#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nnc h ALA 9 N 0.00 0.41 -0.54 -1.46 0.00 -1.99 -2.72 119.26 112.96 2nnc h ALA 9 Ca 0.00 -0.52 0.04 0.00 0.00 0.00 0.00 54.91 54.44 2nnc h ALA 9 Cb 0.00 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.68 2nnc h ALA 9 CO 0.00 0.63 0.29 0.77 0.00 0.00 0.00 179.25 180.94 2nnc h SER 10 N 0.59 0.42 -0.06 0.00 0.02 -2.03 -0.83 113.55 111.66 2nnc h SER 10 Ca 0.00 0.02 -0.00 0.00 -0.84 0.00 0.00 61.79 60.98 2nnc h SER 10 Cb 1.16 -0.06 -0.00 0.00 0.14 0.00 0.00 62.40 63.64 2nnc h SER 10 CO 0.12 0.29 0.04 0.11 -1.14 0.00 0.00 176.83 176.25 2nnc h LYS 11 N 0.55 0.09 -0.62 3.45 1.57 -1.96 0.15 116.57 119.80 2nnc h LYS 11 Ca 0.24 -0.01 0.08 0.00 -1.87 0.00 0.00 60.65 59.09 2nnc h LYS 11 Cb 0.12 -0.02 -0.06 0.00 0.08 0.00 0.00 32.23 32.35 2nnc h LYS 11 CO -0.15 0.13 0.28 1.25 -0.57 0.00 0.00 179.45 180.39 2nnc h LEU 12 N 0.03 0.35 -0.49 2.94 5.85 -1.16 0.42 115.31 123.24 2nnc h LEU 12 Ca 0.02 0.06 -0.15 0.00 0.84 0.00 0.00 57.88 58.66 2nnc h LEU 12 Cb 0.06 0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.09 2nnc h LEU 12 CO -0.00 0.21 -0.35 0.44 -0.34 0.00 0.00 178.44 178.40 2nnc h ASP 13 N 0.51 0.91 -0.28 1.25 3.32 -0.70 0.26 116.42 121.68 2nnc h ASP 13 Ca 0.30 -0.39 0.01 0.00 0.02 0.00 0.00 57.03 56.97 2nnc h ASP 13 Cb 0.31 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.59 2nnc h ASP 13 CO -0.26 1.16 0.15 0.44 -1.72 0.00 0.00 179.24 179.02 2nnc h ASP 14 N 0.71 0.24 -0.56 6.45 3.32 -0.22 -0.04 116.42 126.32 2nnc h ASP 14 Ca 0.07 0.01 0.03 0.00 0.02 0.00 0.00 57.03 57.15 2nnc h ASP 14 Cb 0.92 -0.04 -0.04 0.00 0.22 0.00 0.00 39.33 40.39 2nnc h ASP 14 CO 0.08 0.18 0.34 0.00 -1.72 0.00 0.00 179.24 178.12 2nnc h ALA 15 N 1.13 0.73 -0.51 3.45 0.00 -0.64 -2.05 119.26 121.37 2nnc h ALA 15 Ca 0.11 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.96 2nnc h ALA 15 Cb 0.01 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 2nnc h ALA 15 CO -0.06 0.05 0.10 0.82 0.00 0.00 0.00 179.25 180.16 2nnc h ILE 16 N 0.66 1.25 -0.68 0.00 2.04 -0.70 -2.85 117.51 117.23 2nnc h ILE 16 Ca 0.23 -0.90 0.00 0.00 1.00 0.00 0.00 64.86 65.19 2nnc h ILE 16 Cb 0.04 0.85 -0.03 0.00 -0.74 0.00 0.00 36.82 36.93 2nnc h ILE 16 CO -0.11 0.32 0.43 0.00 0.00 0.00 0.00 178.15 178.80 2nnc h ALA 17 N 0.98 1.49 -0.19 1.87 0.00 -0.78 