#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bdl s PRO 2 N 0.00 1.87 0.44 0.00 0.04 -1.26 -4.94 135.00 131.14 2bdl s PRO 2 Ca 0.00 1.28 0.21 0.00 0.04 0.00 0.00 61.00 62.53 2bdl s PRO 2 Cb 0.00 -1.84 1.00 0.00 0.04 0.00 0.00 34.50 33.69 2bdl s PRO 2 CO 0.00 -1.95 1.89 -0.44 0.04 0.00 0.00 177.00 176.54 2bdl h ASP 3 N -1.36 0.00 -3.74 6.66 3.45 -2.02 -3.45 116.42 115.96 2bdl h ASP 3 Ca -0.43 0.00 -0.08 0.00 0.43 0.00 0.00 57.03 56.94 2bdl h ASP 3 Cb 1.24 0.00 -0.23 0.00 -0.56 0.00 0.00 39.33 39.78 2bdl h ASP 3 CO 0.48 0.26 -0.10 -0.55 -1.57 0.00 0.00 179.24 177.77 2bdl s SER 4 N -6.43 -0.60 -0.16 6.45 0.15 -1.26 -4.52 113.70 107.33 2bdl s SER 4 Ca -0.02 1.11 -0.14 0.00 0.70 0.00 0.00 55.95 57.60 2bdl s SER 4 Cb 0.12 1.09 0.04 0.00 -1.71 0.00 0.00 66.02 65.57 2bdl s SER 4 CO 0.65 -0.19 0.42 0.54 1.20 0.00 0.00 173.24 175.86 2bdl s VAL 5 N 0.58 -0.00 -0.28 4.45 0.11 -0.42 -5.01 120.40 119.82 2bdl s VAL 5 Ca -0.02 0.01 -0.00 0.00 -2.93 0.00 0.00 61.98 59.04 2bdl s VAL 5 Cb -0.05 -0.60 0.09 0.00 -1.53 0.00 0.00 36.38 34.30 2bdl s VAL 5 CO -0.03 0.01 0.05 -0.62 -3.33 0.00 0.00 175.10 171.17 2bdl s ASP 6 N 0.41 3.94 0.17 3.54 -1.08 -1.26 -1.64 116.67 120.75 2bdl s ASP 6 Ca -0.02 -1.50 0.21 0.00 -0.52 0.00 0.00 52.55 50.72 2bdl s ASP 6 Cb -0.04 -1.00 0.87 0.00 -1.46 0.00 0.00 42.92 41.29 2bdl s ASP 6 CO -0.02 -0.36 1.65 -1.22 0.52 0.00 0.00 175.17 175.74 2bdl n TYR 7 N 4.75 0.55 -0.12 -5.34 4.01 -0.62 -2.13 117.16 118.26 2bdl n TYR 7 Ca -0.04 0.21 -0.02 0.00 -0.16 0.00 0.00 57.90 57.89 2bdl n TYR 7 Cb 0.43 -0.84 0.21 0.00 -0.31 0.00 0.00 39.34 38.83 2bdl n TYR 7 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2bdl h ARG 8 N 0.00 0.81 0.00 -0.72 3.08 -1.94 -2.28 114.38 113.33 2bdl h ARG 8 Ca 0.00 -0.15 0.00 0.00 0.07 0.00 0.00 59.98 59.90 2bdl h ARG 8 Cb 0.36 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.28 2bdl h ARG 8 CO 0.00 0.71 0.00 1.63 -1.07 0.00 0.00 179.97 181.24 2bdl n LYS 9 N -4.30 0.00 0.00 0.04 5.02 -0.90 -2.86 118.16 115.16 2bdl n LYS 9 Ca 0.04 0.04 0.13 0.00 -2.02 0.00 0.00 58.31 56.49 2bdl n LYS 9 Cb 0.20 -1.50 0.26 0.00 -0.02 0.00 0.00 35.03 33.97 2bdl n LYS 9 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2bdl n LYS 10 N -1.50 2.03 -1.74 1.97 5.02 -0.92 -4.97 118.16 118.04 2bdl n LYS 10 Ca 0.07 -1.52 -0.06 0.00 -2.02 0.00 0.00 58.31 54.78 2bdl n LYS 10 Cb 0.32 -1.47 -0.01 0.00 -0.02 0.00 0.00 35.03 33.85 2bdl n LYS 10 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2bdl n GLY 11 N 1.29 0.40 0.04 0.72 0.00 -1.13 -4.95 105.19 101.55 2bdl n GLY 11 Ca 0.16 -0.71 0.11 0.00 0.00 0.00 0.00 46.02 45.58 2bdl n GLY 11 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2bdl n TYR 12 N -3.56 0.00 -4.86 1.61 0.53 -0.91 -4.77 117.16 105.21 2bdl n TYR 12 Ca -0.06 0.00 -0.32 0.00 -1.02 0.00 0.00 57.90 56.50 2bdl n TYR 12 Cb 0.41 -0.13 -0.17 0.00 -1.03 0.00 0.00 39.34 38.42 2bdl n TYR 12 CO 0.00 0.00 0.00 0.08 -1.02 0.00 0.00 176.86 175.92 2bdl s VAL 13 N -2.94 1.99 0.79 -0.72 1.01 -1.26 -3.90 120.40 115.38 2bdl s VAL 13 Ca 0.11 -0.96 -0.12 0.00 0.00 0.00 0.00 61.98 61.02 2bdl s VAL 13 Cb 0.17 -1.75 0.07 0.00 0.00 0.00 0.00 36.38 34.86 2bdl s VAL 13 CO 0.75 0.54 1.11 0.42 0.00 0.00 0.00 175.10 177.92 2bdl s THR 14 N 0.65 2.98 0.70 3.92 -4.23 -1.26 -4.98 115.64 113.42 2bdl s THR 14 Ca -0.12 0.32 -0.16 0.00 -1.18 0.00 0.00 61.69 60.55 2bdl s THR 14 Cb -0.16 -3.14 -0.01 0.00 1.34 0.00 0.00 72.50 70.53 2bdl s THR 14 CO 0.02 -0.42 0.98 -2.65 -0.54 0.00 0.00 174.62 172.01 2bdl n PRO 15 N -3.37 0.61 -1.82 3.99 -0.02 -1.26 -4.93 135.00 128.20 2bdl n PRO 15 Ca 0.07 0.26 -0.42 0.00 -2.02 0.00 0.00 63.50 61.40 2bdl n PRO 15 Cb 0.57 -2.23 -0.02 0.00 -0.02 0.00 0.00 33.50 31.81 2bdl n PRO 15 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2bdl s VAL 16 N -1.74 2.20 0.36 -1.45 1.01 -1.26 -5.03 120.40 114.49 2bdl s VAL 16 Ca 0.74 0.16 0.07 0.00 0.00 0.00 0.00 61.98 62.96 2bdl s VAL 16 Cb -0.36 -3.10 -0.02 0.00 0.00 0.00 0.00 36.38 32.90 2bdl s VAL 16 CO 0.49 0.02 0.37 -0.54 0.00 0.00 0.00 175.10 175.44 2bdl s LYS 17 N -0.16 2.77 -0.25 2.72 -0.14 -1.26 -4.67 119.74 118.76 2bdl s LYS 17 Ca 0.65 -1.29 0.03 0.00 -1.36 0.00 0.00 55.97 53.99 2bdl s LYS 17 Cb -0.47 -2.55 0.05 0.00 -1.68 0.00 0.00 37.83 33.19 2bdl s LYS 17 CO 0.44 -0.00 -0.12 1.21 -0.76 0.00 0.00 175.35 176.12 2bdl s ASN 18 N -4.09 4.20 0.16 2.83 3.84 -1.26 -1.08 114.94 119.55 2bdl s ASN 18 Ca 0.44 -1.27 0.23 0.00 0.21 0.00 0.00 52.86 52.47 2bdl s ASN 18 Cb -0.06 -1.51 0.89 0.00 -0.55 0.00 0.00 41.25 40.02 2bdl s ASN 18 CO 0.28 -0.16 1.70 0.00 -2.79 0.00 0.00 177.10 176.12 2bdl n GLN 19 N 4.48 0.14 0.00 0.43 10.64 -0.35 -4.93 117.38 127.79 2bdl n GLN 19 Ca -0.15 0.29 0.00 0.00 -1.83 0.00 0.00 57.00 55.31 2bdl n GLN 19 Cb 0.43 -1.73 0.00 0.00 -0.86 0.00 0.00 30.24 28.08 2bdl n GLN 19 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2bdl n GLY 20 N 0.47 1.18 2.59 2.61 0.00 -1.26 -3.79 105.19 106.99 2bdl n GLY 20 Ca 0.04 -0.58 -0.41 0.00 0.00 0.00 0.00 46.02 45.07 2bdl n GLY 20 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2bdl n GLN 21 N 0.99 4.53 -3.70 1.61 1.13 -1.26 -4.83 117.38 115.85 2bdl n GLN 21 Ca 0.00 -3.68 -0.12 0.00 -1.94 0.00 0.00 57.00 51.27 2bdl n GLN 21 Cb 0.00 -2.66 -0.12 0.00 0.11 0.00 0.00 30.24 27.57 2bdl n GLN 21 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2bdl n GLY 23 N 4.47 3.17 0.92 0.00 0.00 -0.06 -4.49 105.19 109.21 2bdl n GLY 23 Ca -0.21 -0.92 0.08 0.00 0.00 0.00 0.00 46.02 44.98 2bdl n GLY 23 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2bdl n SER 24 N 4.37 3.90 -0.34 1.61 3.41 -1.26 -2.70 113.62 122.60 2bdl n SER 24 Ca 0.47 -2.92 0.19 0.00 -0.26 0.00 0.00 58.87 56.35 2bdl n SER 24 Cb 0.15 -0.52 0.42 0.00 -0.26 0.00 0.00 64.21 64.00 2bdl n SER 24 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2bdl h TRP 26 N 0.53 0.43 -0.08 0.00 5.08 -1.83 0.42 115.95 120.49 2bdl h TRP 26 Ca 0.63 -0.02 -0.19 0.00 1.08 0.00 0.00 58.89 60.40 2bdl h TRP 26 Cb 1.31 -0.13 0.01 0.00 -3.00 0.00 0.00 29.16 27.35 2bdl h TRP 26 CO -0.01 0.37 -0.68 0.00 -1.28 0.00 0.00 178.44 176.85 2bdl h ALA 27 N 1.67 0.19 -0.55 0.11 0.00 -1.36 -1.70 119.26 117.62 2bdl h ALA 27 Ca 0.10 -0.57 -0.08 0.00 0.00 0.00 0.00 54.91 54.36 2bdl h ALA 27 Cb 0.14 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 2bdl h ALA 27 CO -0.01 0.50 0.03 0.74 0.00 0.00 0.00 179.25 180.51 2bdl h PHE 28 N 0.23 1.00 -0.50 0.00 -1.00 -1.20 -0.26 116.94 115.21 2bdl h PHE 28 Ca -0.06 -0.15 -0.02 0.00 2.81 0.00 0.00 57.97 60.56 2bdl h PHE 28 Cb 1.33 -0.27 -0.02 0.00 3.61 0.00 0.00 35.95 40.60 2bdl h PHE 28 CO 0.11 0.88 0.25 1.03 -1.61 0.00 0.00 178.31 178.97 2bdl h SER 29 N 0.87 0.65 0.03 2.17 0.87 -0.93 -1.47 113.55 115.73 2bdl h SER 29 Ca 0.17 -0.12 -0.00 0.00 -1.23 0.00 0.00 61.79 60.60 2bdl h SER 29 Cb 0.47 -0.17 0.00 0.00 -0.44 0.00 0.00 62.40 62.27 2bdl h SER 29 CO 0.02 0.59 -0.01 0.28 -0.53 0.00 0.00 176.83 177.18 2bdl h SER 30 N 0.66 -0.03 -0.98 6.23 0.02 -1.08 -2.57 113.55 115.80 2bdl h SER 30 Ca 0.17 -0.30 0.10 0.00 -0.84 0.00 0.00 61.79 60.92 2bdl h SER 30 Cb 0.11 0.01 -0.08 0.00 0.14 0.00 0.00 62.40 62.58 2bdl h SER 30 CO -0.02 0.29 0.61 0.58 -1.14 0.00 0.00 176.83 177.15 2bdl h VAL 31 N -0.35 0.96 -0.47 2.27 2.07 -1.07 -0.92 116.25 118.73 2bdl h VAL 31 Ca -0.00 -0.35 0.00 0.00 0.82 0.00 0.00 66.70 67.17 2bdl h VAL 31 Cb 0.33 -0.14 -0.02 0.00 -1.52 0.00 0.00 31.29 29.94 2bdl h VAL 31 CO 0.01 0.18 0.30 1.23 0.02 0.00 0.00 177.57 179.31 2bdl h GLY 32 N 1.01 0.68 1.01 2.17 0.00 -1.15 0.22 103.07 107.01 2bdl h GLY 32 Ca 0.47 -0.27 -0.07 0.00 0.00 0.00 0.00 47.33 47.46 2bdl h GLY 32 CO -0.24 0.26 0.07 0.00 0.00 0.00 0.00 176.54 176.63 2bdl h ALA 33 N 1.15 0.73 -0.69 3.60 0.00 -1.05 -2.67 119.26 120.33 2bdl h ALA 33 Ca 0.17 -0.26 -0.07 0.00 0.00 0.00 0.00 54.91 54.76 2bdl h ALA 33 Cb -0.04 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.52 2bdl h ALA 33 CO -0.03 0.49 0.17 -0.07 0.00 0.00 0.00 179.25 179.80 2bdl h LEU 34 N 0.80 1.05 -1.15 0.00 3.38 -0.87 -2.66 115.31 115.86 2bdl h LEU 34 Ca 0.16 -0.22 0.01 0.00 0.09 0.00 0.00 57.88 57.92 2bdl h LEU 34 Cb 0.44 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.87 2bdl h LEU 34 CO 0.01 1.00 0.57 -0.33 0.09 0.00 0.00 178.44 179.78 2bdl h GLU 35 N 1.05 1.13 -0.32 1.13 5.08 -0.46 -0.63 114.58 121.56 2bdl h GLU 35 Ca 0.22 -0.07 -0.08 0.00 -1.00 0.00 0.00 59.36 58.43 2bdl h GLU 35 Cb 0.37 -0.25 -0.01 0.00 0.50 0.00 0.00 28.75 29.35 2bdl h GLU 35 CO 0.00 0.75 -0.11 0.78 -1.00 0.00 0.00 179.01 179.44 2bdl h GLY 36 N 1.17 0.69 1.87 -3.84 0.00 -1.31 -2.23 103.07 99.42 2bdl h GLY 36 Ca 0.31 -0.59 -0.09 0.00 0.00 0.00 0.00 47.33 46.97 2bdl h GLY 36 CO -0.07 0.54 -0.35 1.46 0.00 0.00 0.00 176.54 178.12 2bdl h GLN 37 N 0.41 0.15 -0.34 4.80 1.08 -1.23 -2.21 115.11 117.77 2bdl h GLN 37 Ca 0.08 -0.06 -0.05 0.00 -1.45 0.00 0.00 58.65 57.16 2bdl h GLN 37 Cb 0.61 -0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 28.02 2bdl h GLN 37 CO 0.04 0.49 0.00 1.25 -0.95 0.00 0.00 178.83 179.66 2bdl h LEU 38 N 0.13 0.58 -0.49 1.46 5.85 -1.02 -2.05 115.31 119.77 2bdl h LEU 38 Ca 0.02 -0.30 0.02 0.00 0.84 0.00 0.00 57.88 58.45 2bdl h LEU 38 Cb 0.69 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 41.53 2bdl h LEU 38 CO 0.05 0.74 0.30 0.50 -0.34 0.00 0.00 178.44 179.69 2bdl h LYS 39 N 0.40 0.58 -0.74 1.25 1.63 -1.20 -0.43 116.57 118.06 2bdl h LYS 39 Ca 0.10 -0.03 -0.03 0.00 -0.85 0.00 0.00 60.65 59.83 2bdl h LYS 39 Cb 0.44 -0.13 -0.03 0.00 -0.60 0.00 0.00 32.23 31.91 2bdl h LYS 39 CO 0.02 0.38 0.33 -0.22 -3.45 0.00 0.00 179.45 176.51 2bdl h LYS 40 N 0.59 1.08 0.09 1.90 3.64 -1.36 0.44 116.57 122.95 2bdl h LYS 40 Ca 0.19 -0.17 -0.19 0.00 -1.27 0.00 0.00 60.65 59.21 2bdl h LYS 40 Cb 0.00 -0.19 0.02 0.00 -0.41 0.00 0.00 32.23 31.65 2bdl h LYS 40 CO -0.08 0.86 -0.79 -0.22 -2.27 0.00 0.00 179.45 176.95 2bdl h LYS 41 N 1.05 0.38 0.00 1.90 3.64 -1.18 -3.39 116.57 118.97 2bdl h LYS 41 Ca 0.25 -0.53 -0.02 0.00 -1.27 0.00 0.00 60.65 59.08 2bdl h LYS 41 Cb 0.15 0.18 -0.00 0.00 -0.41 0.00 0.00 32.23 32.15 2bdl h LYS 41 CO -0.03 1.21 -1.72 0.25 -2.27 0.00 0.00 179.45 176.90 2bdl n THR 42 N -4.12 0.08 -0.32 1.00 -2.24 -0.19 -5.00 114.28 103.50 2bdl n THR 42 Ca -0.13 -0.37 0.00 0.00 -2.27 0.00 0.00 64.05 61.29 2bdl n THR 42 Cb 0.79 0.09 0.00 0.00 -2.10 0.00 0.00 70.33 69.11 2bdl n THR 42 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2bdl n GLY 43 N 1.68 1.06 3.60 3.38 0.00 0.14 -5.04 105.19 110.02 2bdl n GLY 43 Ca -0.04 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.64 2bdl n GLY 43 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2bdl s LYS 44 N -0.48 2.74 -0.24 1.61 1.02 -1.25 -4.96 119.74 118.18 2bdl s LYS 44 Ca 0.00 -0.56 -0.05 0.00 0.02 0.00 0.00 55.97 55.38 2bdl s LYS 44 Cb 0.00 -2.60 -0.01 0.00 -0.52 0.00 0.00 37.83 34.70 2bdl s LYS 44 CO 0.00 0.66 -0.01 -1.17 -0.92 0.00 0.00 175.35 173.91 2bdl s LEU 45 N -0.96 3.14 0.05 3.17 2.96 -1.26 -3.20 118.68 122.57 2bdl s LEU 45 Ca 0.14 -0.46 -0.08 0.00 -0.22 0.00 0.00 54.13 53.51 2bdl s LEU 45 Cb -0.11 -1.78 -0.00 0.00 0.50 0.00 0.00 46.19 44.80 2bdl s LEU 45 CO 0.03 -0.06 0.15 -1.48 -1.32 0.00 0.00 176.35 173.67 2bdl s LEU 46 N 1.49 1.57 -0.10 -0.68 0.05 -1.26 -5.09 118.68 114.66 2bdl s LEU 46 Ca 0.05 -0.50 -0.30 0.00 0.05 0.00 0.00 54.13 53.44 2bdl s LEU 46 Cb -0.15 0.81 -0.02 0.00 -2.05 0.00 0.00 46.19 44.78 2bdl s LEU 46 CO -0.02 -0.57 1.18 0.20 -0.55 0.00 0.00 176.35 176.59 2bdl s ASN 47 N -2.26 7.06 0.43 1.48 0.01 -1.26 -4.87 114.94 115.53 2bdl s ASN 47 Ca -0.03 1.71 0.04 0.00 -0.71 0.00 0.00 52.86 53.87 2bdl s ASN 47 Cb 0.00 -2.55 0.01 0.00 0.41 0.00 0.00 41.25 39.12 2bdl s ASN 47 CO -0.06 -0.61 0.62 -0.76 -1.51 0.00 0.00 177.10 174.78 2bdl s LEU 48 N 2.56 3.66 -0.44 0.60 1.43 -1.26 -1.12 118.68 124.11 2bdl s LEU 48 Ca 0.54 -0.04 -0.20 0.00 -1.03 0.00 0.00 54.13 53.40 2bdl s LEU 48 Cb -0.22 -2.89 0.03 0.00 0.03 0.00 0.00 46.19 43.13 2bdl s LEU 48 CO 0.18 -0.73 0.58 -0.55 0.23 0.00 0.00 176.35 176.06 2bdl s SER 49 N -4.27 6.28 0.32 2.29 0.15 -0.70 -4.15 113.70 113.61 2bdl s SER 49 Ca 0.50 -0.49 0.06 0.00 0.70 0.00 0.00 55.95 56.72 2bdl s SER 49 Cb -0.10 -2.29 0.56 0.00 -1.71 0.00 0.00 66.02 62.48 2bdl s SER 49 CO 0.35 -0.73 1.80 1.55 1.20 0.00 0.00 173.24 177.41 2bdl h PRO 50 N 8.85 0.38 -0.63 5.44 0.13 -1.86 -3.23 132.00 141.08 2bdl h PRO 50 Ca -0.26 -0.12 -0.02 0.00 -0.87 0.00 0.00 66.00 64.73 2bdl h PRO 50 Cb 1.10 -0.04 -0.03 0.00 0.13 0.00 0.00 31.00 32.16 2bdl h PRO 50 CO 0.87 0.56 0.32 0.37 -0.23 0.00 0.00 178.00 179.89 2bdl h GLN 51 N 0.35 0.90 -0.81 0.86 5.75 -1.85 -1.09 115.11 119.22 2bdl h GLN 51 Ca 0.06 -0.12 0.19 0.00 -0.15 0.00 0.00 58.65 58.62 2bdl h GLN 51 Cb 0.54 -0.17 -0.14 0.00 1.07 0.00 0.00 27.48 28.78 2bdl h GLN 51 CO 0.04 0.71 -0.02 -0.97 -2.65 0.00 0.00 178.83 175.93 2bdl h ASN 52 N 0.86 -0.42 -0.06 -0.69 -0.00 -1.76 -1.12 115.58 112.39 2bdl h ASN 52 Ca 0.22 0.22 -0.03 0.00 -0.00 0.00 0.00 56.30 56.71 2bdl h ASN 52 Cb 0.09 0.39 -0.00 0.00 -0.00 0.00 0.00 38.32 38.80 2bdl h ASN 52 CO -0.03 -0.22 -0.08 -0.07 -0.00 0.00 0.00 177.43 177.03 2bdl h LEU 53 N 0.08 0.16 -0.56 0.34 3.38 -1.44 -2.25 115.31 115.01 2bdl h LEU 53 Ca 0.44 -0.52 0.11 0.00 0.09 0.00 0.00 57.88 58.00 2bdl h LEU 53 Cb 0.79 -0.05 -0.10 0.00 0.09 0.00 0.00 40.66 41.40 2bdl h LEU 53 CO -0.73 0.65 -0.06 0.58 0.09 0.00 0.00 178.44 178.97 2bdl h VAL 54 N -0.32 0.50 -0.03 1.22 2.07 -0.72 -1.63 116.25 117.34 2bdl h VAL 54 Ca 0.01 -0.02 -0.21 0.00 0.82 0.00 0.00 66.70 67.30 2bdl h VAL 54 Cb 0.62 0.43 -0.00 0.00 -1.52 0.00 0.00 31.29 30.81 2bdl h VAL 54 CO 0.02 0.01 -0.85 0.44 0.02 0.00 0.00 177.57 177.21 2bdl h ASP 55 N 0.06 0.47 0.00 0.57 3.32 -1.26 -3.38 116.42 116.21 2bdl h ASP 55 Ca 0.28 -0.35 -0.03 0.00 0.02 0.00 0.00 57.03 56.94 2bdl h ASP 55 Cb 0.44 