 0.95 0.05 0.25 -1.65 0.00 0.00 177.43 177.02 2bys h LEU 6 N 0.48 0.21 -0.93 1.61 5.85 -1.01 -2.47 115.31 119.04 2bys h LEU 6 Ca 0.08 -0.20 -0.05 0.00 0.84 0.00 0.00 57.88 58.55 2bys h LEU 6 Cb 0.67 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.63 2bys h LEU 6 CO 0.04 0.35 -0.23 0.24 -0.34 0.00 0.00 178.44 178.51 2bys h MET 7 N 0.06 0.00 -0.42 1.25 2.86 -1.53 0.28 114.93 117.44 2bys h MET 7 Ca 0.05 0.00 -0.14 0.00 -2.06 0.00 0.00 59.70 57.55 2bys h MET 7 Cb 0.21 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.86 2bys h MET 7 CO -0.00 0.23 -0.28 -0.09 1.06 0.00 0.00 176.91 177.83 2bys h ARG 8 N 0.00 0.92 0.72 1.72 2.43 -1.41 0.14 114.38 118.91 2bys h ARG 8 Ca -0.00 -0.44 -0.04 0.00 -0.81 0.00 0.00 59.98 58.70 2bys h ARG 8 Cb 0.82 -0.01 0.01 0.00 -0.42 0.00 0.00 29.97 30.37 2bys h ARG 8 CO 0.03 1.09 -0.34 1.25 -1.51 0.00 0.00 179.97 180.49 2bys h LEU 9 N 0.75 -0.82 -0.72 3.80 5.85 -0.94 -0.59 115.31 122.64 2bys h LEU 9 Ca 0.08 0.00 0.13 0.00 0.84 0.00 0.00 57.88 58.94 2bys h LEU 9 Cb 0.86 0.21 -0.09 0.00 0.37 0.00 0.00 40.66 42.01 2bys h LEU 9 CO 0.08 -0.50 0.28 0.11 -0.34 0.00 0.00 178.44 178.06 2bys h LYS 10 N -1.10 0.41 0.08 1.25 1.57 -1.00 0.85 116.57 118.64 2bys h LYS 10 Ca -0.10 -0.02 0.02 0.00 -1.87 0.00 0.00 60.65 58.68 2bys h LYS 10 Cb 0.76 -0.09 -0.04 0.00 0.08 0.00 0.00 32.23 32.94 2bys h LYS 10 CO 0.16 0.27 -0.30 1.03 -0.57 0.00 0.00 179.45 180.05 2bys h SER 11 N 0.43 -0.87 -0.08 0.86 0.87 -0.68 -0.21 113.55 113.87 2bys h SER 11 Ca 0.39 0.11 0.01 0.00 -1.23 0.00 0.00 61.79 61.07 2bys h SER 11 Cb 0.58 0.34 -0.01 0.00 -0.44 0.00 0.00 62.40 62.87 2bys h SER 11 CO -0.39 -0.38 0.02 0.44 -0.53 0.00 0.00 176.83 175.99 2bys h ASP 12 N -0.50 0.01 0.51 6.23 3.45 0.13 -3.26 116.42 122.99 2bys h ASP 12 Ca 0.04 0.01 -0.02 0.00 0.43 0.00 0.00 57.03 57.49 2bys h ASP 12 Cb 0.54 0.01 0.00 0.00 -0.56 0.00 0.00 39.33 39.33 2bys h ASP 12 CO -0.20 0.02 -0.24 -0.07 -1.57 0.00 0.00 179.24 177.17 2bys h LEU 13 N 0.05 -0.58 -8.62 1.55 3.38 -0.85 -3.51 115.31 106.72 2bys h LEU 13 Ca 0.03 0.02 -0.55 0.00 0.09 0.00 0.00 57.88 57.47 2bys h LEU 13 Cb 0.02 0.15 -0.06 0.00 0.09 0.00 0.00 40.66 40.86 2bys h LEU 13 CO -0.04 -0.28 1.07 -0.36 0.09 0.00 0.00 178.44 178.91 2bys s PHE 14 N -3.94 2.39 0.00 1.13 0.08 -0.10 -5.08 117.98 112.46 2bys s PHE 14 Ca -0.10 0.50 0.00 0.00 0.12 0.00 0.00 56.93 57.45 2bys s PHE 14 Cb 0.01 -4.41 0.00 0.00 -0.57 0.00 0.00 43.02 38.05 2bys s PHE 14 CO 0.30 -1.87 0.00 0.98 -0.10 0.00 0.00 175.22 174.53 2bys n TYR 20 N 9.17 0.00 0.71 0.36 9.36 -1.26 -5.04 117.16 130.47 2bys n TYR 20 Ca 0.12 0.00 -0.01 0.00 3.32 0.00 0.00 57.90 61.33 2bys n TYR 20 Cb 0.49 0.00 0.04 0.00 -0.63 0.00 0.00 39.34 39.24 2bys n TYR 20 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 2bys n PRO 21 N 1.87 1.36 0.00 2.98 -0.04 -1.26 -4.90 135.00 135.01 2bys n PRO 21 Ca 0.00 -0.43 0.00 0.00 -0.04 0.00 0.00 63.50 63.03 2bys n PRO 21 Cb 0.00 -1.39 0.00 0.00 -0.04 0.00 0.00 33.50 32.07 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 0.18 -0.82 3.81 0.55 0.00 -1.26 -5.00 105.19 102.65 2bys n GLY 22 Ca 0.06 -1.68 -0.31 0.00 0.00 0.00 0.00 46.02 44.09 2bys n GLY 22 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2bys s PRO 23 N -1.78 2.93 0.24 1.61 0.04 -1.26 -5.07 135.00 131.70 2bys s PRO 23 Ca 0.00 1.04 0.01 0.00 0.04 0.00 0.00 61.00 62.08 2bys s PRO 23 Cb 0.00 -1.99 -0.04 0.00 0.04 0.00 0.00 34.50 32.51 2bys s PRO 23 CO 0.00 -1.11 0.13 0.95 0.04 0.00 0.00 177.00 177.01 2bys s THR 24 N -2.90 0.22 0.24 1.26 -4.23 -0.36 -4.98 115.64 104.88 2bys s THR 24 Ca 0.60 -2.00 -0.05 0.00 -1.18 0.00 0.00 61.69 59.06 2bys s THR 24 Cb -0.15 -2.55 0.21 0.00 1.34 0.00 0.00 72.50 71.35 2bys s THR 24 CO 0.51 0.00 1.73 0.50 -0.54 0.00 0.00 174.62 176.82 2bys h LYS 25 N 2.48 0.41 -0.00 3.99 3.64 -1.91 -1.42 116.57 123.75 2bys h LYS 25 Ca -0.36 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.00 2bys h LYS 25 Cb 1.25 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.98 2bys h LYS 25 CO 0.55 0.27 -0.23 -0.25 -2.27 0.00 0.00 179.45 177.52 2bys n ASP 26 N -5.02 0.39 -3.27 4.20 8.00 -1.26 -4.26 116.55 115.32 2bys n ASP 26 Ca 0.13 -0.18 -0.25 0.00 0.71 0.00 0.00 54.79 55.20 2bys n ASP 26 Cb 0.40 -0.06 -0.08 0.00 -0.02 0.00 0.00 41.12 41.35 2bys n ASP 26 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 2bys n ASP 27 N -1.28 -0.14 -4.87 -2.24 2.03 -0.64 -5.14 116.55 104.26 2bys n ASP 27 Ca 0.09 -2.55 -0.30 0.00 0.52 0.00 0.00 54.79 52.55 2bys n ASP 27 Cb 0.32 -0.59 0.07 0.00 -0.72 0.00 0.00 41.12 40.20 2bys n ASP 27 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 2bys s PRO 28 N -0.63 2.45 0.03 -0.67 0.05 -0.63 -1.23 135.00 134.37 2bys s PRO 28 Ca 0.34 0.39 0.01 0.00 0.05 0.00 0.00 61.00 61.79 2bys s PRO 28 Cb 0.11 -1.98 -0.02 0.00 0.05 0.00 0.00 34.50 32.66 2bys s PRO 28 CO -0.15 -1.31 -0.05 -1.17 0.05 0.00 0.00 177.00 174.37 2bys s LEU 29 N -5.50 2.20 -0.13 -3.56 2.96 -0.04 -4.90 118.68 109.71 2bys s LEU 29 Ca 0.60 -0.43 0.03 0.00 -0.22 0.00 0.00 54.13 54.11 2bys s LEU 29 Cb -0.12 -0.09 0.00 0.00 0.50 0.00 0.00 46.19 46.49 2bys s LEU 29 CO 0.51 -0.18 -0.22 -0.89 -1.32 0.00 0.00 176.35 174.26 2bys s THR 30 N -1.11 2.16 -0.18 3.68 2.01 -1.26 -0.36 115.64 120.58 2bys s THR 30 Ca -0.09 -0.96 -0.03 0.00 0.31 0.00 0.00 61.69 60.91 2bys s THR 30 Cb -0.08 -1.85 -0.02 0.00 0.01 0.00 0.00 72.50 70.56 2bys s THR 30 CO -0.00 0.55 -0.05 -0.69 -0.69 0.00 0.00 174.62 173.74 2bys s VAL 31 N 0.63 3.60 -0.09 3.82 1.01 0.25 -4.52 120.40 125.09 2bys s VAL 31 Ca -0.11 -0.44 -0.19 0.00 0.00 0.00 0.00 61.98 61.24 2bys s VAL 31 Cb -0.16 -2.60 -0.04 0.00 0.00 0.00 0.00 36.38 33.58 2bys s VAL 31 CO 0.02 0.46 0.52 -0.89 0.00 0.00 0.00 175.10 175.21 2bys s THR 32 N 0.85 5.13 0.08 3.92 2.01 0.30 -1.49 115.64 126.44 2bys s THR 32 Ca -0.01 1.05 0.09 0.00 0.31 0.00 0.00 61.69 63.13 2bys s THR 32 Cb -0.15 -3.85 -0.03 0.00 0.01 0.00 0.00 72.50 68.48 2bys s THR 32 CO 0.01 0.34 -0.24 -0.76 -0.69 0.00 0.00 174.62 173.28 2bys s LEU 33 N 0.49 2.25 -0.27 4.42 1.43 0.47 -1.36 118.68 126.10 2bys s LEU 33 Ca 0.28 -0.65 -0.23 0.00 -1.03 0.00 0.00 54.13 52.50 2bys s LEU 33 Cb -0.16 -1.11 0.07 0.00 0.03 0.00 0.00 46.19 45.03 2bys s LEU 33 CO 0.12 0.17 0.73 -0.83 0.23 0.00 0.00 176.35 176.77 2bys s GLY 34 N -1.64 -0.54 -0.04 -3.19 0.00 -0.88 -4.31 107.32 96.72 2bys s GLY 34 Ca 0.10 2.14 0.01 0.00 0.00 0.00 0.00 44.72 46.98 2bys s GLY 34 CO 0.04 1.89 -0.05 -1.36 0.00 0.00 0.00 173.10 173.61 2bys s PHE 35 N 0.63 2.96 -0.34 1.90 0.08 -1.26 -0.59 