0.28 119.26 122.91 2nnc h ALA 17 Ca 0.16 -0.06 -0.13 0.00 0.00 0.00 0.00 54.91 54.88 2nnc h ALA 17 Cb 0.37 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 2nnc h ALA 17 CO 0.01 0.46 -0.44 0.00 0.00 0.00 0.00 179.25 179.28 2nnc h ALA 18 N 1.55 0.90 0.05 0.00 0.00 -1.15 0.48 119.26 121.10 2nnc h ALA 18 Ca 0.25 -0.45 -0.00 0.00 0.00 0.00 0.00 54.91 54.71 2nnc h ALA 18 Cb -0.08 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.61 2nnc h ALA 18 CO -0.05 0.64 -0.03 -0.22 0.00 0.00 0.00 179.25 179.59 2nnc h LYS 19 N 0.37 -0.07 0.00 0.00 1.63 -1.29 -3.41 116.57 113.80 2nnc h LYS 19 Ca 0.03 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.83 2nnc h LYS 19 Cb 0.92 0.02 0.00 0.00 -0.60 0.00 0.00 32.23 32.56 2nnc h LYS 19 CO 0.08 0.42 -0.57 1.19 -3.45 0.00 0.00 179.45 177.13 2nnc n PHE 20 N -4.88 0.00 -4.19 1.91 3.01 0.06 -5.11 117.46 108.26 2nnc n PHE 20 Ca -0.09 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.37 2nnc n PHE 20 Cb 0.27 -0.01 0.00 0.00 -0.01 0.00 0.00 39.48 39.73 2nnc n PHE 20 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2nnc n GLY 21 N 1.29 -1.51 3.30 1.37 0.00 0.17 -4.55 105.19 105.26 2nnc n GLY 21 Ca 0.02 -1.29 -0.44 0.00 0.00 0.00 0.00 46.02 44.31 2nnc n GLY 21 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2nnc n SER 22 N -0.12 5.25 -4.70 1.61 7.64 -1.26 -4.36 113.62 117.68 2nnc n SER 22 Ca 0.00 -3.03 -0.24 0.00 1.01 0.00 0.00 58.87 56.61 2nnc n SER 22 Cb 0.00 -1.53 -0.07 0.00 -1.01 0.00 0.00 64.21 61.61 2nnc n SER 22 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2nnc s LEU 23 N 0.83 3.41 0.24 -3.43 1.43 -1.26 -5.08 118.68 114.82 2nnc s LEU 23 Ca 0.41 -0.44 -0.30 0.00 -1.03 0.00 0.00 54.13 52.77 2nnc s LEU 23 Cb -0.00 -1.98 -0.09 0.00 0.03 0.00 0.00 46.19 44.15 2nnc s LEU 23 CO 0.00 0.02 1.23 -2.84 0.23 0.00 0.00 176.35 174.99 2nnc s PRO 24 N -3.44 4.47 -0.01 1.29 0.02 -1.26 -4.80 135.00 131.27 2nnc s PRO 24 Ca 0.30 1.98 0.03 0.00 0.02 0.00 0.00 61.00 63.33 2nnc s PRO 24 Cb -0.08 -3.18 -0.03 0.00 0.02 0.00 0.00 34.50 31.23 2nnc s PRO 24 CO 0.21 -0.08 -0.07 -1.50 -0.33 0.00 0.00 177.00 175.23 2nnc s ILE 25 N -0.52 3.63 -0.04 2.83 2.07 -1.26 0.22 121.20 128.13 2nnc s ILE 25 Ca 0.51 -0.75 -0.08 0.00 -1.41 0.00 0.00 60.65 58.92 2nnc s ILE 25 Cb -0.35 -2.56 0.01 0.00 0.13 0.00 0.00 42.46 39.69 2nnc s ILE 25 