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.84 2bdl h ASP 55 CO -0.52 1.13 -1.62 0.00 -1.72 0.00 0.00 179.24 176.51 2bdl s VAL 57 N -2.79 3.63 -0.08 0.00 1.01 -0.64 -4.83 120.40 116.71 2bdl s VAL 57 Ca -0.05 0.03 0.31 0.00 0.00 0.00 0.00 61.98 62.27 2bdl s VAL 57 Cb 0.07 -4.58 0.36 0.00 0.00 0.00 0.00 36.38 32.24 2bdl s VAL 57 CO 0.52 -1.51 1.90 0.77 0.00 0.00 0.00 175.10 176.78 2bdl h SER 58 N 11.45 0.00 0.24 3.32 4.64 -1.89 -2.38 113.55 128.92 2bdl h SER 58 Ca -0.14 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.18 2bdl h SER 58 Cb 1.07 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.16 2bdl h SER 58 CO 1.28 0.00 -0.11 -0.62 -0.87 0.00 0.00 176.83 176.52 2bdl n GLU 59 N -2.91 0.92 -4.09 4.77 4.71 -1.26 -4.86 120.64 117.91 2bdl n GLU 59 Ca 0.01 -0.38 -0.26 0.00 -0.01 0.00 0.00 57.16 56.51 2bdl n GLU 59 Cb 0.31 -1.49 -0.04 0.00 -1.01 0.00 0.00 31.44 29.21 2bdl n GLU 59 CO 0.00 0.00 0.00 -0.80 0.09 0.00 0.00 177.13 176.42 2bdl s ASN 60 N -2.35 4.51 -0.32 1.62 0.01 -0.90 -4.86 114.94 112.65 2bdl s ASN 60 Ca 0.31 -1.22 0.07 0.00 -0.71 0.00 0.00 52.86 51.31 2bdl s ASN 60 Cb 0.20 0.07 0.47 0.00 0.41 0.00 0.00 41.25 42.40 2bdl s ASN 60 CO 0.45 -0.85 1.39 0.47 -1.51 0.00 0.00 177.10 177.05 2bdl n ASP 61 N -1.49 3.74 0.00 -1.22 10.43 -0.08 -4.97 116.55 122.96 2bdl n ASP 61 Ca -0.04 -3.80 0.00 0.00 2.57 0.00 0.00 54.79 53.52 2bdl n ASP 61 Cb 0.65 -0.55 0.00 0.00 1.84 0.00 0.00 41.12 43.05 2bdl n ASP 61 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2bdl n GLY 62 N -0.96 3.96 0.00 0.44 0.00 -1.23 -0.41 105.19 106.99 2bdl n GLY 62 Ca 0.38 0.19 0.08 0.00 0.00 0.00 0.00 46.02 46.66 2bdl n GLY 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bdl n GLY 64 N 0.67 3.73 0.00 0.00 0.00 0.45 -0.88 105.19 109.17 2bdl n GLY 64 Ca 0.12 -0.91 0.00 0.00 0.00 0.00 0.00 46.02 45.22 2bdl n GLY 64 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bdl n GLY 65 N -0.23 1.70 0.00 -0.02 0.00 -1.10 -4.83 105.19 100.71 2bdl n GLY 65 Ca 0.20 -2.09 0.00 0.00 0.00 0.00 0.00 46.02 44.13 2bdl n GLY 65 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bdl n GLY 66 N 0.47 0.98 3.74 -0.02 0.00 -1.26 -0.90 105.19 108.20 2bdl n GLY 66 Ca 0.00 -0.94 -0.34 0.00 0.00 0.00 0.00 46.02 44.74 2bdl n GLY 66 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2bdl s TYR 67 N -2.00 3.26 0.25 1.61 2.02 -1.26 -4.76 117.35 116.47 2bdl s TYR 67 Ca 0.00 0.24 -0.02 0.00 -0.37 0.00 0.00 57.07 56.92 2bdl s TYR 67 Cb 0.00 -1.78 0.30 0.00 -0.40 0.00 0.00 41.96 40.08 2bdl s TYR 67 CO 0.00 0.53 1.72 0.52 -1.57 0.00 0.00 175.55 176.75 2bdl h MET 68 N 4.73 0.74 -0.35 -0.62 2.86 -1.98 -2.87 114.93 117.45 2bdl h MET 68 Ca -0.51 -0.24 -0.05 0.00 -2.06 0.00 0.00 59.70 56.84 2bdl h MET 68 Cb 1.19 -0.07 -0.02 0.00 0.06 0.00 0.00 31.60 32.77 2bdl h MET 68 CO 0.58 0.82 -0.01 1.79 1.06 0.00 0.00 176.91 181.15 2bdl h THR 69 N 0.68 1.21 -0.65 2.22 1.35 -1.96 -1.07 112.91 114.68 2bdl h THR 69 Ca 0.12 -0.83 -0.05 0.00 -0.55 0.00 0.00 66.41 65.10 2bdl h THR 69 Cb 0.56 0.95 -0.03 0.00 -1.73 0.00 0.00 68.15 67.91 2bdl h THR 69 CO 0.03 0.29 0.21 0.78 -0.25 0.00 0.00 175.52 176.58 2bdl h ASN 70 N 0.53 0.91 -0.55 5.36 2.35 -1.93 -0.91 115.58 121.34 2bdl h ASN 70 Ca 0.11 -0.15 -0.08 0.00 -0.55 0.00 0.00 56.30 55.62 2bdl h ASN 70 Cb 0.36 -0.24 -0.02 0.00 0.05 0.00 0.00 38.32 38.47 2bdl h ASN 70 CO 0.01 0.85 0.01 0.00 -1.65 0.00 0.00 177.43 176.66 2bdl h ALA 71 N 1.28 0.74 -0.55 -0.83 0.00 -1.18 -1.02 119.26 117.70 2bdl h ALA 71 Ca 0.21 -0.29 -0.10 0.00 0.00 0.00 0.00 54.91 54.73 2bdl h ALA 71 Cb 0.26 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 2bdl h ALA 71 CO -0.01 0.55 -0.06 0.74 0.00 0.00 0.00 179.25 180.48 2bdl h PHE 72 N 0.85 1.12 -0.73 0.00 0.04 -1.05 -2.22 116.94 114.95 2bdl h PHE 72 Ca 0.16 -0.21 -0.02 0.00 2.80 0.00 0.00 57.97 60.69 2bdl h PHE 72 Cb 0.52 -0.28 -0.03 0.00 2.20 0.00 0.00 35.95 38.35 2bdl h PHE 72 CO 0.04 1.02 0.38 0.37 -0.60 0.00 0.00 178.31 179.52 2bdl h GLN 73 N 0.89 1.03 -0.20 1.51 4.15 -1.08 -2.20 115.11 119.20 2bdl h GLN 73 Ca 0.15 -0.13 -0.00 0.00 0.77 0.00 0.00 58.65 59.44 2bdl h GLN 73 Cb 0.62 -0.20 -0.01 0.00 0.21 0.00 0.00 27.48 28.10 2bdl h GLN 73 CO 0.04 0.78 0.12 -0.92 -1.93 0.00 0.00 178.83 176.92 2bdl h TYR 74 N 1.01 0.27 -0.70 3.99 3.20 -1.01 -1.56 116.97 122.17 2bdl h TYR 74 Ca 0.25 -0.00 -0.00 0.00 3.14 0.00 0.00 58.73 62.12 2bdl h TYR 74 Cb 0.07 -0.09 -0.03 0.00 1.54 0.00 0.00 36.73 38.21 2bdl h TYR 74 CO 0.00 0.22 0.42 0.28 -1.64 0.00 0.00 178.16 177.45 2bdl h VAL 75 N 0.23 1.19 0.45 1.81 2.07 -1.27 0.20 116.25 120.94 2bdl h VAL 75 Ca 0.07 -0.42 -0.02 0.00 0.82 0.00 0.00 66.70 67.15 2bdl h VAL 75 Cb 0.04 0.21 0.00 0.00 -1.52 0.00 0.00 31.29 30.02 2bdl h VAL 75 CO -0.01 0.20 -0.22 -0.61 0.02 0.00 0.00 177.57 176.95 2bdl h GLN 76 N 0.96 -0.58 -0.58 1.57 4.15 -1.21 -1.27 115.11 118.14 2bdl h GLN 76 Ca 0.25 0.04 0.01 0.00 0.77 0.00 0.00 58.65 59.72 2bdl h GLN 76 Cb -0.05 0.13 -0.03 0.00 0.21 0.00 0.00 27.48 27.75 2bdl h GLN 76 CO -0.05 -0.29 0.39 0.87 -1.93 0.00 0.00 178.83 177.81 2bdl h LYS 77 N -0.83 0.77 0.00 1.69 1.57 -1.01 -1.55 116.57 117.21 2bdl h LYS 77 Ca -0.06 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.67 2bdl h LYS 77 Cb 0.56 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.70 2bdl h LYS 77 CO 0.10 0.51 0.00 -0.97 -0.57 0.00 0.00 179.45 178.53 2bdl h ASN 78 N 0.79 0.00 -5.66 0.86 -1.24 -0.66 -3.47 115.58 106.20 2bdl h ASN 78 Ca 0.21 0.00 -0.41 0.00 0.71 0.00 0.00 56.30 56.82 2bdl h ASN 78 Cb -0.09 0.00 0.11 0.00 0.73 0.00 0.00 38.32 39.08 2bdl h ASN 78 CO -0.05 0.00 -0.67 0.54 -1.29 0.00 0.00 177.43 175.96 2bdl n ARG 79 N -2.48 -7.30 0.00 6.67 1.74 -0.58 -4.95 116.66 109.76 2bdl n ARG 79 Ca 0.01 0.82 0.00 0.00 -0.77 0.00 0.00 57.85 57.91 2bdl n ARG 79 Cb 0.21 -5.84 0.00 0.00 -1.02 0.00 0.00 32.46 25.81 2bdl n ARG 79 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2bdl n GLY 80 N -1.91 3.48 3.00 -0.13 0.00 -0.58 -4.90 105.19 104.15 2bdl n GLY 80 Ca -0.01 -0.93 -0.18 0.00 0.00 0.00 0.00 46.02 44.90 2bdl n GLY 80 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2bdl s ILE 81 N -2.00 0.63 0.72 -0.61 2.07 -0.50 -4.71 121.20 116.80 2bdl s ILE 81 Ca 0.00 -0.34 -0.11 0.00 -1.41 0.00 0.00 60.65 58.79 2bdl s ILE 81 Cb 0.00 -0.53 0.03 0.00 0.13 0.00 0.00 42.46 42.09 2bdl s ILE 81 CO 0.00 0.18 1.08 -1.81 -1.91 0.00 0.00 174.94 172.48 2bdl s ASP 82 N -0.16 4.97 0.84 4.50 1.01 -1.26 -1.29 116.67 125.28 2bdl s ASP 82 Ca 0.03 1.77 -0.12 0.00 0.71 0.00 0.00 52.55 54.94 2bdl s ASP 82 Cb -0.03 -2.52 0.09 0.00 1.01 0.00 0.00 42.92 41.47 2bdl s ASP 82 CO -0.00 -1.72 1.10 -0.94 0.21 0.00 0.00 175.17 173.82 2bdl s SER 83 N -3.39 4.10 0.22 0.27 1.04 -0.87 -1.72 113.70 113.34 2bdl s SER 83 Ca 0.61 1.27 -0.08 0.00 0.48 0.00 0.00 55.95 58.22 2bdl s SER 83 Cb -0.16 -1.96 0.28 0.00 0.10 0.00 0.00 66.02 64.27 2bdl s SER 83 CO 0.53 -2.21 1.80 -0.08 0.98 0.00 0.00 173.24 