117.98 121.35 2bys s PHE 35 Ca -0.02 0.03 0.02 0.00 0.12 0.00 0.00 56.93 57.07 2bys s PHE 35 Cb -0.05 -1.68 0.09 0.00 -0.57 0.00 0.00 43.02 40.81 2bys s PHE 35 CO -0.03 0.37 0.05 0.99 -0.10 0.00 0.00 175.22 176.50 2bys s THR 36 N -0.90 2.58 -0.35 0.64 2.01 -0.21 -1.38 115.64 118.03 2bys s THR 36 Ca 0.15 -2.04 -0.29 0.00 0.31 0.00 0.00 61.69 59.82 2bys s THR 36 Cb -0.11 -2.75 0.02 0.00 0.01 0.00 0.00 72.50 69.67 2bys s THR 36 CO 0.04 -0.46 1.06 -0.22 -0.69 0.00 0.00 174.62 174.36 2bys s LEU 37 N 1.03 3.89 -0.07 4.42 2.96 -0.83 -1.49 118.68 128.59 2bys s LEU 37 Ca 0.05 0.90 0.07 0.00 -0.22 0.00 0.00 54.13 54.93 2bys s LEU 37 Cb -0.20 -3.51 -0.24 0.00 0.50 0.00 0.00 46.19 42.74 2bys s LEU 37 CO -0.06 -0.93 0.56 0.00 -1.32 0.00 0.00 176.35 174.60 2bys n GLN 38 N 7.00 0.67 -3.60 1.98 6.02 0.09 -3.57 117.38 125.98 2bys n GLN 38 Ca 0.11 0.28 -0.11 0.00 -0.01 0.00 0.00 57.00 57.28 2bys n GLN 38 Cb 0.47 -1.76 -0.06 0.00 1.02 0.00 0.00 30.24 29.91 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 -6.37 -0.45 -0.40 1.08 2.15 -0.69 -0.04 116.67 111.95 2bys s ASP 39 Ca -0.10 0.69 -0.14 0.00 0.43 0.00 0.00 52.55 53.43 2bys s ASP 39 Cb 0.08 0.64 0.02 0.00 -0.30 0.00 0.00 42.92 43.35 2bys s ASP 39 CO 0.81 -0.28 0.28 -0.63 -0.17 0.00 0.00 175.17 175.18 2bys s ILE 40 N -0.46 5.10 -0.07 4.11 1.01 -1.26 -0.83 121.20 128.79 2bys s ILE 40 Ca -0.00 -0.71 -0.18 0.00 0.00 0.00 0.00 60.65 59.76 2bys s ILE 40 Cb -0.03 -3.84 -0.30 0.00 0.01 0.00 0.00 42.46 38.31 2bys s ILE 40 CO -0.01 -0.29 0.73 0.58 0.00 0.00 0.00 174.94 175.95 2bys h VAL 41 N 5.69 1.24 -2.95 2.92 2.07 -1.61 -3.41 116.25 120.21 2bys h VAL 41 Ca -0.27 -2.48 -0.14 0.00 0.82 0.00 0.00 66.70 64.63 2bys h VAL 41 Cb 1.12 2.94 -0.24 0.00 -1.52 0.00 0.00 31.29 33.59 2bys h VAL 41 CO 0.71 0.72 -0.32 -0.75 0.02 0.00 0.00 177.57 177.96 2bys s LYS 42 N -2.47 0.44 -0.11 1.57 2.20 -1.23 -4.88 119.74 115.25 2bys s LYS 42 Ca -0.16 0.36 -0.00 0.00 -0.36 0.00 0.00 55.97 55.80 2bys s LYS 42 Cb 0.03 0.21 0.02 0.00 -1.51 0.00 0.00 37.83 36.58 2bys s LYS 42 CO 0.81 -0.07 -0.09 0.00 -0.36 0.00 0.00 175.35 175.64 2bys s ALA 43 N -0.07 1.35 -0.34 3.13 0.00 -1.26 -1.21 121.76 123.35 2bys s ALA 43 Ca -0.02 -0.55 -0.04 0.00 0.00 0.00 0.00 51.96 51.35 2bys s ALA 43 Cb -0.03 -0.87 0.06 0.00 0.00 0.00 0.00 23.12 22.28 2bys s ALA 43 CO 0.01 -0.35 0.09 0.34 0.00 0.00 0.00 175.76 175.86 2bys s ASP 44 N 1.56 5.14 0.00 0.00 -1.08 0.47 -4.97 116.67 117.79 2bys s ASP 44 Ca 0.02 -1.44 0.28 0.00 -0.52 0.00 0.00 52.55 50.89 2bys s ASP 44 Cb -0.13 -1.80 1.04 0.00 -1.46 0.00 0.00 42.92 40.57 2bys s ASP 44 CO -0.07 -0.37 1.74 -1.54 0.52 0.00 0.00 175.17 175.45 2bys n SER 45 N 4.68 1.12 0.12 -0.34 3.41 -1.26 -0.41 113.62 120.94 2bys n SER 45 Ca -0.10 -1.16 0.07 0.00 -0.26 0.00 0.00 58.87 57.43 2bys n SER 45 Cb 0.43 0.03 0.03 0.00 -0.26 0.00 0.00 64.21 64.44 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 1.60 0.00 0.00 4.04 4.64 -1.96 -3.38 113.55 118.50 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 0.45 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.54 2bys h SER 46 CO 0.00 0.22 0.00 0.35 -0.87 0.00 0.00 176.83 176.53 2bys n THR 47 N -2.93 0.00 -3.73 2.95 -2.24 -1.21 -5.04 114.28 102.08 2bys n THR 47 Ca -0.01 -0.40 -0.27 0.00 -2.27 0.00 0.00 64.05 61.11 2bys n THR 47 Cb 0.64 1.11 0.03 0.00 -2.10 0.00 0.00 70.33 70.01 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 -0.39 -3.27 -4.25 3.42 3.02 0.45 -4.92 115.26 109.31 2bys n ASN 48 Ca 0.00 -0.96 -0.29 0.00 -0.03 0.00 0.00 54.58 53.30 2bys n ASN 48 Cb 0.03 -3.54 -0.16 0.00 -0.61 0.00 0.00 39.78 35.50 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 -6.03 2.03 -0.01 3.52 2.02 -0.97 -1.12 118.70 118.14 2bys s GLU 49 Ca 0.26 -0.83 0.06 0.00 0.02 0.00 0.00 54.97 54.47 2bys s GLU 49 Cb -0.09 -1.88 -0.02 0.00 0.10 0.00 0.00 34.13 32.24 2bys s GLU 49 CO 0.85 0.45 -0.18 0.08 0.02 0.00 0.00 175.26 176.48 2bys s VAL 50 N -0.41 1.43 -0.19 2.63 1.01 -0.80 -0.40 120.40 123.67 2bys s VAL 50 Ca 0.05 -0.82 -0.04 0.00 0.00 0.00 0.00 61.98 61.16 2bys s VAL 50 Cb -0.10 -1.20 -0.02 0.00 0.00 0.00 0.00 36.38 35.05 2bys s VAL 50 CO 0.00 0.36 -0.02 -1.81 0.00 0.00 0.00 175.10 173.64 2bys s ASP 51 N -0.53 4.71 0.08 3.32 1.01 -0.35 -1.40 116.67 123.51 2bys s ASP 51 Ca 0.07 -0.22 0.05 0.00 0.71 0.00 0.00 52.55 53.16 2bys s ASP 51 Cb -0.07 -1.79 -0.04 0.00 1.01 0.00 0.00 42.92 42.03 2bys s ASP 51 CO -0.00 0.08 -0.05 -0.76 0.21 0.00 0.00 175.17 174.64 2bys s LEU 52 N 0.90 3.25 -0.13 1.23 1.43 0.36 -1.45 118.68 124.26 2bys s LEU 52 Ca 0.00 -0.26 0.01 0.00 -1.03 0.00 0.00 54.13 52.86 2bys s LEU 52 Cb -0.14 -1.99 -0.00 0.00 0.03 0.00 0.00 46.19 44.09 2bys s LEU 52 CO 0.02 0.19 -0.18 -0.69 0.23 0.00 0.00 176.35 175.92 2bys s VAL 53 N -1.22 2.49 0.23 -1.59 1.01 -0.01 -1.06 120.40 120.25 2bys s VAL 53 Ca 0.23 -0.85 -0.17 0.00 0.00 0.00 0.00 61.98 61.19 2bys s VAL 53 Cb -0.11 -2.02 0.02 0.00 0.00 0.00 0.00 36.38 34.27 2bys s VAL 53 CO 0.15 0.53 0.56 -0.72 0.00 0.00 0.00 175.10 175.62 2bys s TYR 54 N 0.59 -0.02 0.05 5.22 -0.85 -0.93 -0.73 117.35 120.67 2bys s TYR 54 Ca -0.10 -0.35 0.09 0.00 -0.52 0.00 0.00 57.07 56.19 2bys s TYR 54 Cb -0.16 0.41 -0.03 0.00 0.38 0.00 0.00 41.96 42.56 2bys s TYR 54 CO 0.03 -1.00 -0.24 1.52 -1.52 0.00 0.00 175.55 174.34 2bys s TYR 55 N -3.92 2.10 -0.32 -3.49 -0.85 -0.56 -1.00 117.35 109.31 2bys s TYR 55 Ca 0.13 -0.40 -0.03 0.00 -0.52 0.00 0.00 57.07 56.25 2bys s TYR 55 Cb -0.02 -1.24 0.06 0.00 0.38 0.00 0.00 41.96 41.13 2bys s TYR 55 CO 0.02 0.13 0.05 -2.00 -1.52 0.00 0.00 175.55 172.23 2bys s GLU 56 N -1.30 2.40 -0.16 -3.49 2.12 -0.64 -1.04 118.70 116.60 2bys s GLU 56 Ca 0.10 -1.33 -0.27 0.00 0.36 0.00 0.00 54.97 53.83 2bys s GLU 56 Cb -0.10 -3.29 -0.01 0.00 0.26 0.00 0.00 34.13 31.00 2bys s GLU 56 CO 0.02 -0.69 0.92 -1.14 -0.54 0.00 0.00 175.26 173.83 2bys s GLN 57 N 1.26 4.33 -0.07 4.30 0.74 0.24 -3.37 119.66 127.10 2bys s GLN 57 Ca -0.03 1.19 0.05 0.00 0.05 0.00 0.00 55.36 56.62 2bys s GLN 57 Cb -0.20 -3.57 -0.01 0.00 1.10 0.00 0.00 33.01 30.33 2bys s GLN 57 CO -0.01 -0.37 -0.23 -0.65 -0.55 0.00 0.00 175.29 173.49 2bys s GLN 58 N 2.25 2.69 -0.02 1.67 -0.21 0.25 -2.07 119.66 124.23 2bys s GLN 58 Ca 0.42 -0.86 0.02 0.00 0.02 0.00 0.00 55.36 54.96 2bys s GLN 58 Cb -0.17 -2.25 0.00 0.00 1.00 0.00 0.00 33.01 31.60 2bys s GLN 58 CO 0.13 0.36 -0.06 1.03 -2.12 0.00 0.00 175.29 174.64 2bys s ARG 59 N -0.10 0.62 0.28 2.91 0.52 -0.47 -1.56 118.95 121.15 2bys s ARG 59 Ca -0.05 -0.19 -0.18 0.00 -0.52 0.00 0.00 55.73 54.80 2bys s