CO 0.42 0.42 0.19 0.00 -1.91 0.00 0.00 174.94 174.06 2nnc s GLN 26 N -1.34 0.39 0.55 3.50 -2.07 -0.62 -4.97 119.66 115.11 2nnc s GLN 26 Ca 0.16 -0.03 -0.21 0.00 -1.82 0.00 0.00 55.36 53.47 2nnc s GLN 26 Cb -0.11 0.17 -0.04 0.00 -1.09 0.00 0.00 33.01 31.94 2nnc s GLN 26 CO 0.07 -0.08 1.33 -1.21 -1.32 0.00 0.00 175.29 174.07 2nnc s GLU 27 N -0.62 3.10 -0.05 9.60 0.41 -1.26 -0.86 118.70 129.02 2nnc s GLU 27 Ca -0.07 2.16 -0.03 0.00 -0.41 0.00 0.00 54.97 56.61 2nnc s GLU 27 Cb -0.04 -2.20 0.02 0.00 -1.78 0.00 0.00 34.13 30.13 2nnc s GLU 27 CO 0.01 -1.19 0.12 0.45 -0.49 0.00 0.00 175.26 174.16 2nnc s SER 28 N -1.08 -0.10 0.00 -0.19 0.15 -0.03 -4.72 113.70 107.74 2nnc s SER 28 Ca 0.73 0.25 0.25 0.00 0.70 0.00 0.00 55.95 57.87 2nnc s SER 28 Cb -0.39 0.19 0.97 0.00 -1.71 0.00 0.00 66.02 65.09 2nnc s SER 28 CO 0.45 -0.09 1.68 0.35 1.20 0.00 0.00 173.24 176.83 2nnc n THR 29 N 3.57 0.09 0.74 6.45 -2.24 -1.26 -4.13 114.28 117.51 2nnc n THR 29 Ca -0.19 -0.27 0.03 0.00 -2.27 0.00 0.00 64.05 61.35 2nnc n THR 29 Cb 0.56 0.34 0.11 0.00 -2.10 0.00 0.00 70.33 69.24 2nnc n THR 29 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2nnc n ALA 30 N 0.12 2.75 -3.91 6.98 0.00 -1.26 -4.66 120.51 120.53 2nnc n ALA 30 Ca 0.18 -0.51 -0.31 0.00 0.00 0.00 0.00 53.44 52.80 2nnc n ALA 30 Cb 0.31 -1.02 -0.16 0.00 0.00 0.00 0.00 19.45 18.58 2nnc n ALA 30 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2nnc s ILE 31 N -1.59 1.80 -0.18 0.00 1.01 -1.26 -1.83 121.20 119.14 2nnc s ILE 31 Ca 0.16 -0.79 -0.08 0.00 0.00 0.00 0.00 60.65 59.94 2nnc s ILE 31 Cb 0.11 -1.64 -0.04 0.00 0.01 0.00 0.00 42.46 40.90 2nnc s ILE 31 CO 0.07 0.50 0.07 -1.10 0.00 0.00 0.00 174.94 174.48 2nnc s GLN 32 N 1.21 4.00 -0.16 2.79 1.11 -0.01 -4.94 119.66 123.65 2nnc s GLN 32 Ca 0.01 -0.32 0.01 0.00 0.01 0.00 0.00 55.36 55.06 2nnc s GLN 32 Cb -0.14 -3.24 0.02 0.00 -1.01 0.00 0.00 33.01 28.64 2nnc s GLN 32 CO -0.08 0.29 -0.16 0.42 0.01 0.00 0.00 175.29 175.77 2nnc s ILE 33 N 0.34 1.71 -0.18 1.08 1.01 -1.26 -1.25 121.20 122.64 2nnc s ILE 33 Ca 0.04 -0.74 -0.03 0.00 0.00 0.00 0.00 60.65 59.92 2nnc s ILE 33 Cb -0.12 -1.59 -0.02 0.00 0.01 0.00 0.00 42.46 40.74 2nnc s ILE 33 CO -0.00 0.46 -0.05 -0.54 0.00 0.00 0.00 174.94 174.81 2nnc s LYS 34 N 1.43 3.49 0.02 2.79 1.02 0.15 -5.00 119.74 123.63 2nnc s LYS 34 Ca 0.05 -0.59 -0.28 0.00 0.02 0.00 0.00 55.97 55.16 2nnc s LYS 34 Cb -0.13 -2.92 0.08 0.00 -0.52 0.00 0.00 37.83 34.34 2nnc s LYS 34 CO -0.11 0.04 0.69 0.00 -0.92 0.00 0.00 175.35 175.04 2nnc s ALA 35 N 0.88 -1.73 0.49 5.17 0.00 -1.26 -1.22 121.76 124.09 2nnc s ALA 35 Ca -0.01 1.04 -0.23 0.00 0.00 0.00 0.00 51.96 52.76 2nnc s ALA 35 Cb -0.15 0.28 -0.06 0.00 0.00 0.00 0.00 23.12 23.19 2nnc s ALA 35 CO 0.01 -0.52 1.28 -1.25 0.00 0.00 0.00 175.76 175.28 2nnc s PRO 36 N -2.18 3.51 0.18 0.00 0.04 -1.26 -4.93 135.00 130.35 2nnc s PRO 36 Ca -0.05 2.05 -0.12 0.00 0.04 0.00 0.00 61.00 62.92 2nnc s PRO 36 Cb -0.00 -2.39 0.10 0.00 0.04 0.00 0.00 34.50 32.24 2nnc s PRO 36 CO 0.00 -0.84 1.80 1.49 0.04 0.00 0.00 177.00 179.49 2nnc h GLU 37 N 1.87 0.87 -5.08 4.56 4.81 -1.94 -3.43 114.58 116.24 2nnc h GLU 37 Ca -0.50 -0.10 -0.39 0.00 -0.13 0.00 0.00 59.36 58.24 2nnc h GLU 37 Cb 1.27 -0.17 -0.23 0.00 0.63 0.00 0.00 28.75 30.25 2nnc h GLU 37 CO 0.59 0.66 -0.77 -1.50 -0.73 0.00 0.00 179.01 177.26 2nnc s ILE 38 N -5.86 0.93 0.02 2.32 2.07 -1.26 -1.66 121.20 117.77 2nnc s ILE 38 Ca -0.13 -1.05 0.00 0.00 -1.41 0.00 0.00 60.65 58.06 2nnc s ILE 38 Cb 0.13 -0.89 -0.02 0.00 0.13 0.00 0.00 42.46 41.81 2nnc s ILE 38 CO 0.78 -0.14 -0.04 0.00 -1.91 0.00 0.00 174.94 173.62 2nnc s ALA 39 N -1.04 0.22 0.30 1.50 0.00 0.55 -4.94 121.76 118.35 2nnc s ALA 39 Ca -0.02 -0.62 -0.29 0.00 0.00 0.00 0.00 51.96 51.03 2nnc s ALA 39 Cb -0.09 0.13 -0.10 0.00 0.00 0.00 0.00 23.12 23.06 2nnc s ALA 39 CO 0.01 -0.13 1.14 -1.21 0.00 0.00 0.00 175.76 175.58 2nnc s GLU 40 N -1.47 4.53 -0.09 0.00 2.02 -1.26 -0.96 118.70 121.47 2nnc s GLU 40 Ca -0.15 1.88 -0.36 0.00 0.02 0.00 0.00 54.97 56.37 2nnc s GLU 40 Cb -0.10 -3.11 -0.13 0.00 0.10 0.00 0.00 34.13 30.89 2nnc s GLU 40 CO -0.01 0.08 1.76 -1.71 0.02 0.00 0.00 175.26 175.40 2nnc n ASN 41 N 0.99 2.97 0.00 -0.19 4.05 -1.21 -1.74 115.26 120.14 2nnc n ASN 41 Ca -0.00 1.03 0.00 0.00 0.45 0.00 0.00 54.58 56.05 2nnc n ASN 41 Cb 0.44 -1.30 0.00 0.00 1.23 0.00 0.00 39.78 40.15 2nnc n ASN 41 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 2nnc n GLY 42 N 4.05 1.24 3.77 8.20 0.00 -0.24 -5.03 105.19 117.19 2nnc n GLY 42 Ca 0.22 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.87 2nnc n GLY 42 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2nnc s ALA 43 N -2.52 