174.25 2bdl h GLU 84 N -1.26 0.63 -0.98 4.02 4.57 -1.28 -2.81 114.58 117.47 2bdl h GLU 84 Ca -0.48 -0.04 0.01 0.00 -1.18 0.00 0.00 59.36 57.67 2bdl h GLU 84 Cb 1.28 -0.14 -0.05 0.00 -0.16 0.00 0.00 28.75 29.68 2bdl h GLU 84 CO 0.59 0.42 0.63 -0.44 -1.18 0.00 0.00 179.01 179.03 2bdl h ASP 85 N 0.65 1.14 1.39 1.04 3.45 -1.94 -0.93 116.42 121.22 2bdl h ASP 85 Ca 0.32 -0.04 0.00 0.00 0.43 0.00 0.00 57.03 57.74 2bdl h ASP 85 Cb 0.25 -0.29 0.00 0.00 -0.56 0.00 0.00 39.33 38.74 2bdl h ASP 85 CO -0.21 0.84 0.00 0.00 -1.57 0.00 0.00 179.24 178.30 2bdl n ALA 86 N -2.39 2.26 -2.93 3.45 0.00 -1.12 -4.26 120.51 115.52 2bdl n ALA 86 Ca 0.11 -0.03 -0.14 0.00 0.00 0.00 0.00 53.44 53.38 2bdl n ALA 86 Cb 0.03 -1.47 0.01 0.00 0.00 0.00 0.00 19.45 18.02 2bdl n ALA 86 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 2bdl n TYR 87 N -2.17 -1.97 -0.90 0.00 -0.00 -1.01 -4.82 117.16 106.30 2bdl n TYR 87 Ca 0.06 -2.59 -0.31 0.00 -0.00 0.00 0.00 57.90 55.05 2bdl n TYR 87 Cb 0.41 0.76 0.14 0.00 -0.00 0.00 0.00 39.34 40.65 2bdl n TYR 87 CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 176.86 175.61 2bdl s PRO 88 N -0.28 1.46 -0.12 2.98 0.04 -0.39 -4.42 135.00 134.27 2bdl s PRO 88 Ca 0.32 1.42 -0.22 0.00 0.04 0.00 0.00 61.00 62.56 2bdl s PRO 88 Cb 0.23 -1.79 -0.03 0.00 0.04 0.00 0.00 34.50 32.95 2bdl s PRO 88 CO -0.16 -2.28 0.66 -0.47 0.04 0.00 0.00 177.00 174.79 2bdl s TYR 89 N -2.74 3.50 0.00 0.56 5.04 -1.26 -4.75 117.35 117.70 2bdl s TYR 89 Ca 0.65 1.11 0.00 0.00 -2.44 0.00 0.00 57.07 56.39 2bdl s TYR 89 Cb -0.21 -2.79 0.00 0.00 0.35 0.00 0.00 41.96 39.31 2bdl s TYR 89 CO 0.57 -0.01 0.20 1.33 -1.34 0.00 0.00 175.55 176.30 2bdl n VAL 90 N 4.11 0.00 -2.35 3.14 0.24 -1.26 -5.04 118.33 117.17 2bdl n VAL 90 Ca -0.01 -0.47 -0.15 0.00 -2.04 0.00 0.00 64.34 61.67 2bdl n VAL 90 Cb 0.51 1.03 -0.00 0.00 -1.47 0.00 0.00 33.84 33.90 2bdl n VAL 90 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2bdl n GLY 91 N 0.55 -0.22 3.27 7.63 0.00 -1.26 -5.00 105.19 110.16 2bdl n GLY 91 Ca 0.00 -0.26 -0.12 0.00 0.00 0.00 0.00 46.02 45.64 2bdl n GLY 91 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2bdl s GLN 92 N -4.82 0.82 0.09 1.61 -2.07 -1.26 -4.46 119.66 109.57 2bdl s GLN 92 Ca 0.03 -0.40 -0.30 0.00 -1.82 0.00 0.00 55.36 52.87 2bdl s GLN 92 Cb -0.01 0.36 -0.06 0.00 -1.09 0.00 0.00 33.01 32.21 2bdl s GLN 92 CO 0.04 -0.26 1.10 -1.21 -1.32 0.00 0.00 175.29 173.64 2bdl s GLU 93 N -2.30 4.53 0.21 9.60 2.02 -1.26 -4.96 118.70 126.53 2bdl s GLU 93 Ca -0.07 1.66 0.01 0.00 0.02 0.00 0.00 54.97 56.59 2bdl s GLU 93 Cb -0.02 -3.35 -0.05 0.00 0.10 0.00 0.00 34.13 30.82 2bdl s GLU 93 CO -0.02 -0.08 0.07 -1.21 0.02 0.00 0.00 175.26 174.05 2bdl s GLU 94 N 0.55 1.23 0.70 1.61 2.02 -1.26 -5.11 118.70 118.43 2bdl s GLU 94 Ca 0.54 -1.63 -0.16 0.00 0.02 0.00 0.00 54.97 53.73 2bdl s GLU 94 Cb -0.27 -0.10 0.02 0.00 0.10 0.00 0.00 34.13 33.88 2bdl s GLU 94 CO 0.31 -0.26 1.25 -1.54 0.02 0.00 0.00 175.26 175.04 2bdl s SER 95 N -3.21 4.30 -0.13 -0.19 1.04 -1.26 -4.60 113.70 109.64 2bdl s SER 95 Ca 0.32 2.50 -0.29 0.00 0.48 0.00 0.00 55.95 58.96 2bdl s SER 95 Cb 0.07 -2.60 -0.04 0.00 0.10 0.00 0.00 66.02 63.55 2bdl s SER 95 CO 0.09 -2.20 1.58 0.00 0.98 0.00 0.00 173.24 173.69 2bdl n MET 97 N 7.25 2.50 -1.73 0.00 0.00 -1.26 -5.06 117.12 118.82 2bdl n MET 97 Ca 0.17 -4.17 -0.42 0.00 0.00 0.00 0.00 57.70 53.28 2bdl n MET 97 Cb 0.44 -1.95 -0.03 0.00 0.00 0.00 0.00 33.22 31.68 2bdl n MET 97 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 175.97 176.95 2bdl n TYR 98 N -0.20 2.80 -3.75 1.12 4.19 -1.26 -4.98 117.16 115.09 2bdl n TYR 98 Ca 0.28 0.09 -0.37 0.00 3.31 0.00 0.00 57.90 61.21 2bdl n TYR 98 Cb 0.61 -2.66 -0.11 0.00 0.49 0.00 0.00 39.34 37.67 2bdl n TYR 98 CO 0.00 0.00 0.00 -0.80 0.91 0.00 0.00 176.86 176.97 2bdl s ASN 99 N 1.00 5.31 0.55 2.98 0.01 -1.26 -4.99 114.94 118.54 2bdl s ASN 99 Ca 0.72 -1.95 0.27 0.00 -0.71 0.00 0.00 52.86 51.19 2bdl s ASN 99 Cb -0.50 -1.85 1.45 0.00 0.41 0.00 0.00 41.25 40.76 2bdl s ASN 99 CO 0.36 -0.55 1.99 1.55 -1.51 0.00 0.00 177.10 178.95 2bdl h PRO 100 N 8.12 0.00 0.00 -0.60 0.13 -1.99 -0.70 132.00 136.95 2bdl h PRO 100 Ca -0.15 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.97 2bdl h PRO 100 Cb 1.05 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.18 2bdl h PRO 100 CO 0.71 0.00 -0.03 1.79 -0.23 0.00 0.00 178.00 180.24 2bdl h THR 101 N 0.00 0.09 -0.20 1.56 1.35 -2.01 -3.02 112.91 110.67 2bdl h THR 101 Ca 0.23 -0.51 0.00 0.00 -0.55 0.00 0.00 66.41 65.58 2bdl h THR 101 Cb 1.00 1.46 0.00 0.00 -1.73 0.00 0.00 68.15 68.88 2bdl h THR 101 CO -0.00 0.03 0.00 0.61 -0.25 0.00 0.00 175.52 175.91 2bdl n GLY 102 N -0.13 0.95 3.64 5.82 0.00 -0.27 -4.98 105.19 110.22 2bdl n GLY 102 Ca -0.00 -0.60 -0.48 0.00 0.00 0.00 0.00 46.02 44.94 2bdl n GLY 102 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2bdl n LYS 103 N 0.97 1.78 0.00 1.61 4.81 -1.14 -2.04 118.16 124.14 2bdl n LYS 103 Ca 0.17 0.64 0.00 0.00 -0.87 0.00 0.00 58.31 58.25 2bdl n LYS 103 Cb 0.50 -2.36 0.00 0.00 0.02 0.00 0.00 35.03 33.19 2bdl n LYS 103 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2bdl n ALA 104 N 3.03 1.10 -3.55 3.14 0.00 -0.41 -4.83 120.51 118.99 2bdl n ALA 104 Ca 0.17 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.51 2bdl n ALA 104 Cb 0.25 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.68 2bdl n ALA 104 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2bdl s ALA 105 N -0.63 -1.53 0.38 0.00 0.00 -1.19 -5.00 121.76 113.79 2bdl s ALA 105 Ca 0.00 0.33 0.04 0.00 0.00 0.00 0.00 51.96 52.33 2bdl s ALA 105 Cb 0.00 0.82 -0.03 0.00 0.00 0.00 0.00 23.12 23.91 2bdl s ALA 105 CO 0.00 -0.84 0.12 0.15 0.00 0.00 0.00 175.76 175.19 2bdl s LYS 106 N -3.71 1.84 -0.00 0.00 1.02 -1.26 -1.41 119.74 116.22 2bdl s LYS 106 Ca 0.04 -2.10 0.00 0.00 0.02 0.00 0.00 55.97 53.94 2bdl s LYS 106 Cb -0.02 -0.58 0.00 0.00 -0.52 0.00 0.00 37.83 36.71 2bdl s LYS 106 CO -0.07 -0.43 -0.01 0.00 -0.92 0.00 0.00 175.35 173.92 2bdl n ARG 108 N 3.14 1.66 0.00 0.00 1.74 0.92 -3.96 116.66 120.16 2bdl n ARG 108 Ca -0.13 -2.87 0.00 0.00 -0.77 0.00 0.00 57.85 54.08 2bdl n ARG 108 Cb 0.59 -1.61 0.00 0.00 -1.02 0.00 0.00 32.46 30.41 2bdl n ARG 108 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2bdl n GLY 109 N -1.19 0.63 3.25 -0.13 0.00 -1.25 -4.83 105.19 101.67 2bdl n GLY 109 Ca 0.19 -2.15 -0.09 0.00 0.00 0.00 0.00 46.02 43.97 2bdl n GLY 109 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2bdl s TYR 110 N -0.86 0.17 0.13 1.61 -0.85 -1.26 -0.64 117.35 115.64 2bdl s TYR 110 Ca 0.00 -0.58 0.05 0.00 -0.52 0.00 0.00 57.07 56.02 2bdl s TYR 110 Cb 0.00 -0.03 -0.04 0.00 0.38 0.00 0.00 41.96 42.27 2bdl s TYR 110 CO 0.00 -0.60 -0.12 1.03 -1.52 0.00 0.00 175.55 174.34 2bdl s ARG 111 N -3.88 1.01 -0.02 -3.49 1.81 -0.54 -4.91 118.95 108.93 2bdl s ARG 111 Ca 0.07 -1.28 0.08 0.00 -1.72 0.00 0.00 55.73 52.88 2bdl s ARG 111 Cb 