ARG 59 Cb -0.14 -0.61 0.02 0.00 0.52 0.00 0.00 34.95 34.73 2bys s ARG 59 CO 0.04 0.07 0.65 1.67 0.02 0.00 0.00 175.30 177.75 2bys s TRP 60 N 0.20 0.02 -0.04 -0.53 -2.14 -1.02 -0.54 118.94 114.89 2bys s TRP 60 Ca -0.02 -0.47 -0.02 0.00 2.66 0.00 0.00 56.10 58.25 2bys s TRP 60 Cb -0.07 0.55 0.02 0.00 -3.10 0.00 0.00 33.47 30.88 2bys s TRP 60 CO -0.00 -1.19 0.08 0.21 -2.66 0.00 0.00 176.95 173.39 2bys s LYS 61 N -3.80 0.07 0.00 3.25 2.20 -1.26 -0.12 119.74 120.08 2bys s LYS 61 Ca 0.15 0.18 0.04 0.00 -0.36 0.00 0.00 55.97 55.99 2bys s LYS 61 Cb -0.04 -0.06 -0.01 0.00 -1.51 0.00 0.00 37.83 36.20 2bys s LYS 61 CO 0.08 -0.07 -0.14 -0.51 -0.36 0.00 0.00 175.35 174.35 2bys s LEU 62 N 0.49 2.07 0.48 5.43 1.43 0.08 -4.92 118.68 123.74 2bys s LEU 62 Ca -0.04 -0.31 0.28 0.00 -1.03 0.00 0.00 54.13 53.03 2bys s LEU 62 Cb -0.05 -0.67 0.87 0.00 0.03 0.00 0.00 46.19 46.37 2bys s LEU 62 CO -0.02 0.13 1.80 0.78 0.23 0.00 0.00 176.35 179.27 2bys h ASN 63 N 5.54 0.00 0.38 2.29 2.35 -1.89 -3.08 115.58 121.17 2bys h ASN 63 Ca -0.35 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.40 2bys h ASN 63 Cb 1.17 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.54 2bys h ASN 63 CO 0.47 0.05 0.00 -1.54 -1.65 0.00 0.00 177.43 174.77 2bys n SER 64 N -3.14 0.57 -0.35 5.81 3.41 -1.26 -2.99 113.62 115.68 2bys n SER 64 Ca 0.02 0.69 0.06 0.00 -0.26 0.00 0.00 58.87 59.38 2bys n SER 64 Cb 0.42 -0.80 0.13 0.00 -0.26 0.00 0.00 64.21 63.71 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 -2.19 2.70 -4.79 1.04 4.77 -1.16 -5.00 117.00 112.37 2bys n LEU 65 Ca 0.01 -2.53 -0.37 0.00 -0.03 0.00 0.00 56.01 53.09 2bys n LEU 65 Cb 0.13 -0.29 -0.06 0.00 -2.33 0.00 0.00 43.42 40.87 2bys n LEU 65 CO 0.14 0.65 0.59 -0.04 -1.33 0.00 0.00 177.39 177.40 2bys s MET 66 N -1.93 4.48 0.16 3.23 -1.94 -1.16 -3.93 119.30 118.22 2bys s MET 66 Ca 0.23 1.20 -0.09 0.00 -1.71 0.00 0.00 55.69 55.32 2bys s MET 66 Cb 0.18 -2.80 -0.01 0.00 2.01 0.00 0.00 34.83 34.21 2bys s MET 66 CO 0.06 0.30 0.27 1.67 -0.01 0.00 0.00 175.02 177.31 2bys s TRP 67 N -1.61 0.39 -0.40 -0.03 -2.14 -0.08 -4.96 118.94 110.12 2bys s TRP 67 Ca 0.49 -0.76 -0.16 0.00 2.66 0.00 0.00 56.10 58.33 2bys s TRP 67 Cb -0.18 -0.07 0.01 0.00 -3.10 0.00 0.00 33.47 30.14 2bys s TRP 67 CO 0.23 -0.70 0.37 0.34 -2.66 0.00 0.00 176.95 174.53 2bys s ASP 68 N -2.96 6.16 0.40 -2.66 2.15 -1.26 -4.61 116.67 113.88 2bys s ASP 68 Ca 0.16 -0.63 0.14 0.00 0.43 0.00 0.00 52.55 52.65 2bys s ASP 68 Cb 0.04 -2.19 0.99 0.00 -0.30 0.00 0.00 42.92 41.45 2bys s ASP 68 CO -0.01 -0.47 1.88 -0.65 -0.17 0.00 0.00 175.17 175.75 2bys h PRO 69 N 8.63 0.48 0.00 4.34 0.11 -1.94 -0.61 132.00 143.01 2bys h PRO 69 Ca -0.28 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.81 2bys h PRO 69 Cb 1.12 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.12 2bys h PRO 69 CO 0.75 0.32 0.00 -0.97 -0.21 0.00 0.00 178.00 177.88 2bys h ASN 70 N 0.50 0.00 0.15 -2.05 -1.24 -1.93 0.53 115.58 111.53 2bys h ASN 70 Ca 0.43 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.44 2bys h ASN 70 Cb 0.92 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.97 2bys h ASN 70 CO -0.17 0.00 -0.20 -0.62 -1.29 0.00 0.00 177.43 175.15 2bys n GLU 71 N -2.69 1.11 -2.26 6.67 1.02 -0.24 -4.35 120.64 119.90 2bys n GLU 71 Ca 0.00 -0.68 -0.06 0.00 -0.02 0.00 0.00 57.16 56.41 2bys n GLU 71 Cb 0.21 -1.49 0.05 0.00 -0.02 0.00 0.00 31.44 30.19 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 -0.35 1.41 -2.81 -0.32 4.01 -0.61 -4.97 117.16 113.51 2bys n TYR 72 Ca 0.14 -1.89 -0.19 0.00 -0.16 0.00 0.00 57.90 55.80 2bys n TYR 72 Cb 0.36 -0.25 0.02 0.00 -0.31 0.00 0.00 39.34 39.17 2bys n TYR 72 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2bys n GLY 73 N -0.52 -0.35 3.30 2.72 0.00 -1.19 -3.01 105.19 106.14 2bys n GLY 73 Ca 0.18 -0.03 -0.22 0.00 0.00 0.00 0.00 46.02 45.95 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 -6.09 -4.67 1.61 4.05 0.18 -4.98 115.26 103.54 2bys n ASN 74 Ca -0.12 -0.43 -0.43 0.00 0.45 0.00 0.00 54.58 54.06 2bys n ASN 74 Cb 0.61 -4.78 -0.02 0.00 1.23 0.00 0.00 39.78 36.82 2bys n ASN 74 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 177.26 173.58 2bys s ILE 75 N -3.25 4.69 -0.18 -1.44 1.01 -1.16 -4.90 121.20 115.96 2bys s ILE 75 Ca 0.46 2.00 0.19 0.00 0.00 0.00 0.00 60.65 63.30 2bys s ILE 75 Cb -0.20 -4.29 -0.28 0.00 0.01 0.00 0.00 42.46 37.70 2bys s ILE 75 CO 0.57 -0.09 0.49 0.35 0.00 0.00 0.00 174.94 176.27 2bys n THR 76 N 4.95 0.00 -3.80 2.92 -2.24 -1.26 -4.30 114.28 110.54 2bys n THR 76 Ca 0.11 -0.37 -0.04 0.00 -2.27 0.00 0.00 64.05 61.47 2bys n THR 76 Cb 0.47 0.23 -0.00 0.00 -2.10 0.00 0.00 70.33 68.93 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 -3.96 -0.13 -0.10 3.42 1.47 -1.26 -0.67 116.67 115.44 2bys s ASP 77 Ca -0.04 -0.57 -0.30 0.00 1.18 0.00 0.00 52.55 52.82 2bys s ASP 77 Cb 0.13 0.56 0.08 0.00 -0.34 0.00 0.00 42.92 43.35 2bys s ASP 77 CO 0.80 -1.07 0.74 0.72 0.68 0.00 0.00 175.17 177.04 2bys s PHE 78 N -3.04 -0.62 0.29 2.11 -0.12 -0.63 -5.01 117.98 110.96 2bys s PHE 78 Ca 0.14 1.15 -0.14 0.00 -0.05 0.00 0.00 56.93 58.03 2bys s PHE 78 Cb -0.03 0.40 -0.08 0.00 -0.63 0.00 0.00 43.02 42.68 2bys s PHE 78 CO 0.05 -0.53 0.68 -0.98 -0.05 0.00 0.00 175.22 174.39 2bys s ARG 79 N -0.95 3.97 0.14 1.99 3.03 -1.26 -1.26 118.95 124.61 2bys s ARG 79 Ca -0.08 0.58 -0.16 0.00 2.03 0.00 0.00 55.73 58.10 2bys s ARG 79 Cb -0.01 -2.53 0.03 0.00 -1.03 0.00 0.00 34.95 31.41 2bys s ARG 79 CO 0.07 0.22 0.43 -0.08 -1.13 0.00 0.00 175.30 174.81 2bys s THR 80 N -1.89 0.06 0.41 4.99 -1.32 0.29 -4.97 115.64 113.20 2bys s THR 80 Ca 0.51 -0.63 -0.26 0.00 -1.21 0.00 0.00 61.69 60.11 2bys s THR 80 Cb -0.11 -1.27 -0.09 0.00 -1.51 0.00 0.00 72.50 69.53 2bys s THR 80 CO 0.19 -0.27 1.34 -0.55 -2.21 0.00 0.00 174.62 173.12 2bys s SER 81 N -2.82 6.23 0.55 8.08 0.15 -1.26 -0.31 113.70 124.31 2bys s SER 81 Ca 0.05 2.75 0.28 0.00 0.70 0.00 0.00 55.95 59.72 2bys s SER 81 Cb 0.01 -2.64 1.59 0.00 -1.71 0.00 0.00 66.02 63.27 2bys s SER 81 CO -0.10 -0.92 2.14 0.00 1.20 0.00 0.00 173.24 175.57 2bys h ALA 82 N 2.64 1.39 0.00 5.45 0.00 -1.55 -2.00 119.26 125.19 2bys h ALA 82 Ca -0.50 -0.07 -0.08 0.00 0.00 0.00 0.00 54.91 54.27 2bys h ALA 82 Cb 1.25 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.02 2bys h ALA 82 CO 0.62 0.09 -0.36 0.00 0.00 0.00 0.00 179.25 179.61 2bys h ALA 83 N 1.93 1.30 0.00 0.00 0.00 -1.90 -3.07 119.26 117.51 2bys h ALA 83 Ca -0.00 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.58 2bys h ALA 83 Cb 0.20 