3.22 0.18 4.61 0.00 -0.71 -4.67 121.76 121.88 2nnc s ALA 43 Ca 0.00 0.67 -0.30 0.00 0.00 0.00 0.00 51.96 52.33 2nnc s ALA 43 Cb 0.00 -3.25 -0.08 0.00 0.00 0.00 0.00 23.12 19.79 2nnc s ALA 43 CO 0.00 -0.03 1.16 -0.06 0.00 0.00 0.00 175.76 176.83 2nnc s PHE 44 N -1.49 3.49 -0.04 0.00 0.40 -1.26 -1.97 117.98 117.10 2nnc s PHE 44 Ca 0.51 1.49 0.03 0.00 -0.60 0.00 0.00 56.93 58.36 2nnc s PHE 44 Cb -0.23 -3.37 0.00 0.00 0.51 0.00 0.00 43.02 39.93 2nnc s PHE 44 CO 0.29 -0.97 -0.13 0.08 0.70 0.00 0.00 175.22 175.19 2nnc s VAL 45 N -0.15 1.10 0.07 -0.44 1.01 0.00 -4.89 120.40 117.10 2nnc s VAL 45 Ca 0.51 -0.52 -0.31 0.00 0.00 0.00 0.00 61.98 61.66 2nnc s VAL 45 Cb -0.31 -0.97 -0.06 0.00 0.00 0.00 0.00 36.38 35.03 2nnc s VAL 45 CO 0.36 0.33 1.23 -2.16 0.00 0.00 0.00 175.10 174.87 2nnc s PRO 46 N 0.22 4.41 -0.06 2.72 0.04 -1.26 -1.10 135.00 139.98 2nnc s PRO 46 Ca -0.06 1.83 0.03 0.00 0.04 0.00 0.00 61.00 62.84 2nnc s PRO 46 Cb -0.11 -3.33 0.01 0.00 0.04 0.00 0.00 34.50 31.11 2nnc s PRO 46 CO 0.02 -0.29 -0.14 0.08 0.04 0.00 0.00 177.00 176.71 2nnc s VAL 47 N 1.05 1.21 -0.00 -0.36 1.01 0.12 -4.39 120.40 119.03 2nnc s VAL 47 Ca 0.60 -0.55 0.05 0.00 0.00 0.00 0.00 61.98 62.08 2nnc s VAL 47 Cb -0.31 -1.08 -0.01 0.00 0.00 0.00 0.00 36.38 34.98 2nnc s VAL 47 CO 0.29 0.36 -0.17 0.42 0.00 0.00 0.00 175.10 176.01 2nnc s THR 48 N 0.44 1.34 0.03 3.92 -4.23 -0.36 -0.53 115.64 116.25 2nnc s THR 48 Ca -0.11 -0.78 0.06 0.00 -1.18 0.00 0.00 61.69 59.69 2nnc s THR 48 Cb -0.14 -1.13 -0.02 0.00 1.34 0.00 0.00 72.50 72.55 2nnc s THR 48 CO 0.03 0.33 -0.19 0.68 -0.54 0.00 0.00 174.62 174.94 2nnc s VAL 49 N -0.46 1.50 0.17 2.29 -7.23 0.11 -0.68 120.40 116.10 2nnc s VAL 49 Ca 0.06 -1.06 -0.08 0.00 -1.81 0.00 0.00 61.98 59.09 2nnc s VAL 49 Cb -0.07 -1.30 -0.01 0.00 0.56 0.00 0.00 36.38 35.56 2nnc s VAL 49 CO -0.00 0.21 0.26 0.00 -0.31 0.00 0.00 175.10 175.26 2nnc s ALA 50 N -0.72 0.13 -0.05 1.32 0.00 -0.38 -0.86 121.76 121.19 2nnc s ALA 50 Ca 0.06 -0.98 -0.15 0.00 0.00 0.00 0.00 51.96 50.89 2nnc s ALA 50 Cb -0.08 0.89 0.03 0.00 0.00 0.00 0.00 23.12 23.96 2nnc s ALA 50 CO 0.01 -0.64 0.35 -0.08 0.00 0.00 0.00 175.76 175.40 2nnc s THR 51 N -3.99 0.04 -2.16 0.00 -1.32 -1.19 -0.83 115.64 106.20 2nnc s THR 51 Ca 0.19 -0.32 0.22 0.00 -1.21 0.00 0.00 61.69 60.56 2nnc s THR 51 Cb 0.04 -0.61 0.04 