0.04 -0.78 -0.02 0.00 -0.45 0.00 0.00 34.95 33.74 2bdl s ARG 111 CO -0.09 0.14 -0.25 -1.21 -0.68 0.00 0.00 175.30 173.21 2bdl s GLU 112 N -2.94 2.13 0.14 3.54 2.02 -1.26 -1.98 118.70 120.34 2bdl s GLU 112 Ca 0.10 -0.92 -0.30 0.00 0.02 0.00 0.00 54.97 53.88 2bdl s GLU 112 Cb -0.03 -2.07 -0.07 0.00 0.10 0.00 0.00 34.13 32.07 2bdl s GLU 112 CO 0.02 0.56 0.94 0.42 0.02 0.00 0.00 175.26 177.22 2bdl s ILE 113 N -0.64 4.41 -0.01 -1.63 1.09 -0.71 -4.99 121.20 118.73 2bdl s ILE 113 Ca 0.10 2.04 -0.36 0.00 -1.10 0.00 0.00 60.65 61.33 2bdl s ILE 113 Cb -0.10 -4.31 -0.14 0.00 -1.06 0.00 0.00 42.46 36.85 2bdl s ILE 113 CO -0.01 0.37 1.62 -2.65 -0.10 0.00 0.00 174.94 174.18 2bdl n PRO 114 N 2.45 1.69 -1.68 2.79 -0.02 -1.26 -4.67 135.00 134.29 2bdl n PRO 114 Ca 0.01 0.61 -0.56 0.00 -2.02 0.00 0.00 63.50 61.54 2bdl n PRO 114 Cb 0.49 -2.35 -0.07 0.00 -0.02 0.00 0.00 33.50 31.55 2bdl n PRO 114 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 2bdl n GLU 115 N 4.37 1.19 -0.14 -0.52 2.13 -1.26 -1.69 120.64 124.72 2bdl n GLU 115 Ca 0.21 0.44 0.00 0.00 0.66 0.00 0.00 57.16 58.46 2bdl n GLU 115 Cb 0.23 -2.12 0.00 0.00 0.27 0.00 0.00 31.44 29.83 2bdl n GLU 115 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2bdl n GLY 116 N 3.76 2.36 3.52 8.31 0.00 0.82 -4.94 105.19 119.02 2bdl n GLY 116 Ca 0.24 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.84 2bdl n GLY 116 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2bdl s ASN 117 N -3.63 6.28 0.44 1.61 3.84 -0.68 -4.85 114.94 117.94 2bdl s ASN 117 Ca 0.00 -0.95 0.23 0.00 0.21 0.00 0.00 52.86 52.36 2bdl s ASN 117 Cb 0.00 -2.51 0.93 0.00 -0.55 0.00 0.00 41.25 39.13 2bdl s ASN 117 CO 0.00 -1.59 1.84 -0.33 -2.79 0.00 0.00 177.10 174.22 2bdl h GLU 118 N 9.75 0.00 -0.01 0.43 5.08 -1.89 -2.36 114.58 125.57 2bdl h GLU 118 Ca -0.15 0.00 -0.23 0.00 -1.00 0.00 0.00 59.36 57.98 2bdl h GLU 118 Cb 1.05 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.30 2bdl h GLU 118 CO 1.27 0.24 -0.94 0.87 -1.00 0.00 0.00 179.01 179.44 2bdl h LYS 119 N 0.00 0.51 -0.26 2.33 1.57 -1.98 -2.27 116.57 116.47 2bdl h LYS 119 Ca -0.00 -0.53 -0.08 0.00 -1.87 0.00 0.00 60.65 58.17 2bdl h LYS 119 Cb 0.73 0.14 -0.01 0.00 0.08 0.00 0.00 32.23 33.17 2bdl h LYS 119 CO 0.03 1.16 -0.21 0.00 -0.57 0.00 0.00 179.45 179.87 2bdl h ALA 120 N 0.66 1.17 -0.44 3.86 0.00 -1.91 -1.86 119.26 120.75 2bdl h ALA 120 Ca -0.09 -0.31 -0.12 0.00 0.00 0.00 0.00 54.91 54.39 2bdl h ALA 120 Cb 1.58 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 19.23 2bdl h ALA 120 CO 0.17 0.53 -0.21 1.25 0.00 0.00 0.00 179.25 180.99 2bdl h LEU 121 N 0.42 0.94 -0.25 0.00 5.85 -1.43 -1.67 115.31 119.17 2bdl h LEU 121 Ca 0.07 -0.40 0.01 0.00 0.84 0.00 0.00 57.88 58.40 2bdl h LEU 121 Cb 0.60 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 41.35 2bdl h LEU 121 CO 0.04 1.13 0.14 0.50 -0.34 0.00 0.00 178.44 179.91 2bdl h LYS 122 N 0.74 0.28 -0.41 1.25 3.64 -1.25 -0.69 116.57 120.13 2bdl h LYS 122 Ca 0.10 -0.02 -0.06 0.00 -1.27 0.00 0.00 60.65 59.40 2bdl h LYS 122 Cb 0.78 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 32.51 2bdl h LYS 122 CO 0.06 0.19 0.01 0.00 -2.27 0.00 0.00 179.45 177.44 2bdl h ARG 123 N 0.29 0.65 -0.13 1.90 3.08 -1.31 -1.15 114.38 117.71 2bdl h ARG 123 Ca 0.10 -0.15 -0.03 0.00 0.07 0.00 0.00 59.98 59.96 2bdl h ARG 123 Cb 0.00 -0.09 -0.00 0.00 0.08 0.00 0.00 29.97 29.96 2bdl h ARG 123 CO -0.05 0.67 -0.03 0.00 -1.07 0.00 0.00 179.97 179.49 2bdl h ALA 124 N 1.39 0.18 -0.58 0.04 0.00 -1.10 -0.83 119.26 118.36 2bdl h ALA 124 Ca 0.13 -0.23 0.04 0.00 0.00 0.00 0.00 54.91 54.85 2bdl h ALA 124 Cb 0.38 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.08 2bdl h ALA 124 CO 0.01 -0.07 0.33 0.28 0.00 0.00 0.00 179.25 179.80 2bdl h VAL 125 N -0.06 1.01 -0.61 0.00 2.07 -1.00 0.21 116.25 117.88 2bdl h VAL 125 Ca 0.03 -0.22 -0.03 0.00 0.82 0.00 0.00 66.70 67.30 2bdl h VAL 125 Cb 0.45 0.32 -0.03 0.00 -1.52 0.00 0.00 31.29 30.51 2bdl h VAL 125 CO 0.01 0.12 0.26 0.00 0.02 0.00 0.00 177.57 177.98 2bdl h ALA 126 N 1.28 0.78 0.20 1.67 0.00 -1.16 -1.72 119.26 120.31 2bdl h ALA 126 Ca 0.25 -0.15 -0.30 0.00 0.00 0.00 0.00 54.91 54.70 2bdl h ALA 126 Cb 0.09 -0.24 0.02 0.00 0.00 0.00 0.00 17.79 17.67 2bdl h ALA 126 CO -0.13 0.38 -1.39 -0.09 0.00 0.00 0.00 179.25 178.01 2bdl h ARG 127 N 0.84 0.42 0.00 0.00 2.43 -0.92 -3.42 114.38 113.73 2bdl h ARG 127 Ca 0.20 -0.71 -0.37 0.00 -0.81 0.00 0.00 59.98 58.29 2bdl h ARG 127 Cb 0.17 0.27 -0.06 0.00 -0.42 0.00 0.00 29.97 29.93 2bdl h ARG 127 CO -0.02 1.34 -2.02 0.28 -1.51 0.00 0.00 179.97 178.04 2bdl n VAL 128 N -3.81 1.53 0.00 0.20 0.31 0.71 -5.09 118.33 112.19 2bdl n VAL 128 Ca -0.19 -0.24 0.00 0.00 -0.01 0.00 0.00 64.34 63.90 2bdl n VAL 128 Cb 1.01 -1.95 0.00 0.00 -0.91 0.00 0.00 33.84 31.99 2bdl n VAL 128 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2bdl n GLY 129 N 1.33 0.62 3.68 2.92 0.00 -0.65 -4.91 105.19 108.17 2bdl n GLY 129 Ca -0.45 -2.03 -0.44 0.00 0.00 0.00 0.00 46.02 43.09 2bdl n GLY 129 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2bdl n PRO 130 N 0.00 2.07 -4.89 1.61 -0.02 -1.26 -4.28 135.00 128.23 2bdl n PRO 130 Ca 0.00 0.73 -0.27 0.00 -2.02 0.00 0.00 63.50 61.94 2bdl n PRO 130 Cb 0.00 -2.38 -0.16 0.00 -0.02 0.00 0.00 33.50 30.94 2bdl n PRO 130 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2bdl s VAL 131 N -0.24 1.53 0.16 -1.45 1.01 -0.76 -4.72 120.40 115.93 2bdl s VAL 131 Ca 0.66 -0.75 -0.30 0.00 0.00 0.00 0.00 61.98 61.58 2bdl s VAL 131 Cb -0.63 -1.33 -0.08 0.00 0.00 0.00 0.00 36.38 34.34 2bdl s VAL 131 CO 0.52 0.44 1.30 -0.44 0.00 0.00 0.00 175.10 176.92 2bdl s SER 132 N 0.19 6.92 0.08 3.32 0.01 -0.59 -0.68 113.70 122.95 2bdl s SER 132 Ca -0.08 2.32 0.01 0.00 1.31 0.00 0.00 55.95 59.51 2bdl s SER 132 Cb -0.14 -2.60 -0.04 0.00 0.21 0.00 0.00 66.02 63.45 2bdl s SER 132 CO 0.04 -0.53 -0.06 0.68 0.41 0.00 0.00 173.24 173.77 2bdl s VAL 133 N 0.45 0.59 -0.04 3.43 -7.23 -0.82 -1.47 120.40 115.31 2bdl s VAL 133 Ca 0.58 -1.79 0.07 0.00 -1.81 0.00 0.00 61.98 59.03 2bdl s VAL 133 Cb -0.35 -1.50 -0.01 0.00 0.56 0.00 0.00 36.38 35.07 2bdl s VAL 133 CO 0.35 -0.83 -0.25 0.00 -0.31 0.00 0.00 175.10 174.07 2bdl s ALA 134 N -3.36 2.08 0.09 1.32 0.00 -1.22 -1.36 121.76 119.31 2bdl s ALA 134 Ca 0.08 -1.04 -0.01 0.00 0.00 0.00 0.00 51.96 50.99 2bdl s ALA 134 Cb 0.04 -0.59 -0.04 0.00 0.00 0.00 0.00 23.12 22.53 2bdl s ALA 134 CO -0.05 0.45 0.01 0.96 0.00 0.00 0.00 175.76 177.13 2bdl s ILE 135 N -0.36 0.22 -0.58 0.00 -4.36 0.19 -4.19 121.20 112.12 2bdl s ILE 135 Ca 0.03 -1.87 -0.26 0.00 -0.26 0.00 0.00 60.65 58.29 2bdl s ILE 135 Cb -0.12 -1.79 0.04 0.00 1.25 0.00 0.00 42.46 41.84 2bdl s ILE 135 CO 0.01 -0.73 1.06 -0.62 0.24 0.00 0.00 174.94 174.90 2bdl s ASP 136 N -3.00 6.37 -0.21 4.36 2.15 -0.58 -1.55 116.67 124.21 2bdl s ASP 136 Ca 0.16 -0.18 0.14 0.00 0.43 0.00 0.00 52.55 53.09 2bdl s ASP 136 Cb 0.08 -2.49 0.46 0.00 -0.30 0.00 