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.93 2bys h ALA 83 CO 0.01 0.45 0.00 -0.25 0.00 0.00 0.00 179.25 179.46 2bys n ASP 84 N -3.96 0.00 -4.24 0.00 8.00 -0.75 -4.85 116.55 110.76 2bys n ASP 84 Ca -0.02 -0.13 -0.13 0.00 0.71 0.00 0.00 54.79 55.23 2bys n ASP 84 Cb 0.41 -0.29 -0.10 0.00 -0.02 0.00 0.00 41.12 41.13 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 -2.57 0.75 0.17 0.53 -4.36 -1.16 -4.95 121.20 109.60 2bys s ILE 85 Ca 0.27 -1.98 -0.30 0.00 -0.26 0.00 0.00 60.65 58.38 2bys s ILE 85 Cb 0.20 -2.04 -0.08 0.00 1.25 0.00 0.00 42.46 41.79 2bys s ILE 85 CO 0.44 -0.56 1.29 0.86 0.24 0.00 0.00 174.94 177.22 2bys s TRP 86 N -3.60 3.30 0.10 1.37 -0.00 -1.26 -4.93 118.94 113.92 2bys s TRP 86 Ca 0.22 1.21 0.06 0.00 -0.00 0.00 0.00 56.10 57.59 2bys s TRP 86 Cb 0.06 -3.57 -0.03 0.00 -0.00 0.00 0.00 33.47 29.92 2bys s TRP 86 CO 0.02 -1.80 -0.16 0.95 -0.00 0.00 0.00 176.95 175.97 2bys s THR 87 N 0.35 1.36 0.45 5.86 -4.23 -1.26 -5.11 115.64 113.06 2bys s THR 87 Ca 0.58 -1.55 -0.21 0.00 -1.18 0.00 0.00 61.69 59.33 2bys s THR 87 Cb -0.35 -1.39 -0.10 0.00 1.34 0.00 0.00 72.50 72.00 2bys s THR 87 CO 0.36 -0.27 0.99 -2.16 -0.54 0.00 0.00 174.62 172.99 2bys s PRO 88 N -2.19 4.06 -0.79 3.99 0.04 -1.26 -4.95 135.00 133.89 2bys s PRO 88 Ca 0.05 1.22 -0.05 0.00 0.04 0.00 0.00 61.00 62.26 2bys s PRO 88 Cb -0.08 -2.15 0.07 0.00 0.04 0.00 0.00 34.50 32.38 2bys s PRO 88 CO 0.03 -0.19 2.67 -0.40 0.04 0.00 0.00 177.00 179.15 2bys n ASP 89 N -0.77 7.07 -4.64 6.66 5.75 -1.26 -4.95 116.55 124.41 2bys n ASP 89 Ca 0.08 -3.14 -0.43 0.00 -0.01 0.00 0.00 54.79 51.30 2bys n ASP 89 Cb 0.53 -1.30 -0.02 0.00 -1.03 0.00 0.00 41.12 39.30 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 -1.59 3.83 0.06 2.12 -1.09 -1.26 -2.86 121.20 120.40 2bys s ILE 90 Ca 0.58 0.97 0.08 0.00 -2.23 0.00 0.00 60.65 60.04 2bys s ILE 90 Cb 0.30 -3.75 -0.03 0.00 -1.58 0.00 0.00 42.46 37.40 2bys s ILE 90 CO -0.16 -0.23 -0.21 -0.89 -1.23 0.00 0.00 174.94 172.23 2bys s THR 91 N 4.51 1.69 0.13 2.92 2.01 0.89 -4.87 115.64 122.92 2bys s THR 91 Ca 0.67 -1.30 -0.30 0.00 0.31 0.00 0.00 61.69 61.07 2bys s THR 91 Cb -0.25 -1.48 -0.06 0.00 0.01 0.00 0.00 72.50 70.71 2bys s THR 91 CO 0.26 0.13 0.96 0.00 -0.69 0.00 0.00 174.62 175.28 2bys s ALA 92 N -0.90 3.26 0.11 7.40 0.00 -1.26 -1.27 121.76 129.10 2bys s ALA 92 Ca 0.07 0.59 -0.07 0.00 0.00 0.00 0.00 51.96 52.55 2bys s ALA 92 Cb -0.09 -3.27 -0.15 0.00 0.00 0.00 0.00 23.12 19.61 2bys s ALA 92 CO 0.02 0.01 1.26 -0.92 0.00 0.00 0.00 175.76 176.13 2bys h TYR 93 N 5.33 0.74 -0.51 0.00 3.20 -1.52 -3.34 116.97 120.87 2bys h TYR 93 Ca -0.43 -0.41 -0.34 0.00 3.14 0.00 0.00 58.73 60.69 2bys h TYR 93 Cb 1.21 -0.08 -0.23 0.00 1.54 0.00 0.00 36.73 39.17 2bys h TYR 93 CO 0.64 1.24 -0.32 -1.13 -1.64 0.00 0.00 178.16 176.95 2bys n SER 94 N -3.76 3.80 -4.77 -2.11 3.41 -1.26 -5.03 113.62 103.90 2bys n SER 94 Ca -0.08 -3.80 -0.37 0.00 -0.26 0.00 0.00 58.87 54.35 2bys n SER 94 Cb 0.87 -0.55 -0.01 0.00 -0.26 0.00 0.00 64.21 64.26 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 -2.98 6.13 -0.00 4.04 1.04 -1.26 -1.01 113.70 119.66 2bys s SER 95 Ca 0.48 2.37 0.12 0.00 0.48 0.00 0.00 55.95 59.41 2bys s SER 95 Cb 0.41 -2.61 -0.14 0.00 0.10 0.00 0.00 66.02 63.78 2bys s SER 95 CO -0.00 -0.95 0.47 0.35 0.98 0.00 0.00 173.24 174.09 2bys n THR 96 N -0.44 0.00 -4.09 2.02 -2.24 -0.07 -4.85 114.28 104.62 2bys n THR 96 Ca 0.07 -0.23 -0.09 0.00 -2.27 0.00 0.00 64.05 61.53 2bys n THR 96 Cb 0.47 0.84 -0.10 0.00 -2.10 0.00 0.00 70.33 69.44 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 -2.29 0.62 0.48 -0.78 1.81 -1.25 -5.06 118.95 112.47 2bys s ARG 97 Ca 0.03 -1.10 -0.24 0.00 -1.72 0.00 0.00 55.73 52.69 2bys s ARG 97 Cb 0.09 0.02 -0.07 0.00 -0.45 0.00 0.00 34.95 34.54 2bys s ARG 97 CO 0.50 -0.06 1.39 -2.30 -0.68 0.00 0.00 175.30 174.15 2bys n PRO 98 N 0.45 2.04 -1.91 3.54 -0.02 -1.26 -4.66 135.00 133.18 2bys n PRO 98 Ca -0.16 0.73 -0.41 0.00 -2.02 0.00 0.00 63.50 61.64 2bys n PRO 98 Cb 0.59 -2.58 -0.01 0.00 -0.02 0.00 0.00 33.50 31.48 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 -1.22 2.28 -0.27 -1.45 1.01 -1.26 -4.87 120.40 114.62 2bys s VAL 99 Ca 0.64 0.28 -0.09 0.00 0.00 0.00 0.00 61.98 62.81 2bys s VAL 99 Cb -0.45 -3.18 -0.03 0.00 0.00 0.00 0.00 36.38 32.72 2bys s VAL 99 CO 0.55 0.06 0.12 -1.10 0.00 0.00 0.00 175.10 174.74 2bys s GLN 100 N -1.87 3.73 -0.09 2.72 -0.21 -0.74 -4.98 119.66 118.22 2bys s GLN 100 Ca 0.52 -0.45 -0.26 0.00 0.02 0.00 0.00 55.36 55.19 2bys s GLN 100 Cb -0.44 -3.47 -0.03 0.00 1.00 0.00 0.00 33.01 30.07 2bys s GLN 100 CO 0.59 -0.21 0.84 0.08 -2.12 0.00 0.00 175.29 174.46 2bys s VAL 101 N 1.67 4.93 -1.06 1.09 1.01 -1.26 -0.79 120.40 125.99 2bys s VAL 101 Ca 0.06 1.70 0.11 0.00 0.00 0.00 0.00 61.98 63.86 2bys s VAL 101 Cb -0.16 -4.16 0.01 0.00 0.00 0.00 0.00 36.38 32.07 2bys s VAL 101 CO 0.07 0.14 0.69 0.18 0.00 0.00 0.00 175.10 176.18 2bys n LEU 102 N 4.37 1.36 -4.25 3.92 4.77 0.83 -4.97 117.00 123.02 2bys n LEU 102 Ca 0.03 -0.79 -0.15 0.00 -0.03 0.00 0.00 56.01 55.07 2bys n LEU 102 Cb 0.50 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.49 2bys n LEU 102 CO 0.49 0.27 -0.42 -0.94 -1.33 0.00 0.00 177.39 175.46 2bys s SER 103 N -1.40 1.89 0.31 -1.43 1.04 -1.24 -4.91 113.70 107.96 2bys s SER 103 Ca 0.10 -0.96 -0.28 0.00 0.48 0.00 0.00 55.95 55.29 2bys s SER 103 Cb 0.09 -0.03 -0.14 0.00 0.10 0.00 0.00 66.02 66.04 2bys s SER 103 CO 0.26 -0.27 1.03 -2.65 0.98 0.00 0.00 173.24 172.60 2bys n PRO 104 N -0.01 1.43 -2.35 4.02 -0.02 -1.26 -4.85 135.00 131.97 2bys n PRO 104 Ca -0.11 0.50 -0.42 0.00 -2.02 0.00 0.00 63.50 61.45 2bys n PRO 104 Cb 0.60 -1.91 0.00 0.00 -0.02 0.00 0.00 33.50 32.17 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 0.65 4.12 -4.81 -0.52 6.02 -1.26 -4.90 117.38 116.68 2bys n GLN 105 Ca 0.09 -3.71 -0.25 0.00 -0.01 0.00 0.00 57.00 53.11 2bys n GLN 105 Cb 0.33 -2.76 -0.16 0.00 1.02 0.00 0.00 30.24 28.68 2bys n GLN 105 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 2bys s ILE 106 N -0.77 1.37 0.36 5.09 1.01 -1.26 -1.39 121.20 125.61 2bys s ILE 106 Ca 0.42 -0.70 0.08 0.00 0.00 0.00 0.00 60.65 60.45 2bys s ILE 106 Cb 0.12 -1.17 -0.07 0.00 0.01 0.00 0.00 42.46 41.35 2bys s ILE 106 CO -0.02 0.39 -0.05 0.00 0.00 0.00 0.00 174.94 175.27 2bys s ALA 107 N -0.09 2.92 -0.11 9.38 0.00 0.58 -4.70 121.76 129.74 2bys s ALA 107 Ca -0.01 -2.14 0.03 0.00 0.00 0.00 0.00 51.96 49.85 2bys s ALA 107 Cb -0.10 0.08 0.01 0.00 0.00 0.00 0.00 23.12 23.11 2bys s ALA 107 CO 0.01 -0.02 -0.21 0.08 0.00 