0.00 -1.51 0.00 0.00 72.50 70.46 2nnc s THR 51 CO 0.01 -0.18 1.08 -1.54 -2.21 0.00 0.00 174.62 171.79 2nnc n SER 52 N 1.67 2.20 -4.62 8.08 3.41 -0.76 -4.33 113.62 119.27 2nnc n SER 52 Ca -0.19 -1.60 -0.43 0.00 -0.26 0.00 0.00 58.87 56.39 2nnc n SER 52 Cb 0.56 0.35 -0.03 0.00 -0.26 0.00 0.00 64.21 64.83 2nnc n SER 52 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 2nnc s ILE 53 N -2.22 3.09 0.14 -1.33 1.01 -1.26 -4.88 121.20 115.76 2nnc s ILE 53 Ca 0.20 0.10 -0.20 0.00 0.00 0.00 0.00 60.65 60.75 2nnc s ILE 53 Cb 0.17 -3.10 0.02 0.00 0.01 0.00 0.00 42.46 39.56 2nnc s ILE 53 CO 0.47 -0.05 1.67 -0.65 0.00 0.00 0.00 174.94 176.38 2nnc h PRO 54 N 13.28 -0.09 -0.05 2.79 0.11 -1.98 -2.09 132.00 143.96 2nnc h PRO 54 Ca -0.43 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.69 2nnc h PRO 54 Cb 1.23 0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.36 2nnc h PRO 54 CO 0.96 -0.06 0.00 0.41 -0.21 0.00 0.00 178.00 179.10 2nnc n GLY 55 N -1.29 -0.75 3.68 -0.55 0.00 -1.26 -1.25 105.19 103.77 2nnc n GLY 55 Ca -0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.59 2nnc n GLY 55 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2nnc s ALA 56 N -1.94 3.68 -0.94 4.61 0.00 -0.79 -4.01 121.76 122.36 2nnc s ALA 56 Ca 0.00 1.33 0.11 0.00 0.00 0.00 0.00 51.96 53.40 2nnc s ALA 56 Cb 0.00 -3.78 -0.03 0.00 0.00 0.00 0.00 23.12 19.32 2nnc s ALA 56 CO 0.00 -1.33 0.64 0.25 0.00 0.00 0.00 175.76 175.33 2nnc n THR 57 N 5.05 0.00 -3.65 0.00 -2.24 -0.03 -3.94 114.28 109.48 2nnc n THR 57 Ca 0.18 -0.35 -0.14 0.00 -2.27 0.00 0.00 64.05 61.46 2nnc n THR 57 Cb 0.40 1.11 -0.08 0.00 -2.10 0.00 0.00 70.33 69.66 2nnc n THR 57 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 2nnc s ASN 58 N -1.61 -0.61 -0.10 3.42 3.84 -1.20 -1.04 114.94 117.64 2nnc s ASN 58 Ca 0.08 1.05 0.00 0.00 0.21 0.00 0.00 52.86 54.21 2nnc s ASN 58 Cb 0.09 1.05 0.02 0.00 -0.55 0.00 0.00 41.25 41.86 2nnc s ASN 58 CO 0.32 -0.31 -0.07 -0.51 -2.79 0.00 0.00 177.10 173.75 2nnc s ILE 59 N -0.08 0.93 0.10 -5.21 2.07 -0.72 -1.74 121.20 116.55 2nnc s ILE 59 Ca -0.03 -0.26 0.10 0.00 -1.41 0.00 0.00 60.65 59.05 2nnc s ILE 59 Cb -0.04 -0.95 -0.04 0.00 0.13 0.00 0.00 42.46 41.57 2nnc s ILE 59 CO 0.03 0.34 -0.26 -0.44 -1.91 0.00 0.00 174.94 172.70 2nnc s SER 60 N 1.50 3.18 -0.15 4.50 0.01 0.04 -0.69 113.70 122.09 