0.00 42.92 40.67 2bdl s ASP 136 CO -0.04 -1.37 1.36 0.00 -0.17 0.00 0.00 175.17 174.96 2bdl n ALA 137 N 7.97 3.37 0.38 3.66 0.00 -1.26 -4.74 120.51 129.90 2bdl n ALA 137 Ca 0.04 -2.76 0.12 0.00 0.00 0.00 0.00 53.44 50.85 2bdl n ALA 137 Cb 0.48 -0.62 0.25 0.00 0.00 0.00 0.00 19.45 19.56 2bdl n ALA 137 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2bdl h SER 138 N 1.08 0.00 -3.88 0.00 4.64 -1.92 -3.44 113.55 110.03 2bdl h SER 138 Ca 0.08 -0.00 -0.49 0.00 -0.47 0.00 0.00 61.79 60.90 2bdl h SER 138 Cb 1.39 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.50 2bdl h SER 138 CO 0.22 0.00 0.43 -0.76 -0.87 0.00 0.00 176.83 175.85 2bdl s LEU 139 N -5.51 4.34 0.40 5.97 1.02 -1.26 -4.94 118.68 118.70 2bdl s LEU 139 Ca 0.08 2.12 0.10 0.00 0.02 0.00 0.00 54.13 56.45 2bdl s LEU 139 Cb 0.08 -3.92 0.90 0.00 0.02 0.00 0.00 46.19 43.27 2bdl s LEU 139 CO 0.65 -0.30 1.98 0.74 0.02 0.00 0.00 176.35 179.43 2bdl h THR 140 N 2.62 0.96 -0.14 5.49 2.02 -2.00 -1.37 112.91 120.49 2bdl h THR 140 Ca -0.47 -0.19 -0.02 0.00 0.77 0.00 0.00 66.41 66.50 2bdl h THR 140 Cb 1.21 0.36 -0.01 0.00 -1.74 0.00 0.00 68.15 67.97 2bdl h THR 140 CO 0.65 0.10 -0.00 0.77 0.37 0.00 0.00 175.52 177.41 2bdl h SER 141 N 0.56 0.17 -0.16 4.18 4.64 -1.97 -2.40 113.55 118.57 2bdl h SER 141 Ca 0.28 -0.02 -0.13 0.00 -0.47 0.00 0.00 61.79 61.45 2bdl h SER 141 Cb 0.37 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.42 2bdl h SER 141 CO -0.08 0.22 -0.40 0.15 -0.87 0.00 0.00 176.83 175.84 2bdl h PHE 142 N 0.19 0.71 -0.93 4.77 3.04 -1.59 -2.98 116.94 120.15 2bdl h PHE 142 Ca 0.05 -0.27 0.09 0.00 3.98 0.00 0.00 57.97 61.81 2bdl h PHE 142 Cb 0.14 -0.12 -0.07 0.00 2.56 0.00 0.00 35.95 38.45 2bdl h PHE 142 CO 0.00 1.02 0.57 0.37 -2.02 0.00 0.00 178.31 178.26 2bdl h GLN 143 N 0.19 0.95 -0.42 1.11 4.15 -1.17 -2.83 115.11 117.09 2bdl h GLN 143 Ca -0.01 -0.06 0.00 0.00 0.77 0.00 0.00 58.65 59.36 2bdl h GLN 143 Cb 1.01 -0.21 0.00 0.00 0.21 0.00 0.00 27.48 28.49 2bdl h GLN 143 CO 0.09 0.63 0.00 1.19 -1.93 0.00 0.00 178.83 178.81 2bdl n PHE 144 N -4.62 0.54 -1.56 3.99 0.99 -0.99 -4.86 117.46 110.95 2bdl n PHE 144 Ca 0.15 -0.28 -0.51 0.00 -0.00 0.00 0.00 57.45 56.81 2bdl n PHE 144 Cb 0.25 -0.00 -0.05 0.00 -1.00 0.00 0.00 39.48 38.68 2bdl n PHE 144 CO 0.00 0.00 0.00 0.98 -0.00 0.00 0.00 176.76 177.74 2bdl n TYR 145 N 1.49 1.14 -0.00 1.38 9.36 -1.07 -4.93 117.16 124.52 2bdl n TYR 145 Ca 0.20 0.75 -0.02 0.00 3.32 0.00 0.00 57.90 62.15 2bdl n TYR 145 Cb 0.60 -2.24 -0.01 0.00 -0.63 0.00 0.00 39.34 37.07 2bdl n TYR 145 CO 0.00 0.00 0.00 0.45 0.22 0.00 0.00 176.86 177.53 2bdl n SER 146 N 2.08 0.63 -3.89 2.98 2.88 -1.26 -3.40 113.62 113.63 2bdl n SER 146 Ca 0.17 0.09 -0.12 0.00 -1.33 0.00 0.00 58.87 57.69 2bdl n SER 146 Cb 0.20 -0.34 -0.07 0.00 -0.75 0.00 0.00 64.21 63.25 2bdl n SER 146 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 2bdl s LYS 147 N -1.60 1.49 0.15 -1.46 1.02 -1.26 -2.89 119.74 115.19 2bdl s LYS 147 Ca -0.05 -1.54 0.00 0.00 0.02 0.00 0.00 55.97 54.39 2bdl s LYS 147 Cb 0.01 0.38 0.00 0.00 -0.52 0.00 0.00 37.83 37.70 2bdl s LYS 147 CO 0.08 -0.57 0.00 0.41 -0.92 0.00 0.00 175.35 174.35 2bdl n GLY 148 N -0.39 -2.87 3.60 -3.33 0.00 -1.26 -4.85 105.19 96.10 2bdl n GLY 148 Ca 0.01 -1.77 -0.42 0.00 0.00 0.00 0.00 46.02 43.84 2bdl n GLY 148 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2bdl s VAL 149 N -0.73 4.77 -0.09 1.61 1.01 -1.26 -4.13 120.40 121.57 2bdl s VAL 149 Ca 0.00 1.09 -0.30 0.00 0.00 0.00 0.00 61.98 62.78 2bdl s VAL 149 Cb 0.00 -4.17 -0.03 0.00 0.00 0.00 0.00 36.38 32.18 2bdl s VAL 149 CO 0.00 -0.31 1.25 -0.47 0.00 0.00 0.00 175.10 175.56 2bdl s TYR 150 N 3.02 3.02 -0.10 5.22 5.04 0.18 -4.84 117.35 128.89 2bdl s TYR 150 Ca 0.32 1.09 -0.06 0.00 -2.44 0.00 0.00 57.07 55.98 2bdl s TYR 150 Cb -0.14 -3.48 0.04 0.00 0.35 0.00 0.00 41.96 38.73 2bdl s TYR 150 CO 0.14 -1.59 0.24 -0.47 -1.34 0.00 0.00 175.55 172.53 2bdl s TYR 151 N 2.72 -0.29 -0.06 4.97 5.04 -1.26 -1.45 117.35 127.01 2bdl s TYR 151 Ca 0.56 0.71 -0.03 0.00 -2.44 0.00 0.00 57.07 55.88 2bdl s TYR 151 Cb -0.24 0.06 0.04 0.00 0.35 0.00 0.00 41.96 42.17 2bdl s TYR 151 CO 0.20 -0.19 0.12 0.34 -1.34 0.00 0.00 175.55 174.69 2bdl s ASP 152 N 0.80 0.52 0.54 4.32 -1.08 -1.26 -5.04 116.67 115.46 2bdl s ASP 152 Ca -0.06 0.25 0.25 0.00 -0.52 0.00 0.00 52.55 52.47 2bdl s ASP 152 Cb -0.07 0.14 1.51 0.00 -1.46 0.00 0.00 42.92 43.05 2bdl s ASP 152 CO -0.05 -0.21 2.15 1.05 0.52 0.00 0.00 175.17 178.63 2bdl h GLU 153 N 7.97 0.00 -0.17 4.34 -0.00 -2.04 -2.08 114.58 122.61 2bdl h GLU 153 Ca -0.24 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.12 2bdl h GLU 153 Cb 1.12 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 29.87 2bdl h GLU 153 CO 0.25 0.07 0.00 -1.13 -0.00 0.00 0.00 179.01 178.20 2bdl n SER 154 N -3.94 1.40 -4.75 3.06 3.41 -1.26 -4.86 113.62 106.68 2bdl n SER 154 Ca -0.03 -1.73 -0.41 0.00 -0.26 0.00 0.00 58.87 56.45 2bdl n SER 154 Cb 0.16 -0.11 -0.03 0.00 -0.26 0.00 0.00 64.21 63.97 2bdl n SER 154 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2bdl s ASN 156 N 0.04 4.39 0.30 0.00 3.84 -1.26 -4.65 114.94 117.59 2bdl s ASN 156 Ca 0.54 -0.56 0.26 0.00 0.21 0.00 0.00 52.86 53.31 2bdl s ASN 156 Cb -0.38 -1.73 0.99 0.00 -0.55 0.00 0.00 41.25 39.57 2bdl s ASN 156 CO 0.43 -0.07 1.76 0.77 -2.79 0.00 0.00 177.10 177.21 2bdl h SER 157 N 8.10 0.00 1.62 -4.21 4.64 -1.87 -2.59 113.55 119.25 2bdl h SER 157 Ca -0.38 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.94 2bdl h SER 157 Cb 1.14 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.23 2bdl h SER 157 CO 0.60 0.00 -0.34 0.44 -0.87 0.00 0.00 176.83 176.66 2bdl h ASP 158 N 0.00 0.00 -3.06 4.97 3.32 -1.94 -3.40 116.42 116.31 2bdl h ASP 158 Ca 0.00 -0.01 -0.79 0.00 0.02 0.00 0.00 57.03 56.26 2bdl h ASP 158 Cb 0.48 0.00 -0.29 0.00 0.22 0.00 0.00 39.33 39.73 2bdl h ASP 158 CO 0.00 0.00 0.55 -3.20 -1.72 0.00 0.00 179.24 174.88 2bdl n ASN 159 N -2.90 5.88 -4.66 6.45 5.15 -0.98 -5.01 115.26 119.20 2bdl n ASN 159 Ca 0.03 -3.30 -0.43 0.00 -0.60 0.00 0.00 54.58 50.28 2bdl n ASN 159 Cb 0.53 -1.24 -0.02 0.00 -0.53 0.00 0.00 39.78 38.51 2bdl n ASN 159 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 2bdl s LEU 160 N -2.31 4.08 0.00 1.20 1.43 -1.26 -3.74 118.68 118.08 2bdl s LEU 160 Ca 0.31 1.31 0.00 0.00 -1.03 0.00 0.00 54.13 54.73 2bdl s LEU 160 Cb 0.01 -3.50 0.00 0.00 0.03 0.00 0.00 46.19 42.73 2bdl s LEU 160 CO 0.04 -0.67 0.03 -0.46 0.23 0.00 0.00 176.35 175.52 2bdl n ASN 161 N 6.34 0.07 -3.83 2.29 0.23 -0.67 -4.95 115.26 114.74 2bdl n ASN 161 Ca 0.11 -0.51 -0.13 0.00 -0.53 0.00 0.00 54.58 53.52 2bdl n ASN 161 Cb 0.46 0.07 -0.15 0.00 -2.08 0.00 0.00 39.78 38.09 2bdl n ASN 161 CO 0.00 0.00 0.00 -2.28 -0.93 0.00 0.00 177.26 174.05 2bdl s HIS 162 N -0.07 0.00 -0.18 -2.53 5.04 -0.59 -4.93 115.29 112.03 2bdl s HIS 162 Ca 0.00 0.08 -0.06 0.00 -1.54 0.00 0.00 55.06 53.53 2bdl s HIS 162 Cb 0.00 -0.09 -0.03 0.00 0.04 0.00 0.00 32.58 32.49 2bdl s HIS 162 CO 0.00 -0.04 0.03 0.00 -2.34 0.00 0.00 174.74 172.39 2bdl s ALA 163 N 0.45 3.24 0.00 1.58 0.00 -1.26 -0.64 121.76 125.13 2bdl s ALA 163 Ca -0.04 -0.81 0.00 0.00 0.00 0.00 0.00 51.96 51.11 2bdl s ALA 163 Cb -0.05 -1.81 0.00 0.00 0.00 0.00 0.00 23.12 21.26 2bdl s ALA 163 CO -0.01 0.13 0.00 1.33 0.00 0.00 0.00 175.76 177.20 2bdl n VAL 164 N 3.67 0.00 -4.15 0.00 0.24 -0.46 -4.54 118.33 113.08 2bdl n VAL 164 Ca -0.17 0.00 -0.22 0.00 -2.04 0.00 0.00 64.34 61.91 2bdl n VAL 164 Cb 0.52 0.00 -0.17 0.00 -1.47 0.00 0.00 33.84 32.73 2bdl n VAL 164 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 2bdl s LEU 165 N 0.00 1.26 -0.48 1.34 2.96 -1.06 -1.95 118.68 120.75 2bdl s LEU 165 Ca 0.00 -0.18 -0.21 0.00 -0.22 0.00 0.00 54.13 53.52 2bdl s LEU 165 Cb 0.00 -0.58 0.04 0.00 0.50 0.00 0.00 46.19 46.15 2bdl s LEU 165 CO 0.00 -0.07 0.72 0.00 -1.32 0.00 0.00 176.35 175.69 2bdl s ALA 166 N 1.13 3.31 -2.28 5.97 0.00 0.14 -0.61 121.76 129.43 2bdl s ALA 166 Ca -0.07 -1.33 0.22 0.00 0.00 0.00 0.00 51.96 50.77 2bdl s ALA 166 Cb -0.14 -3.43 0.52 0.00 0.00 0.00 0.00 23.12 20.07 2bdl s ALA 166 CO -0.01 -2.00 1.45 1.33 0.00 0.00 0.00 175.76 176.53 2bdl n VAL 167 N 5.91 0.58 -3.57 0.00 0.24 0.06 -1.83 118.33 119.73 2bdl n VAL 167 Ca -0.02 -0.72 0.00 0.00 -2.04 0.00 0.00 64.34 61.56 2bdl n VAL 167 Cb 0.47 0.69 0.00 0.00 -1.47 0.00 0.00 33.84 33.53 2bdl n VAL 167 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2bdl n GLY 168 N 1.45 -1.12 3.35 7.63 0.00 -1.23 -1.59 105.19 113.68 2bdl n GLY 168 Ca 0.20 -1.30 -0.11 0.00 0.00 0.00 0.00 46.02 44.80 2bdl n GLY 168 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2bdl s TYR 169 N -2.89 -0.30 0.00 1.61 -0.85 -0.65 -0.91 117.35 113.35 2bdl s TYR 169 Ca 0.00 0.02 0.00 0.00 -0.52 0.00 0.00 57.07 56.57 2bdl s TYR 169 Cb 0.00 0.35 0.00 0.00 0.38 0.00 0.00 41.96 42.69 2bdl s TYR 169 CO 0.00 -0.75 0.00 0.41 -1.52 0.00 0.00 175.55 173.69 2bdl n GLY 170 N -0.27 1.63 2.66 5.49 0.00 -0.86 -1.30 105.19 112.53 2bdl n GLY 170 Ca -0.16 -0.60 -0.21 0.00 0.00 0.00 0.00 46.02 45.04 2bdl n GLY 170 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2bdl s ILE 171 N -2.17 -0.09 -0.42 -0.61 1.01 -1.26 -1.10 121.20 116.56 2bdl s ILE 171 Ca 0.00 0.30 -0.08 0.00 0.00 0.00 0.00 60.65 60.87 2bdl s ILE 171 Cb 0.00 -0.25 0.09 0.00 0.01 0.00 0.00 42.46 42.31 2bdl s ILE 171 CO 0.00 0.09 0.25 -1.58 0.00 0.00 0.00 174.94 173.69 2bdl s GLN 172 N 2.16 2.50 -1.26 2.79 0.74 0.02 -4.68 119.66 121.92 2bdl s GLN 172 Ca 0.04 -1.53 -0.09 0.00 0.05 0.00 0.00 55.36 53.83 2bdl s GLN 172 Cb -0.13 -3.74 -0.01 0.00 1.10 0.00 0.00 33.01 30.24 2bdl s GLN 172 CO -0.04 -0.98 0.64 0.36 -0.55 0.00 0.00 175.29 174.72 2bdl n LYS 173 N 4.86 -2.74 0.00 1.67 2.85 -1.26 -2.13 118.16 121.41 2bdl n LYS 173 Ca -0.09 0.48 0.00 0.00 -1.05 0.00 0.00 58.31 57.65 2bdl n LYS 173 Cb 0.42 -4.52 0.00 0.00 -0.65 0.00 0.00 35.03 30.28 2bdl n LYS 173 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2bdl n GLY 174 N -1.76 2.67 3.53 2.58 0.00 -1.26 -5.02 105.19 105.93 2bdl n GLY 174 Ca -0.21 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.40 2bdl n GLY 174 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2bdl s ASN 175 N -1.81 6.08 0.27 1.61 0.02 -0.90 -5.07 114.94 115.14 2bdl s ASN 175 Ca 0.00 -0.43 -0.29 0.00 -1.02 0.00 0.00 52.86 51.11 2bdl s ASN 175 Cb 0.00 -2.15 -0.10 0.00 0.02 0.00 0.00 41.25 39.03 2bdl s ASN 175 CO 0.00 -0.27 1.26 -0.54 0.02 0.00 0.00 177.10 177.57 2bdl s LYS 176 N 1.76 4.44 0.15 -0.60 1.02 -1.26 -0.80 119.74 124.45 2bdl s LYS 176 Ca 0.07 2.06 -0.05 0.00 0.02 0.00 0.00 55.97 58.06 2bdl s LYS 176 Cb -0.17 -3.14 -0.02 0.00 -0.52 0.00 0.00 37.83 33.97 2bdl s LYS 176 CO 0.11 -0.11 0.18 -3.38 -0.92 0.00 0.00 175.35 171.22 2bdl s HIS 177 N -0.71 0.61 -0.09 3.18 -3.43 -0.26 -1.36 115.29 113.22 2bdl s HIS 177 Ca 0.50 -0.98 -0.03 0.00 -0.80 0.00 0.00 55.06 53.75 2bdl s HIS 177 Cb -0.37 -0.25 -0.04 0.00 -1.43 0.00 0.00 32.58 30.50 2bdl s HIS 177 CO 0.45 -0.62 0.05 -1.58 -2.00 0.00 0.00 174.74 171.03 2bdl s TRP 178 N -4.00 3.30 -0.33 0.38 0.52 0.12 -2.02 118.94 116.91 2bdl s TRP 178 Ca 0.20 0.30 -0.19 0.00 0.02 0.00 0.00 56.10 56.43 2bdl s TRP 178 Cb 0.05 -1.83 -0.01 0.00 -1.15 0.00 0.00 33.47 30.53 2bdl s TRP 178 CO 0.01 0.55 0.54 0.42 0.02 0.00 0.00 176.95 178.50 2bdl s ILE 179 N -0.94 5.00 -0.19 2.03 1.01 -0.09 -1.34 121.20 126.68 2bdl s ILE 179 Ca 0.14 0.53 0.00 0.00 0.00 0.00 0.00 60.65 61.33 2bdl s ILE 179 Cb -0.12 -3.96 0.02 0.00 0.01 0.00 0.00 42.46 38.42 2bdl s ILE 179 CO 0.03 -0.17 -0.17 -0.63 0.00 0.00 0.00 174.94 174.00 2bdl s ILE 180 N 2.45 2.26 -0.23 2.92 -1.09 -0.16 -0.76 121.20 126.59 2bdl s ILE 180 Ca 0.21 -0.93 -0.23 0.00 -2.23 0.00 0.00 60.65 57.46 2bdl s ILE 180 Cb -0.15 -1.99 -0.01 0.00 -1.58 0.00 0.00 42.46 38.72 2bdl s ILE 180 CO 0.13 0.48 0.77 -0.75 -1.23 0.00 0.00 174.94 174.33 2bdl s LYS 181 N 1.30 4.18 0.52 2.79 2.20 0.22 -1.37 119.74 129.59 2bdl s LYS 181 Ca 0.04 0.84 0.08 0.00 -0.36 0.00 0.00 55.97 56.57 2bdl s LYS 181 Cb -0.14 -3.63 0.06 0.00 -1.51 0.00 0.00 37.83 32.61 2bdl s LYS 181 CO -0.11 -0.45 0.72 1.21 -0.36 0.00 0.00 175.35 176.37 2bdl s ASN 182 N 1.33 5.27 -0.25 1.43 3.84 -0.92 -2.56 114.94 123.09 2bdl s ASN 182 Ca 0.33 -0.61 0.11 0.00 0.21 0.00 0.00 52.86 52.90 2bdl s ASN 182 Cb -0.16 -0.15 0.45 0.00 -0.55 0.00 0.00 41.25 40.84 2bdl s ASN 182 CO 0.08 -1.15 1.19 -1.54 -2.79 0.00 0.00 177.10 172.90 2bdl n SER 183 N -2.14 3.43 -1.05 -4.21 3.41 -1.26 -4.50 113.62 107.29 2bdl n SER 183 Ca 0.12 -3.56 0.03 0.00 -0.26 0.00 0.00 58.87 55.20 2bdl n SER 183 Cb 0.60 -0.41 0.24 0.00 -0.26 0.00 0.00 64.21 64.38 2bdl n SER 183 CO 0.00 0.00 0.00 0.79 -0.16 0.00 0.00 175.04 175.67 2bdl n TRP 184 N -0.77 1.11 0.00 7.33 8.01 -1.17 -1.21 117.44 130.74 2bdl n TRP 184 Ca 0.31 -1.15 0.00 0.00 -1.31 0.00 0.00 57.50 55.35 2bdl n TRP 184 Cb 0.88 -0.40 0.00 0.00 -2.01 0.00 0.00 31.31 29.77 2bdl n TRP 184 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2bdl n GLY 185 N -0.72 -0.86 0.12 6.99 0.00 -0.24 -4.32 105.19 106.16 2bdl n GLY 185 Ca 0.27 -1.67 0.13 0.00 0.00 0.00 0.00 46.02 44.75 2bdl n GLY 185 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2bdl h GLU 186 N 0.00 0.00 -0.00 1.61 5.08 -1.83 -3.16 114.58 116.27 2bdl h GLU 186 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2bdl h GLU 186 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 2bdl h GLU 186 CO 0.00 0.00 -0.18 0.09 -1.00 0.00 0.00 179.01 177.92 2bdl n ASN 187 N -2.35 0.52 -4.87 1.42 3.02 -1.26 -3.34 115.26 108.40 2bdl n ASN 187 Ca 0.05 -0.48 -0.34 0.00 -0.03 0.00 0.00 54.58 53.78 2bdl n ASN 187 Cb 0.39 -0.04 -0.05 0.00 -0.61 0.00 0.00 39.78 39.47 2bdl n ASN 187 CO 0.00 0.00 0.00 0.86 -2.62 0.00 0.00 177.26 175.50 2bdl s TRP 188 N -2.60 3.54 0.00 3.10 -0.00 -1.19 -4.96 118.94 116.83 2bdl s TRP 188 Ca 0.24 0.79 0.00 0.00 -0.00 0.00 0.00 