0.00 0.00 175.76 175.63 2bys s VAL 108 N -2.72 1.87 -0.11 0.00 1.01 -0.70 -0.55 120.40 119.20 2bys s VAL 108 Ca 0.33 -0.89 -0.01 0.00 0.00 0.00 0.00 61.98 61.42 2bys s VAL 108 Cb 0.05 -1.64 -0.03 0.00 0.00 0.00 0.00 36.38 34.76 2bys s VAL 108 CO 0.16 0.52 -0.07 -0.69 0.00 0.00 0.00 175.10 175.02 2bys s VAL 109 N 0.64 3.68 0.19 2.92 1.01 -0.39 -1.41 120.40 127.04 2bys s VAL 109 Ca -0.13 -0.46 0.08 0.00 0.00 0.00 0.00 61.98 61.48 2bys s VAL 109 Cb -0.16 -2.55 -0.04 0.00 0.00 0.00 0.00 36.38 33.62 2bys s VAL 109 CO 0.03 0.55 -0.03 -0.89 0.00 0.00 0.00 175.10 174.76 2bys s THR 110 N -0.20 3.50 0.60 3.92 2.01 0.17 -1.60 115.64 124.04 2bys s THR 110 Ca 0.03 -1.59 0.31 0.00 0.31 0.00 0.00 61.69 60.75 2bys s THR 110 Cb -0.13 -2.78 0.37 0.00 0.01 0.00 0.00 72.50 69.97 2bys s THR 110 CO 0.03 -0.16 2.24 1.12 -0.69 0.00 0.00 174.62 177.15 2bys h HIS 111 N 2.60 0.00 0.00 4.92 2.07 -1.20 0.24 115.15 123.79 2bys h HIS 111 Ca -0.46 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.06 2bys h HIS 111 Cb 1.21 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.19 2bys h HIS 111 CO 0.64 0.00 0.00 -0.40 -3.07 0.00 0.00 177.93 175.10 2bys n ASP 112 N -3.73 0.00 0.00 3.10 5.75 -1.26 -0.90 116.55 119.51 2bys n ASP 112 Ca -0.02 -1.33 0.00 0.00 -0.01 0.00 0.00 54.79 53.43 2bys n ASP 112 Cb 0.13 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.22 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 0.63 0.75 3.80 6.12 0.00 0.85 -4.74 105.19 112.60 2bys n GLY 113 Ca 0.12 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.37 7.18 0.11 1.61 1.04 -1.21 -0.74 113.70 119.31 2bys s SER 114 Ca 0.00 1.42 0.10 0.00 0.48 0.00 0.00 55.95 57.96 2bys s SER 114 Cb 0.00 -2.42 -0.04 0.00 0.10 0.00 0.00 66.02 63.67 2bys s SER 114 CO 0.00 0.21 -0.27 -0.69 0.98 0.00 0.00 173.24 173.48 2bys s VAL 115 N -1.19 2.21 -0.02 5.02 1.01 0.82 -0.66 120.40 127.60 2bys s VAL 115 Ca 0.34 -1.66 0.01 0.00 0.00 0.00 0.00 61.98 60.67 2bys s VAL 115 Cb -0.20 -1.94 0.01 0.00 0.00 0.00 0.00 36.38 34.25 2bys s VAL 115 CO 0.22 0.16 -0.03 -0.32 0.00 0.00 0.00 175.10 175.12 2bys s MET 116 N -1.84 0.52 -0.03 2.72 0.00 -0.50 -2.44 119.30 117.73 2bys s MET 116 Ca 0.13 -0.09 -0.00 0.00 0.00 0.00 0.00 55.69 55.73 2bys s MET 116 Cb -0.10 -0.57 0.03 0.00 0.00 0.00 0.00 34.83 34.19 2bys s MET 116 CO 0.05 -0.02 0.03 0.12 0.00 0.00 0.00 175.02 175.19 2bys s PHE 117 N 0.54 0.15 -0.55 4.11 5.36 -0.60 -1.72 117.98 125.27 2bys s PHE 117 Ca -0.06 0.10 0.06 0.00 -0.96 0.00 0.00 56.93 56.07 2bys s PHE 117 Cb -0.10 -0.36 0.22 0.00 -0.34 0.00 0.00 43.02 42.44 2bys s PHE 117 CO -0.00 -0.13 0.56 -0.89 -1.46 0.00 0.00 175.22 173.30 2bys n ILE 118 N 4.43 0.76 -2.26 3.12 5.41 -1.26 -0.58 119.36 128.99 2bys n ILE 118 Ca -0.22 -4.51 -0.41 0.00 1.00 0.00 0.00 62.75 58.61 2bys n ILE 118 Cb 0.50 -2.00 -0.03 0.00 -0.71 0.00 0.00 39.64 37.40 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 -1.48 4.41 -0.04 0.38 0.04 -1.22 -4.75 135.00 132.35 2bys s PRO 119 Ca 0.34 2.01 -0.16 0.00 0.04 0.00 0.00 61.00 63.23 2bys s PRO 119 Cb 0.10 -3.21 -0.05 0.00 0.04 0.00 0.00 34.50 31.37 2bys s PRO 119 CO -0.10 -0.23 0.44 0.00 0.04 0.00 0.00 177.00 177.14 2bys s ALA 120 N 0.17 3.61 0.02 8.56 0.00 -1.26 -1.62 121.76 131.24 2bys s ALA 120 Ca 0.56 -0.20 -0.00 0.00 0.00 0.00 0.00 51.96 52.32 2bys s ALA 120 Cb -0.35 -2.49 -0.02 0.00 0.00 0.00 0.00 23.12 20.26 2bys s ALA 120 CO 0.37 0.30 -0.03 -0.65 0.00 0.00 0.00 175.76 175.76 2bys s GLN 121 N -0.47 0.27 -0.17 0.00 -0.21 -0.17 -0.12 119.66 118.79 2bys s GLN 121 Ca 0.24 -0.52 -0.06 0.00 0.02 0.00 0.00 55.36 55.04 2bys s GLN 121 Cb -0.16 0.09 -0.03 0.00 1.00 0.00 0.00 33.01 33.91 2bys s GLN 121 CO 0.12 -0.04 0.02 0.50 -2.12 0.00 0.00 175.29 173.77 2bys s ARG 122 N -1.25 3.82 -0.08 2.91 3.52 0.03 -2.20 118.95 125.70 2bys s ARG 122 Ca -0.14 -0.42 0.01 0.00 -0.13 0.00 0.00 55.73 55.05 2bys s ARG 122 Cb -0.09 -3.07 0.02 0.00 -1.56 0.00 0.00 34.95 30.25 2bys s ARG 122 CO -0.01 0.28 -0.09 -1.17 -0.81 0.00 0.00 175.30 173.50 2bys s LEU 123 N 0.32 1.40 -0.22 -0.88 2.96 -0.22 -1.79 118.68 120.26 2bys s LEU 123 Ca 0.00 -0.27 -0.17 0.00 -0.22 0.00 0.00 54.13 53.48 2bys s LEU 123 Cb -0.13 -0.76 -0.04 0.00 0.50 0.00 0.00 46.19 45.76 2bys s LEU 123 CO 0.01 -0.04 0.44 -0.44 -1.32 0.00 0.00 176.35 175.01 2bys s SER 124 N 1.11 6.45 0.19 3.68 0.01 -1.26 -0.49 113.70 123.39 2bys s SER 124 Ca -0.07 0.53 0.03 0.00 1.31 0.00 0.00 55.95 57.76 2bys s SER 124 Cb -0.14 -2.25 -0.05 0.00 0.21 0.00 0.00 66.02 63.79 2bys s SER 124 CO -0.01 -0.15 -0.02 0.72 0.41 0.00 0.00 173.24 174.19 2bys s PHE 125 N 1.63 1.34 -0.13 2.43 -0.12 -0.50 -0.89 117.98 121.74 2bys s PHE 125 Ca 0.20 -0.93 -0.29 0.00 -0.05 0.00 0.00 56.93 55.86 2bys s PHE 125 Cb -0.15 -0.75 -0.04 0.00 -0.63 0.00 0.00 43.02 41.45 2bys s PHE 125 CO 0.09 -0.09 1.59 -1.64 -0.05 0.00 0.00 175.22 175.12 2bys s MET 126 N -3.86 4.03 -0.30 1.99 -1.94 -0.18 -1.90 119.30 117.13 2bys s MET 126 Ca 0.24 1.91 -0.12 0.00 -1.71 0.00 0.00 55.69 56.02 2bys s MET 126 Cb 0.05 -3.98 0.12 0.00 2.01 0.00 0.00 34.83 33.04 2bys s MET 126 CO 0.05 -1.01 0.69 0.00 -0.01 0.00 0.00 175.02 174.74 2bys s ASP 128 N 2.61 6.40 -0.02 0.00 2.15 -1.26 -3.21 116.67 123.34 2bys s ASP 128 Ca -0.06 -0.19 0.02 0.00 0.43 0.00 0.00 52.55 52.75 2bys s ASP 128 Cb -0.10 -2.42 0.10 0.00 -0.30 0.00 0.00 42.92 40.20 2bys s ASP 128 CO -0.19 -1.09 0.87 -0.81 -0.17 0.00 0.00 175.17 173.78 2bys n PRO 129 N 7.16 1.38 -1.66 4.34 -0.04 -1.26 -4.73 135.00 140.18 2bys n PRO 129 Ca 0.03 -0.39 -0.47 0.00 -0.04 0.00 0.00 63.50 62.62 2bys n PRO 129 Cb 0.48 -1.34 -0.05 0.00 -0.04 0.00 0.00 33.50 32.56 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 -0.06 0.04 -0.20 0.52 -1.04 -1.26 -1.73 114.28 110.55 2bys n THR 130 Ca 0.04 -0.01 0.00 0.00 -2.04 0.00 0.00 64.05 62.04 2bys n THR 130 Cb 0.23 -1.42 0.00 0.00 -1.82 0.00 0.00 70.33 67.32 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 3.32 0.60 0.23 3.41 0.00 -1.26 -4.46 105.19 107.03 2bys n GLY 131 Ca 0.18 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.30 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 0.64 -0.27 1.61 3.04 -1.54 -1.89 116.25 117.84 2bys h VAL 132 Ca 0.00 -1.00 0.00 0.00 -1.01 0.00 0.00 66.70 64.69 2bys h VAL 132 Cb 0.00 1.65 0.00 0.00 -2.01 0.00 0.00 31.29 30.93 2bys h VAL 132 CO 0.00 0.22 0.00 -0.90 -1.01 0.00 0.00 177.57 175.88 2bys n ASP 133 N -3.52 2.41 -4.79 3.17 5.68 -1.26 -1.16 116.55 117.08 2bys n ASP 133 Ca -0.01 -2.22 -0.31 0.00 -0.50 0.00 0.00 54.79 51.75 2bys n ASP 133 Cb 0.38 -0.42 -0.06 0.00 -1.14 0.00 0.00 41.12 39.88 2bys n ASP 133 CO 0.00 0.00 0.00 -0.94 -1.33 0.00 0.00 177.20 174.93 2bys s SER 134 N -0.62 4.24 0.19 -1.12 1.04 -0.72 -5.00 113.70 111.70 2bys s SER 134 Ca 0.22 -1.54 0.09 0.00 0.48 0.00 0.00 55.95 55.21 2bys s SER 134 Cb 0.15 0.44 -0.02 0.00 0.10 0.00 0.00 66.02 66.68 2bys s SER 134 CO 0.10 -0.88 1.39 -0.08 0.98 0.00 0.00 173.24 174.74 2bys h GLU 135 N 1.23 0.00 0.00 4.02 4.81 -1.90 -3.14 114.58 119.60 2bys h GLU 135 Ca -0.42 0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 58.75 2bys h GLU 135 Cb 1.31 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.68 2bys h GLU 135 CO 0.71 0.82 -0.27 1.05 -0.73 0.00 0.00 179.01 180.59 2bys h GLU 136 N 0.00 0.00 0.00 1.92 4.11 -1.97 -3.50 114.58 115.15 2bys h GLU 136 Ca -0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.42 2bys h GLU 136 Cb 1.54 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.79 2bys h GLU 136 CO 0.11 0.27 0.00 0.41 0.07 0.00 0.00 179.01 179.87 2bys n GLY 137 N 0.27 -1.53 3.40 1.06 0.00 -1.15 -4.85 105.19 102.39 2bys n GLY 137 Ca 0.00 -1.22 -0.29 0.00 0.00 0.00 0.00 46.02 44.51 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 -1.46 2.42 -0.11 4.61 0.00 0.79 -4.37 121.76 123.65 2bys s ALA 138 Ca 0.00 -1.42 0.03 0.00 0.00 0.00 0.00 51.96 50.57 2bys s ALA 138 Cb 0.00 -0.45 -0.00 0.00 0.00 0.00 0.00 23.12 22.67 2bys s ALA 138 CO 0.00 0.55 -0.22 0.99 0.00 0.00 0.00 175.76 177.08 2bys s THR 139 N -1.04 2.27 0.19 0.00 2.01 -1.26 -0.66 115.64 117.15 2bys s THR 139 Ca 0.14 -0.94 0.04 0.00 0.31 0.00 0.00 61.69 61.25 2bys s THR 139 Cb -0.10 -1.89 -0.05 0.00 0.01 0.00 0.00 72.50 70.47 2bys s THR 139 CO 0.06 0.55 -0.06 0.00 -0.69 0.00 0.00 174.62 174.49 2bys s ALA 141 N -3.34 0.45 -0.19 0.00 0.00 -1.26 -1.03 121.76 116.39 2bys s ALA 141 Ca 0.23 -0.85 -0.09 0.00 0.00 0.00 0.00 51.96 51.25 2bys s ALA 141 Cb 0.04 0.13 0.07 0.00 0.00 0.00 0.00 23.12 23.37 2bys s ALA 141 CO 0.05 -0.16 0.44 0.54 0.00 0.00 0.00 175.76 176.63 2bys s VAL 142 N -2.12 -0.30 0.05 0.00 0.11 0.07 -4.91 120.40 113.30 2bys s VAL 142 Ca -0.07 0.12 0.01 0.00 -2.93 0.00 0.00 61.98 59.11 2bys s VAL 142 Cb -0.05 -0.67 -0.04 0.00 -1.53 0.00 0.00 36.38 34.09 2bys s VAL 142 CO -0.02 0.05 0.15 -1.59 -3.33 0.00 0.00 175.10 170.35 2bys s LYS 143 N 1.95 3.22 -0.06 1.54 -2.85 -1.26 -0.49 119.74 121.79 2bys s LYS 143 Ca -0.06 -0.51 0.03 0.00 -1.00 0.00 0.00 55.97 54.43 2bys s LYS 143 Cb -0.10 -2.93 0.00 0.00 -2.06 0.00 0.00 37.83 32.75 2bys s LYS 143 CO -0.13 0.61 -0.16 -0.06 0.10 0.00 0.00 175.35 175.71 2bys s PHE 144 N -1.41 1.68 0.22 1.78 0.08 -0.27 -1.15 117.98 118.91 2bys s PHE 144 Ca 0.31 -0.55 -0.23 0.00 0.12 0.00 0.00 56.93 56.58 2bys s PHE 144 Cb -0.13 -1.16 0.04 0.00 -0.57 0.00 0.00 43.02 41.21 2bys s PHE 144 CO 0.23 -0.22 0.80 0.20 -0.10 0.00 0.00 175.22 176.13 2bys s GLY 145 N 0.28 -0.18 0.20 4.36 0.00 -0.40 -0.82 107.32 110.77 2bys s GLY 145 Ca -0.09 -0.08 -0.31 0.00 0.00 0.00 0.00 44.72 44.25 2bys s GLY 145 CO 0.03 -0.03 1.45 -0.45 0.00 0.00 0.00 173.10 174.10 2bys s SER 146 N -2.90 6.69 0.10 1.64 0.15 -1.26 -0.08 113.70 118.04 2bys s SER 146 Ca 0.11 2.57 -0.15 0.00 0.70 0.00 0.00 55.95 59.18 2bys s SER 146 Cb -0.04 -2.61 -0.09 0.00 -1.71 0.00 0.00 66.02 61.57 2bys s SER 146 CO 0.04 -0.71 1.41 -0.25 1.20 0.00 0.00 173.24 174.93 2bys h TRP 147 N 5.81 0.87 -0.00 3.44 2.91 -1.88 -3.38 115.95 123.72 2bys h TRP 147 Ca -0.44 -0.27 0.00 0.00 1.13 0.00 0.00 58.89 59.31 2bys h TRP 147 Cb 1.21 -0.18 0.00 0.00 -0.51 0.00 0.00 29.16 29.68 2bys h TRP 147 CO 0.62 1.03 -0.31 1.33 -1.03 0.00 0.00 178.44 180.08 2bys n VAL 148 N -4.24 0.00 -4.10 2.65 0.24 -1.26 -4.97 118.33 106.65 2bys n VAL 148 Ca -0.04 -0.35 -0.35 0.00 -2.04 0.00 0.00 64.34 61.57 2bys n VAL 148 Cb 0.49 1.06 -0.13 0.00 -1.47 0.00 0.00 33.84 33.78 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 -1.57 2.98 0.87 6.34 2.02 -1.26 -5.10 117.35 121.63 2bys s TYR 149 Ca 0.06 -0.64 -0.13 0.00 -0.37 0.00 0.00 57.07 55.98 2bys s TYR 149 Cb 0.07 -2.06 0.13 0.00 -0.40 0.00 0.00 41.96 39.70 2bys s TYR 149 CO 0.30 -0.34 1.23 -1.54 -1.57 0.00 0.00 175.55 173.63 2bys s SER 150 N 1.08 3.95 0.56 2.29 1.04 -1.26 -4.54 113.70 116.82 2bys s SER 150 Ca 0.02 0.55 0.33 0.00 0.48 0.00 0.00 55.95 57.33 2bys s SER 150 Cb -0.15 -0.86 1.46 0.00 0.10 0.00 0.00 66.02 66.57 2bys s SER 150 CO 0.00 -2.23 1.78 1.23 0.98 0.00 0.00 173.24 175.00 2bys h GLY 151 N -1.28 0.00 2.00 7.32 0.00 -0.68 0.17 103.07 110.60 2bys h GLY 151 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.88 2bys h GLY 151 CO 0.54 0.00 0.00 0.74 0.00 0.00 0.00 176.54 177.82 2bys h PHE 152 N 0.00 0.00 0.00 5.60 0.04 -1.92 -3.36 116.94 117.30 2bys h PHE 152 Ca 0.45 0.00 -0.22 0.00 2.80 0.00 0.00 57.97 60.99 2bys h PHE 152 Cb 2.00 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 40.11 2bys h PHE 152 CO 0.00 0.00 -1.79 0.39 -0.60 0.00 0.00 178.31 176.31 2bys n GLU 153 N -2.80 0.32 -4.11 1.51 4.71 0.39 -4.05 120.64 116.61 2bys n GLU 153 Ca 0.03 0.11 -0.27 0.00 -0.01 0.00 0.00 57.16 57.01 2bys n GLU 153 Cb 0.40 -1.15 -0.17 0.00 -1.01 0.00 0.00 31.44 29.51 2bys n GLU 153 CO 0.00 0.00 0.00 0.42 0.09 0.00 0.00 177.13 177.64 2bys s ILE 154 N -2.27 1.22 0.13 -3.67 1.01 0.06 -0.86 121.20 116.82 2bys s ILE 154 Ca -0.19 -0.44 0.06 0.00 0.00 0.00 0.00 60.65 60.08 2bys s ILE 154 Cb 0.06 -1.17 -0.04 0.00 0.01 0.00 0.00 42.46 41.32 2bys s ILE 154 CO 0.29 0.39 -0.02 -0.62 0.00 0.00 0.00 174.94 174.98 2bys s ASP 155 N 1.39 4.82 0.15 3.58 2.15 0.51 -3.73 116.67 125.54 2bys s ASP 155 Ca 0.00 -0.30 0.10 0.00 0.43 0.00 0.00 52.55 52.78 2bys s ASP 155 Cb -0.13 -1.06 -0.04 0.00 -0.30 0.00 0.00 42.92 41.38 2bys s ASP 155 CO -0.06 0.14 -0.20 -0.76 -0.17 0.00 0.00 175.17 174.12 2bys s LEU 156 N -2.55 2.58 0.14 -1.34 1.43 -1.26 -0.58 118.68 117.09 2bys s LEU 156 Ca 0.26 -0.68 -0.09 0.00 -1.03 0.00 0.00 54.13 52.58 2bys s LEU 156 Cb -0.11 -1.39 -0.00 0.00 0.03 0.00 0.00 46.19 44.72 2bys s LEU 156 CO 0.18 0.15 0.26 -1.59 0.23 0.00 0.00 176.35 175.58 2bys s LYS 157 N -2.35 1.06 0.16 1.70 -2.85 -0.56 -4.91 119.74 111.99 2bys s LYS 157 Ca 0.19 -1.09 0.09 0.00 -1.00 0.00 0.00 55.97 54.16 2bys s LYS 157 Cb -0.10 0.37 -0.04 0.00 -2.06 0.00 0.00 37.83 36.00 2bys s LYS 157 CO 0.10 -0.38 -0.20 0.95 0.10 0.00 0.00 175.35 175.92 2bys s THR 158 N -3.93 1.94 -0.38 3.79 -4.23 -1.26 -0.39 115.64 111.18 2bys s THR 158 Ca 0.13 -1.87 0.23 0.00 -1.18 0.00 0.00 61.69 59.00 2bys s THR 158 Cb 0.04 -1.86 0.05 0.00 1.34 0.00 0.00 72.50 72.07 2bys s THR 158 CO -0.04 -0.20 