2nnc s SER 60 Ca 0.00 -0.69 0.02 0.00 1.31 0.00 0.00 55.95 56.60 2nnc s SER 60 Cb -0.13 -0.24 0.01 0.00 0.21 0.00 0.00 66.02 65.88 2nnc s SER 60 CO -0.05 0.20 -0.21 -0.63 0.41 0.00 0.00 173.24 172.96 2nnc s ILE 61 N -0.98 2.12 0.01 1.44 1.01 0.21 -1.34 121.20 123.67 2nnc s ILE 61 Ca 0.13 -0.95 0.06 0.00 0.00 0.00 0.00 60.65 59.89 2nnc s ILE 61 Cb -0.10 -1.86 -0.03 0.00 0.01 0.00 0.00 42.46 40.48 2nnc s ILE 61 CO 0.04 0.54 -0.16 -0.36 0.00 0.00 0.00 174.94 175.01 2nnc s PHE 62 N 0.98 2.62 -0.54 3.97 0.40 0.14 -0.30 117.98 125.25 2nnc s PHE 62 Ca -0.03 -0.22 0.04 0.00 -0.60 0.00 0.00 56.93 56.12 2nnc s PHE 62 Cb -0.15 -1.52 0.16 0.00 0.51 0.00 0.00 43.02 42.02 2nnc s PHE 62 CO -0.05 0.24 0.36 0.95 0.70 0.00 0.00 175.22 177.42 2nnc s THR 63 N -0.87 1.73 -0.05 0.64 -4.23 0.17 -0.84 115.64 112.19 2nnc s THR 63 Ca 0.14 -3.27 0.30 0.00 -1.18 0.00 0.00 61.69 57.68 2nnc s THR 63 Cb -0.11 -2.17 0.32 0.00 1.34 0.00 0.00 72.50 71.89 2nnc s THR 63 CO 0.04 -1.03 1.90 1.55 -0.54 0.00 0.00 174.62 176.55 2nnc h PRO 64 N 5.91 0.00 0.00 3.99 0.13 -1.76 -0.48 132.00 139.79 2nnc h PRO 64 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 2nnc h PRO 64 Cb 0.85 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.98 2nnc h PRO 64 CO 0.55 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.32 2nnc h ALA 65 N 2.09 1.00 -2.21 -0.56 0.00 -1.93 -3.46 119.26 114.19 2nnc h ALA 65 Ca 0.00 0.00 -0.47 0.00 0.00 0.00 0.00 54.91 54.44 2nnc h ALA 65 Cb 0.29 0.00 0.04 0.00 0.00 0.00 0.00 17.79 18.11 2nnc h ALA 65 CO 0.00 0.00 0.04 -0.80 0.00 0.00 0.00 179.25 178.49 2nnc s ASN 66 N -5.62 5.89 0.26 0.00 0.01 -0.19 -4.99 114.94 110.30 2nnc s ASN 66 Ca 0.06 0.60 -0.03 0.00 -0.71 0.00 0.00 52.86 52.78 2nnc s ASN 66 Cb 0.08 -1.81 0.42 0.00 0.41 0.00 0.00 41.25 40.35 2nnc s ASN 66 CO 0.60 -0.76 1.85 0.15 -1.51 0.00 0.00 177.10 177.42 2nnc h PHE 67 N 0.19 1.06 -3.38 2.20 3.57 -1.91 -3.28 116.94 115.39 2nnc h PHE 67 Ca -0.46 0.03 -0.74 0.00 3.53 0.00 0.00 57.97 60.33 2nnc h PHE 67 Cb 1.24 -0.34 -0.29 0.00 2.79 0.00 0.00 35.95 39.35 2nnc h PHE 67 CO 0.50 0.49 -0.29 -1.12 -2.23 0.00 0.00 178.31 175.66 2nnc s SER 68 N -5.76 5.88 0.46 0.41 0.01 -1.26 -4.96 113.70 108.48 2nnc s SER 68 Ca -0.12 -2.14 0.24 0.00 1.31 0.00 0.00 55.95 55.23 2nnc s SER 68 Cb 0.20 -2.05 1.10 0.00 0.21 0.00 0.00 66.02 65.48 