56.10 57.13 2bdl s TRP 188 Cb 0.19 -2.17 0.00 0.00 -0.00 0.00 0.00 33.47 31.49 2bdl s TRP 188 CO 0.52 0.45 0.00 0.41 -0.00 0.00 0.00 176.95 178.33 2bdl n GLY 189 N 0.58 3.21 3.20 5.86 0.00 -1.22 -0.93 105.19 115.89 2bdl n GLY 189 Ca -0.05 -0.22 -0.41 0.00 0.00 0.00 0.00 46.02 45.34 2bdl n GLY 189 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2bdl s ASN 190 N -4.00 5.94 -1.35 1.61 3.84 -0.43 -4.63 114.94 115.92 2bdl s ASN 190 Ca 0.00 -2.81 -0.03 0.00 0.21 0.00 0.00 52.86 50.23 2bdl s ASN 190 Cb 0.00 -2.02 0.02 0.00 -0.55 0.00 0.00 41.25 38.70 2bdl s ASN 190 CO 0.00 -0.45 0.22 0.29 -2.79 0.00 0.00 177.10 174.37 2bdl n LYS 191 N 3.66 -2.90 -0.02 0.43 5.02 -1.24 -1.37 118.16 121.74 2bdl n LYS 191 Ca 0.11 0.72 0.00 0.00 -2.02 0.00 0.00 58.31 57.12 2bdl n LYS 191 Cb 0.42 -5.41 0.00 0.00 -0.02 0.00 0.00 35.03 30.02 2bdl n LYS 191 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2bdl n GLY 192 N -1.07 0.31 3.63 0.72 0.00 -0.11 -4.68 105.19 104.00 2bdl n GLY 192 Ca -0.13 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.64 2bdl n GLY 192 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2bdl s TYR 193 N -2.05 2.73 -0.01 1.61 2.02 -0.47 -2.16 117.35 119.02 2bdl s TYR 193 Ca 0.00 -0.20 0.00 0.00 -0.37 0.00 0.00 57.07 56.51 2bdl s TYR 193 Cb 0.00 -1.27 0.01 0.00 -0.40 0.00 0.00 41.96 40.30 2bdl s TYR 193 CO 0.00 0.56 0.00 -1.50 -1.57 0.00 0.00 175.55 173.05 2bdl s ILE 194 N -1.99 0.04 -0.21 2.71 2.07 -0.47 -1.32 121.20 122.03 2bdl s ILE 194 Ca 0.29 0.06 -0.16 0.00 -1.41 0.00 0.00 60.65 59.42 2bdl s ILE 194 Cb -0.08 -0.09 -0.04 0.00 0.13 0.00 0.00 42.46 42.38 2bdl s ILE 194 CO 0.18 0.05 0.40 -0.76 -1.91 0.00 0.00 174.94 172.91 2bdl s LEU 195 N 0.43 4.15 -0.05 8.50 1.43 -1.26 -0.99 118.68 130.90 2bdl s LEU 195 Ca -0.04 0.51 0.06 0.00 -1.03 0.00 0.00 54.13 53.63 2bdl s LEU 195 Cb -0.06 -2.52 -0.02 0.00 0.03 0.00 0.00 46.19 43.63 2bdl s LEU 195 CO -0.01 -0.09 -0.21 -0.04 0.23 0.00 0.00 176.35 176.23 2bdl s MET 196 N 1.36 2.42 0.05 1.70 -1.94 -0.45 0.49 119.30 122.93 2bdl s MET 196 Ca 0.19 -0.84 -0.37 0.00 -1.71 0.00 0.00 55.69 52.96 2bdl s MET 196 Cb -0.15 -2.21 -0.16 0.00 2.01 0.00 0.00 34.83 34.32 2bdl s MET 196 CO 0.08 0.51 1.44 0.00 -0.01 0.00 0.00 175.02 177.04 2bdl n ALA 197 N 2.60 -0.50 -2.56 3.03 0.00 -0.53 0.16 120.51 122.72 2bdl n ALA 197 Ca -0.17 0.48 -0.33 0.00 0.00 0.00 0.00 53.44 53.42 2bdl n ALA 197 Cb 0.52 -2.15 -0.12 0.00 0.00 0.00 0.00 19.45 17.70 2bdl n ALA 197 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 2bdl s ARG 198 N 1.03 2.66 -1.43 0.00 3.52 -0.46 -4.60 118.95 119.67 2bdl s ARG 198 Ca 0.86 -0.63 -0.03 0.00 -0.13 0.00 0.00 55.73 55.79 2bdl s ARG 198 Cb -0.92 -2.48 0.00 0.00 -1.56 0.00 0.00 34.95 29.99 2bdl s ARG 198 CO 0.48 0.61 0.42 0.09 -0.81 0.00 0.00 175.30 176.09 2bdl n ASN 199 N 2.36 -5.59 -3.26 -2.12 3.02 -1.26 -4.62 115.26 103.79 2bdl n ASN 199 Ca -0.18 -0.20 -0.30 0.00 -0.03 0.00 0.00 54.58 53.88 2bdl n ASN 199 Cb 0.52 -4.47 -0.04 0.00 -0.61 0.00 0.00 39.78 35.18 2bdl n ASN 199 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2bdl n LYS 200 N -3.47 3.34 -3.92 3.52 4.76 -1.26 -4.89 118.16 116.24 2bdl n LYS 200 Ca -0.13 -4.76 -0.29 0.00 -2.87 0.00 0.00 58.31 50.26 2bdl n LYS 200 Cb 0.62 -2.29 -0.01 0.00 -1.84 0.00 0.00 35.03 31.51 2bdl n LYS 200 CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32 2bdl n ASN 201 N 0.26 -1.85 -3.79 4.39 5.15 -1.26 -3.05 115.26 115.11 2bdl n ASN 201 Ca 0.32 -1.06 -0.25 0.00 -0.60 0.00 0.00 54.58 52.99 2bdl n ASN 201 Cb 0.38 -2.90 0.01 0.00 -0.53 0.00 0.00 39.78 36.74 2bdl n ASN 201 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 2bdl n ASN 202 N -2.82 -1.74 -4.73 1.20 5.15 -1.26 -4.84 115.26 106.22 2bdl n ASN 202 Ca -0.24 -0.94 -0.42 0.00 -0.60 0.00 0.00 54.58 52.38 2bdl n ASN 202 Cb 0.65 -3.51 -0.03 0.00 -0.53 0.00 0.00 39.78 36.36 2bdl n ASN 202 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2bdl s ALA 203 N -3.75 3.89 -0.84 5.20 0.00 -1.17 -1.26 121.76 123.83 2bdl s ALA 203 Ca 0.11 1.59 0.00 0.00 0.00 0.00 0.00 51.96 53.66 2bdl s ALA 203 Cb -0.04 -3.68 0.00 0.00 0.00 0.00 0.00 23.12 19.40 2bdl s ALA 203 CO 0.85 -0.95 0.00 0.00 0.00 0.00 0.00 175.76 175.66 2bdl n GLY 205 N -0.12 -0.10 0.39 0.00 0.00 -0.39 -1.53 105.19 103.44 2bdl n GLY 205 Ca -0.08 -0.28 0.18 0.00 0.00 0.00 0.00 46.02 45.83 2bdl n GLY 205 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 2bdl h ILE 206 N -0.46 0.74 -0.44 -0.61 6.09 -1.67 -1.81 117.51 119.35 2bdl h ILE 206 Ca -0.31 -0.13 0.00 0.00 -1.37 0.00 0.00 64.86 63.05 2bdl h ILE 206 Cb 1.22 0.34 0.00 0.00 0.47 0.00 0.00 36.82 38.85 2bdl h ILE 206 CO 0.35 0.07 0.00 0.00 -3.07 0.00 0.00 178.15 175.50 2bdl n ALA 207 N -2.54 2.84 0.05 0.18 0.00 -1.26 -4.49 120.51 115.29 2bdl n ALA 207 Ca 0.16 -1.71 -0.07 0.00 0.00 0.00 0.00 53.44 51.81 2bdl n ALA 207 Cb 0.61 -0.76 -0.12 0.00 0.00 0.00 0.00 19.45 19.18 2bdl n ALA 207 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 2bdl h ASN 208 N 2.79 0.01 -1.71 0.00 2.35 -1.60 0.23 115.58 117.64 2bdl h ASN 208 Ca 0.00 -0.01 -0.46 0.00 -0.55 0.00 0.00 56.30 55.29 2bdl h ASN 208 Cb 1.27 -0.00 -0.36 0.00 0.05 0.00 0.00 38.32 39.28 2bdl h ASN 208 CO 0.18 1.00 -1.08 -0.11 -1.65 0.00 0.00 177.43 175.77 2bdl n LEU 209 N -3.30 0.27 -4.76 1.61 7.94 -1.26 -4.57 117.00 112.94 2bdl n LEU 209 Ca -0.03 -4.77 -0.36 0.00 -1.11 0.00 0.00 56.01 49.74 2bdl n LEU 209 Cb 0.96 0.74 -0.08 0.00 0.53 0.00 0.00 43.42 45.57 2bdl n LEU 209 CO 0.47 2.23 -0.26 0.00 -1.11 0.00 0.00 177.39 178.72 2bdl s ALA 210 N -1.87 3.51 0.14 1.96 0.00 -1.26 -3.45 121.76 120.78 2bdl s ALA 210 Ca 0.37 -0.74 -0.15 0.00 0.00 0.00 0.00 51.96 51.43 2bdl s ALA 210 Cb 0.32 -1.66 0.03 0.00 0.00 0.00 0.00 23.12 21.80 2bdl s ALA 210 CO -0.08 0.60 0.40 -1.54 0.00 0.00 0.00 175.76 175.14 2bdl s SER 211 N -0.94 -0.21 -0.00 0.00 1.04 -0.54 -1.73 113.70 111.32 2bdl s SER 211 Ca 0.14 -0.39 -0.03 0.00 0.48 0.00 0.00 55.95 56.15 2bdl s SER 211 Cb -0.12 0.48 -0.00 0.00 0.10 0.00 0.00 66.02 66.48 2bdl s SER 211 CO 0.03 -0.88 0.06 0.72 0.98 0.00 0.00 173.24 174.15 2bdl s PHE 212 N -3.83 0.08 0.50 5.02 -0.12 -0.84 -1.55 117.98 117.25 2bdl s PHE 212 Ca 0.05 -0.17 -0.18 0.00 -0.05 0.00 0.00 56.93 56.58 2bdl s PHE 212 Cb 0.02 -0.07 -0.08 0.00 -0.63 0.00 0.00 43.02 42.25 2bdl s PHE 212 CO -0.10 -0.17 0.98 -1.25 -0.05 0.00 0.00 175.22 174.63 2bdl s PRO 213 N -0.95 3.99 0.05 1.99 0.04 -1.26 -1.47 135.00 137.38 2bdl s PRO 213 Ca -0.10 1.01 0.01 0.00 0.04 0.00 0.00 61.00 61.95 2bdl s PRO 213 Cb -0.06 -2.14 -0.04 0.00 0.04 0.00 0.00 34.50 32.30 2bdl s PRO 213 CO 0.00 -0.24 0.11 0.15 0.04 0.00 0.00 177.00 177.06 2bdl s LYS 214 N -3.86 3.07 0.00 4.56 1.02 0.18 -4.90 119.74 119.81 2bdl s LYS 214 Ca 0.60 -0.56 0.00 0.00 0.02 0.00 0.00 55.97 56.03 2bdl s LYS 214 Cb -0.10 -2.85 0.00 0.00 -0.52 0.00 0.00 37.83 34.36 2bdl s LYS 214 CO 0.27 0.60 0.17 -1.33 -0.92 0.00 0.00 175.35 174.15