1.19 0.44 -0.54 0.00 0.00 174.62 175.47 2bys h ASP 159 N 3.42 0.00 -5.03 3.99 3.32 -1.98 -3.48 116.42 116.65 2bys h ASP 159 Ca -0.44 -0.07 -0.05 0.00 0.02 0.00 0.00 57.03 56.49 2bys h ASP 159 Cb 1.20 0.00 -0.14 0.00 0.22 0.00 0.00 39.33 40.61 2bys h ASP 159 CO 0.48 0.03 0.04 0.28 -1.72 0.00 0.00 179.24 178.35 2bys s THR 160 N -3.29 0.04 -1.64 0.35 -1.32 -1.26 -5.04 115.64 103.48 2bys s THR 160 Ca 0.02 -0.30 0.26 0.00 -1.21 0.00 0.00 61.69 60.46 2bys s THR 160 Cb 0.10 -1.05 0.19 0.00 -1.51 0.00 0.00 72.50 70.23 2bys s THR 160 CO 0.76 -0.16 1.48 -0.90 -2.21 0.00 0.00 174.62 173.58 2bys n ASP 161 N -0.02 1.03 -4.65 8.08 5.75 -1.26 -4.75 116.55 120.74 2bys n ASP 161 Ca -0.17 -0.85 -0.38 0.00 -0.01 0.00 0.00 54.79 53.38 2bys n ASP 161 Cb 0.63 0.21 -0.09 0.00 -1.03 0.00 0.00 41.12 40.83 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 -2.59 4.08 0.31 0.11 -1.52 -1.26 -0.78 119.66 118.00 2bys s GLN 162 Ca 0.21 -0.10 -0.29 0.00 -1.95 0.00 0.00 55.36 53.23 2bys s GLN 162 Cb 0.19 -3.57 -0.11 0.00 -0.22 0.00 0.00 33.01 29.30 2bys s GLN 162 CO 0.56 -0.05 1.46 0.08 -0.25 0.00 0.00 175.29 177.09 2bys s VAL 163 N 1.37 2.39 -0.15 1.09 1.01 -0.78 -4.84 120.40 120.49 2bys s VAL 163 Ca 0.12 0.36 -0.29 0.00 0.00 0.00 0.00 61.98 62.16 2bys s VAL 163 Cb -0.15 -3.23 -0.03 0.00 0.00 0.00 0.00 36.38 32.98 2bys s VAL 163 CO 0.07 0.07 1.45 -0.62 0.00 0.00 0.00 175.10 176.07 2bys s ASP 164 N 0.10 6.73 -0.01 3.32 -1.08 -0.48 -4.87 116.67 120.39 2bys s ASP 164 Ca 0.57 1.81 0.08 0.00 -0.52 0.00 0.00 52.55 54.48 2bys s ASP 164 Cb -0.44 -2.54 0.23 0.00 -1.46 0.00 0.00 42.92 38.72 2bys s ASP 164 CO 0.51 -0.93 1.19 0.18 0.52 0.00 0.00 175.17 176.64 2bys n LEU 165 N 7.19 2.70 0.14 -1.34 4.77 -1.26 -1.97 117.00 127.23 2bys n LEU 165 Ca 0.16 -2.04 0.13 0.00 -0.03 0.00 0.00 56.01 54.22 2bys n LEU 165 Cb 0.44 -0.18 0.47 0.00 -2.33 0.00 0.00 43.42 41.82 2bys n LEU 165 CO 0.60 0.67 0.88 0.77 -1.33 0.00 0.00 177.39 178.98 2bys h SER 166 N 1.45 0.00 -0.38 -1.43 4.64 -1.89 -2.39 113.55 113.55 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 0.69 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.78 2bys h SER 166 CO 0.01 0.00 0.00 -1.20 -0.87 0.00 0.00 176.83 174.77 2bys n SER 167 N -2.37 3.59 -4.72 4.97 7.64 -1.26 -5.02 113.62 116.44 2bys n SER 167 Ca 0.03 -2.42 -0.42 0.00 1.01 0.00 0.00 58.87 57.07 2bys n SER 167 Cb 0.32 -0.40 -0.03 0.00 -1.01 0.00 0.00 64.21 63.09 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 -1.76 3.21 -0.17 1.43 5.04 -0.90 -4.54 117.35 119.65 2bys s TYR 168 Ca 0.35 0.97 -0.29 0.00 -2.44 0.00 0.00 57.07 55.66 2bys s TYR 168 Cb 0.23 -3.71 -0.05 0.00 0.35 0.00 0.00 41.96 38.79 2bys s TYR 168 CO 0.15 -2.43 1.98 -0.47 -1.34 0.00 0.00 175.55 173.45 2bys s TYR 169 N 0.83 1.46 0.51 4.97 5.04 0.94 -4.85 117.35 126.26 2bys s TYR 169 Ca 0.63 0.31 0.33 0.00 -2.44 0.00 0.00 57.07 55.91 2bys s TYR 169 Cb -0.38 -4.04 1.82 0.00 0.35 0.00 0.00 41.96 39.71 2bys s TYR 169 CO 0.33 -4.06 2.20 0.00 -1.34 0.00 0.00 175.55 172.68 2bys h ALA 170 N 12.85 1.26 -0.38 3.97 0.00 -1.90 -2.03 119.26 133.03 2bys h ALA 170 Ca -0.41 -0.04 -0.14 0.00 0.00 0.00 0.00 54.91 54.32 2bys h ALA 170 Cb 1.21 -0.01 -0.08 0.00 0.00 0.00 0.00 17.79 18.91 2bys h ALA 170 CO 0.97 0.05 0.02 0.43 0.00 0.00 0.00 179.25 180.72 2bys n SER 171 N -3.51 3.15 -4.60 0.00 7.64 -1.26 -5.03 113.62 110.01 2bys n SER 171 Ca -0.02 -3.47 -0.33 0.00 1.01 0.00 0.00 58.87 56.05 2bys n SER 171 Cb 0.15 -0.62 0.12 0.00 -1.01 0.00 0.00 64.21 62.85 2bys n SER 171 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2bys n SER 172 N -0.88 -0.01 0.25 6.43 2.88 -0.77 -4.90 113.62 116.63 2bys n SER 172 Ca 0.31 0.51 0.11 0.00 -1.33 0.00 0.00 58.87 58.47 2bys n SER 172 Cb 1.04 -1.40 0.64 0.00 -0.75 0.00 0.00 64.21 63.75 2bys n SER 172 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 2bys h LYS 173 N -1.09 0.00 -5.41 -1.46 1.79 -1.90 -3.44 116.57 105.05 2bys h LYS 173 Ca -0.45 0.00 -0.67 0.00 -2.18 0.00 0.00 60.65 57.34 2bys h LYS 173 Cb 1.30 0.00 -0.31 0.00 -1.58 0.00 0.00 32.23 31.64 2bys h LYS 173 CO 0.42 0.16 -0.85 0.71 -1.08 0.00 0.00 179.45 178.82 2bys s TYR 174 N -4.22 2.62 0.07 -1.35 2.02 -1.26 -0.49 117.35 114.75 2bys s TYR 174 Ca -0.03 -0.90 -0.20 0.00 -0.37 0.00 0.00 57.07 55.58 2bys s TYR 174 Cb 0.13 -1.73 -0.07 0.00 -0.40 0.00 0.00 41.96 39.89 2bys s TYR 174 CO 0.62 -0.34 0.58 -2.00 -1.57 0.00 0.00 175.55 172.84 2bys s GLU 175 N 0.28 4.22 -0.19 -0.62 2.12 0.52 -4.80 118.70 120.23 2bys s GLU 175 Ca -0.15 0.75 -0.20 0.00 0.36 0.00 0.00 54.97 55.74 2bys s GLU 175 Cb -0.17 -3.24 -0.03 0.00 0.26 0.00 0.00 34.13 30.95 2bys s GLU 175 CO 0.08 0.63 0.58 0.42 -0.54 0.00 0.00 175.26 176.42 2bys s ILE 176 N -1.08 5.07 -0.14 -3.70 -1.09 -1.26 -1.99 121.20 117.00 2bys s ILE 176 Ca 0.29 1.08 0.08 0.00 -2.23 0.00 0.00 60.65 59.87 2bys s ILE 176 Cb -0.20 -3.90 -0.23 0.00 -1.58 0.00 0.00 42.46 36.56 2bys s ILE 176 CO 0.19 0.16 0.27 0.18 -1.23 0.00 0.00 174.94 174.51 2bys n LEU 177 N 4.80 1.44 -3.45 2.97 4.77 -0.10 -4.99 117.00 122.44 2bys n LEU 177 Ca -0.03 0.16 -0.13 0.00 -0.03 0.00 0.00 56.01 55.97 2bys n LEU 177 Cb 0.50 -0.24 -0.03 0.00 -2.33 0.00 0.00 43.42 41.32 2bys n LEU 177 CO 0.43 0.63 0.40 -0.94 -1.33 0.00 0.00 177.39 176.58 2bys s SER 178 N -6.23 -0.58 -0.26 -1.43 1.04 -1.13 -4.97 113.70 100.14 2bys s SER 178 Ca -0.16 0.16 -0.04 0.00 0.48 0.00 0.00 55.95 56.39 2bys s SER 178 Cb 0.07 0.58 0.14 0.00 0.10 0.00 0.00 66.02 66.92 2bys s SER 178 CO 0.77 -0.88 0.49 0.00 0.98 0.00 0.00 173.24 174.60 2bys s ALA 179 N -3.14 -1.58 0.23 5.32 0.00 -1.26 -1.95 121.76 119.38 2bys s ALA 179 Ca -0.02 1.49 0.11 0.00 0.00 0.00 0.00 51.96 53.54 2bys s ALA 179 Cb -0.01 -1.77 -0.05 0.00 0.00 0.00 0.00 23.12 21.30 2bys s ALA 179 CO -0.08 -1.14 -0.20 0.95 0.00 0.00 0.00 175.76 175.29 2bys s THR 180 N 2.70 2.27 -0.10 0.00 -4.23 -0.43 -1.87 115.64 113.98 2bys s THR 180 Ca 0.10 -2.21 -0.01 0.00 -1.18 0.00 0.00 61.69 58.39 2bys s THR 180 Cb -0.14 -2.16 0.03 0.00 1.34 0.00 0.00 72.50 71.57 2bys s THR 180 CO -0.17 -0.33 -0.02 0.00 -0.54 0.00 0.00 174.62 173.56 2bys s GLN 181 N -3.19 0.93 -0.03 3.99 -2.07 0.04 -1.31 119.66 118.02 2bys s GLN 181 Ca 0.25 -0.08 0.00 0.00 -1.82 0.00 0.00 55.36 53.71 2bys s GLN 181 Cb -0.05 -1.31 0.03 0.00 -1.09 0.00 0.00 33.01 30.58 2bys s GLN 181 CO 0.11 -0.33 0.01 0.99 -1.32 0.00 0.00 175.29 174.75 2bys s THR 182 N 1.87 0.15 0.22 3.63 2.01 -0.58 -4.29 115.64 118.64 2bys s THR 182 Ca 0.04 0.12 -0.30 0.00 0.31 0.00 0.00 61.69 61.86 2bys s THR 182 Cb -0.13 -0.26 -0.10 0.00 0.01 0.00 0.00 72.50 72.03 2bys s THR 182 CO -0.07 0.15 1.43 -0.60 -0.69 0.00 0.00 174.62 174.85 2bys s ARG 183 N 1.14 4.28 0.18 4.92 3.52 -1.26 -0.31 118.95 131.42 2bys s ARG 183 Ca -0.08 2.26 0.03 0.00 -0.13 0.00 0.00 55.73 57.81 2bys s ARG 183 Cb -0.13 -3.14 -0.05 0.00 -1.56 0.00 0.00 34.95 30.07 2bys s ARG 183 CO -0.02 -0.42 -0.03 -0.65 -0.81 0.00 0.00 175.30 173.37 2bys s GLN 184 N -0.03 1.14 -0.10 5.12 -0.21 0.86 -4.93 119.66 121.51 2bys s GLN 184 Ca 0.61 -1.54 -0.00 0.00 0.02 0.00 0.00 55.36 54.45 2bys s GLN 184 Cb -0.41 -0.44 0.02 0.00 1.00 0.00 0.00 33.01 33.18 2bys s GLN 184 CO 0.40 -0.07 -0.07 0.08 -2.12 0.00 0.00 175.29 173.51 2bys s VAL 185 N -3.51 0.95 0.14 1.09 1.01 -1.26 -1.64 120.40 117.17 2bys s VAL 185 Ca 0.23 -0.27 0.02 0.00 0.00 0.00 0.00 61.98 61.96 2bys s VAL 185 Cb 0.05 -0.97 -0.04 0.00 0.00 0.00 0.00 36.38 35.42 2bys s VAL 185 CO 0.04 0.35 -0.04 -1.58 0.00 0.00 0.00 175.10 173.87 2bys s GLN 186 N 1.52 0.98 0.19 2.72 2.00 -0.85 -4.98 119.66 121.23 2bys s GLN 186 Ca 0.01 -1.44 0.07 0.00 -2.00 0.00 0.00 55.36 52.00 2bys s GLN 186 Cb -0.13 -0.27 -0.04 0.00 0.80 0.00 0.00 33.01 33.37 2bys s GLN 186 CO -0.06 -0.06 0.03 -1.01 -0.50 0.00 0.00 175.29 173.69 2bys s HIS 187 N -3.62 2.88 0.06 1.67 3.76 -1.26 -1.25 115.29 117.53 2bys s HIS 187 Ca 0.18 -0.13 0.02 0.00 -0.15 0.00 0.00 55.06 54.98 2bys s HIS 187 Cb 0.05 -1.38 -0.03 0.00 1.11 0.00 0.00 32.58 32.34 2bys s HIS 187 CO -0.00 0.53 -0.08 0.71 -0.85 0.00 0.00 174.74 175.05 2bys s TYR 188 N -1.81 0.73 0.38 1.40 1.51 -1.26 -4.99 117.35 113.31 2bys s TYR 188 Ca 0.29 -0.59 0.08 0.00 -1.01 0.00 0.00 57.07 55.84 2bys s TYR 188 Cb -0.09 -0.44 0.82 0.00 -0.11 0.00 0.00 41.96 42.15 2bys s TYR 188 CO 0.20 -0.09 1.96 0.77 -1.11 0.00 0.00 175.55 177.27 2bys h SER 189 N 4.16 0.59 -0.14 2.29 0.02 -2.00 -2.61 113.55 115.85 2bys h SER 189 Ca -0.36 0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 60.59 2bys h SER 189 Cb 1.19 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 63.61 2bys h SER 189 CO 0.46 0.37 0.07 0.00 -1.14 0.00 0.00 176.83 176.58 2bys h PRO 192 N 6.32 0.81 -6.84 0.00 0.11 -1.90 -3.38 132.00 127.11 2bys h PRO 192 Ca -0.31 -0.09 -0.50 0.00 0.11 0.00 0.00 66.00 65.21 2bys h PRO 192 Cb 1.18 -0.16 0.02 0.00 0.11 0.00 0.00 31.00 32.15 2bys h PRO 192 CO 0.39 0.61 0.46 -1.21 -0.21 0.00 0.00 178.00 178.04 2bys s GLU 193 N -5.52 4.52 0.45 1.05 8.01 -1.26 -4.95 118.70 120.99 2bys s GLU 193 Ca -0.10 1.75 -0.21 0.00 0.01 0.00 0.00 54.97 56.42 2bys s GLU 193 Cb 0.17 -3.04 -0.09 0.00 -4.31 0.00 0.00 34.13 26.86 2bys s GLU 193 CO 0.77 0.12 1.02 -1.25 0.01 0.00 0.00 175.26 175.93 2bys s PRO 194 N -1.70 3.98 -0.04 0.39 0.04 -1.26 -4.63 135.00 131.78 2bys s PRO 194 Ca 0.48 1.33 0.03 0.00 0.04 0.00 0.00 61.00 62.88 2bys s PRO 194 Cb -0.30 -2.21 -0.03 0.00 0.04 0.00 0.00 34.50 32.00 2bys s PRO 194 CO 0.38 -0.27 -0.13 0.71 0.04 0.00 0.00 177.00 177.73 2bys s TYR 195 N -1.96 2.74 -0.02 0.56 2.02 -0.38 -0.22 117.35 120.09 2bys s TYR 195 Ca 0.64 -0.13 -0.13 0.00 -0.37 0.00 0.00 57.07 57.08 2bys s TYR 195 Cb -0.16 -1.63 -0.05 0.00 -0.40 0.00 0.00 41.96 39.72 2bys s TYR 195 CO 0.20 0.23 0.36 0.42 -1.57 0.00 0.00 175.55 175.19 2bys s ILE 196 N -0.79 5.11 0.12 2.71 -1.09 -1.26 -2.01 121.20 123.99 2bys s ILE 196 Ca 0.12 0.73 0.03 0.00 -2.23 0.00 0.00 60.65 59.31 2bys s ILE 196 Cb -0.11 -3.66 -0.04 0.00 -1.58 0.00 0.00 42.46 37.07 2bys s ILE 196 CO 0.02 0.58 -0.08 1.51 -1.23 0.00 0.00 174.94 175.73 2bys s ASP 197 N -1.04 1.45 -0.21 3.58 1.47 -0.65 -4.28 116.67 116.99 2bys s ASP 197 Ca 0.22 -0.99 -0.04 0.00 1.18 0.00 0.00 52.55 52.92 2bys s ASP 197 Cb -0.16 0.04 -0.01 0.00 -0.34 0.00 0.00 42.92 42.45 2bys s ASP 197 CO 0.12 -0.39 -0.03 -0.69 0.68 0.00 0.00 175.17 174.86 2bys s VAL 198 N -3.39 3.53 -0.26 2.11 1.01 0.00 -0.10 120.40 123.31 2bys s VAL 198 Ca 0.13 -0.45 -0.12 0.00 0.00 0.00 0.00 61.98 61.55 2bys s VAL 198 Cb 0.03 -2.60 -0.05 0.00 0.00 0.00 0.00 36.38 33.77 2bys s VAL 198 CO -0.02 0.43 0.21 0.21 0.00 0.00 0.00 175.10 175.93 2bys s ASN 199 N 1.29 6.11 -0.35 3.32 2.47 0.57 -1.11 114.94 127.25 2bys s ASN 199 Ca 0.04 0.11 -0.13 0.00 0.42 0.00 0.00 52.86 53.30 2bys s ASN 199 Cb -0.14 -2.13 -0.00 0.00 -1.45 0.00 0.00 41.25 37.52 2bys s ASN 199 CO -0.01 -0.02 0.23 -0.22 -3.72 0.00 0.00 177.10 173.36 2bys s LEU 200 N 1.48 4.60 -0.16 3.21 2.96 0.36 -1.53 118.68 129.60 2bys s LEU 200 Ca 0.09 -0.60 -0.01 0.00 -0.22 0.00 0.00 54.13 53.39 2bys s LEU 200 Cb -0.15 -2.11 -0.01 0.00 0.50 0.00 0.00 46.19 44.43 2bys s LEU 200 CO 0.08 -0.29 -0.13 -0.69 -1.32 0.00 0.00 176.35 174.00 2bys s VAL 201 N 1.68 2.90 -0.07 1.68 1.01 -0.43 -0.76 120.40 126.41 2bys s VAL 201 Ca 0.05 -0.69 0.01 0.00 0.00 0.00 0.00 61.98 61.35 2bys s VAL 201 Cb -0.18 -2.24 0.02 0.00 0.00 0.00 0.00 36.38 33.98 2bys s VAL 201 CO 0.09 0.50 -0.06 0.68 0.00 0.00 0.00 175.10 176.31 2bys s VAL 202 N 0.83 0.78 -0.13 2.92 -7.23 -0.20 -1.31 120.40 116.06 2bys s VAL 202 Ca -0.04 -0.21 -0.05 0.00 -1.81 0.00 0.00 61.98 59.87 2bys s VAL 202 Cb -0.15 -0.79 -0.04 0.00 0.56 0.00 0.00 36.38 35.96 2bys s VAL 202 CO 0.00 0.30 0.06 -0.75 -0.31 0.00 0.00 175.10 174.40 2bys s LYS 203 N 1.25 3.49 0.10 4.82 2.20 -0.82 -1.27 119.74 129.52 2bys s LYS 203 Ca -0.05 -0.31 -0.18 0.00 -0.36 0.00 0.00 55.97 55.08 2bys s LYS 203 Cb -0.14 -3.06 0.04 0.00 -1.51 0.00 0.00 37.83 33.16 2bys s LYS 203 CO -0.02 0.56 0.43 -0.59 -0.36 0.00 0.00 175.35 175.37 2bys s PHE 204 N -0.45 -0.27 0.20 4.03 -0.12 0.16 -0.92 117.98 120.61 2bys s PHE 204 Ca 0.10 0.06 -0.13 0.00 -0.05 0.00 0.00 56.93 56.90 2bys s PHE 204 Cb -0.12 0.29 0.01 0.00 -0.63 0.00 0.00 43.02 42.56 2bys s PHE 204 CO 0.02 -0.68 0.43 -0.98 -0.05 0.00 0.00 175.22 173.96 2bys s ARG 205 N -3.37 1.34 0.29 1.99 1.70 -0.84 -0.15 118.95 119.91 2bys s ARG 205 Ca 0.00 -1.06 -0.29 0.00 -0.47 0.00 0.00 55.73 53.90 2bys s ARG 205 Cb 0.01 0.46 -0.10 0.00 -0.57 0.00 0.00 34.95 34.75 2bys s ARG 205 CO -0.09 -0.54 1.33 -1.21 -1.08 0.00 0.00 175.30 173.71 2bys s GLU 206 N -3.94 4.35 0.20 3.89 2.02 -0.31 -0.35 118.70 124.56 2bys s GLU 206 Ca 0.15 2.19 -0.30 0.00 0.02 0.00 0.00 54.97 57.03 2bys s GLU 206 Cb 0.01 -3.10 -0.08 0.00 0.10 0.00 0.00 34.13 31.05 2bys s GLU 206 CO 0.01 -0.23 1.13 0.50 0.02 0.00 0.00 175.26 176.68 2bys s ARG 207 N -1.21 4.57 0.00 1.61 3.52 0.36 -4.71 118.95 123.09 2bys s ARG 207 Ca 0.52 1.78 0.00 0.00 -0.13 0.00 0.00 55.73 57.90 2bys s ARG 207 Cb -0.39 -3.25 0.00 0.00 -1.56 0.00 0.00 34.95 29.75 2bys s ARG 207 CO 0.48 0.05 0.00 0.54 -0.81 0.00 0.00 175.30 175.56