2nnc s SER 68 CO 0.80 -0.66 1.92 -0.65 0.41 0.00 0.00 173.24 175.06 2nnc h PRO 69 N 8.23 0.00 -4.90 12.44 0.11 -1.75 -3.41 132.00 142.72 2nnc h PRO 69 Ca -0.15 0.00 -0.64 0.00 0.11 0.00 0.00 66.00 65.32 2nnc h PRO 69 Cb 1.06 0.00 -0.18 0.00 0.11 0.00 0.00 31.00 31.99 2nnc h PRO 69 CO 0.85 0.21 -0.54 1.41 -0.21 0.00 0.00 178.00 179.73 2nnc s MET 70 N -3.92 3.88 -0.09 1.05 1.75 -1.26 0.45 119.30 121.16 2nnc s MET 70 Ca -0.01 -0.36 0.05 0.00 -1.25 0.00 0.00 55.69 54.11 2nnc s MET 70 Cb 0.12 -3.60 -0.24 0.00 2.84 0.00 0.00 34.83 33.94 2nnc s MET 70 CO 0.63 -0.19 0.48 0.28 -0.65 0.00 0.00 175.02 175.56 2nnc n VAL 71 N 5.04 1.66 -3.54 10.11 0.31 0.59 -4.97 118.33 127.53 2nnc n VAL 71 Ca -0.14 -0.74 -0.14 0.00 -0.01 0.00 0.00 64.34 63.31 2nnc n VAL 71 Cb 0.52 -1.30 -0.05 0.00 -0.91 0.00 0.00 33.84 32.10 2nnc n VAL 71 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2nnc s ALA 72 N -2.57 -1.84 -0.12 3.52 0.00 -1.17 -5.00 121.76 114.57 2nnc s ALA 72 Ca -0.13 1.40 -0.04 0.00 0.00 0.00 0.00 51.96 53.19 2nnc s ALA 72 Cb 0.07 -0.28 0.06 0.00 0.00 0.00 0.00 23.12 22.97 2nnc s ALA 72 CO 0.79 -0.37 0.22 0.45 0.00 0.00 0.00 175.76 176.86 2nnc s SER 73 N -1.28 0.61 -0.41 0.00 0.15 -1.26 -0.62 113.70 110.89 2nnc s SER 73 Ca -0.05 0.41 -0.01 0.00 0.70 0.00 0.00 55.95 56.99 2nnc s SER 73 Cb -0.00 0.52 0.11 0.00 -1.71 0.00 0.00 66.02 64.94 2nnc s SER 73 CO 0.04 -0.25 0.19 0.12 1.20 0.00 0.00 173.24 174.54 2nnc s PHE 74 N 2.37 3.60 -0.01 3.44 5.36 0.13 -5.00 117.98 127.88 2nnc s PHE 74 Ca 0.03 -2.58 -0.30 0.00 -0.96 0.00 0.00 56.93 53.12 2nnc s PHE 74 Cb -0.12 -3.16 -0.03 0.00 -0.34 0.00 0.00 43.02 39.37 2nnc s PHE 74 CO -0.08 -0.95 1.04 -0.51 -1.46 0.00 0.00 175.22 173.25 2nnc s ASP 75 N 1.51 7.28 0.05 6.13 1.01 -1.26 -1.75 116.67 129.63 2nnc s ASP 75 Ca 0.10 1.71 -0.05 0.00 0.71 0.00 0.00 52.55 55.02 2nnc s ASP 75 Cb -0.22 -2.57 -0.01 0.00 1.01 0.00 0.00 42.92 41.13 2nnc s ASP 75 CO -0.05 -0.35 0.09 0.68 0.21 0.00 0.00 175.17 175.75 2nnc s VAL 76 N 1.26 0.15 0.62 -1.27 -7.23 -0.21 -4.98 120.40 108.75 2nnc s VAL 76 Ca 0.53 -1.23 -0.15 0.00 -1.81 0.00 0.00 61.98 59.33 2nnc s VAL 76 Cb -0.22 -1.08 -0.02 0.00 0.56 0.00 0.00 36.38 35.62 2nnc s VAL 76 CO 0.26 -0.68 1.06 -0.76 -0.31 0.00 0.00 175.10 174.68 2nnc s LEU 77 N -2.39 3.41 0.72 1.32 1.43 -1.26 -4.24 118.68 117.67 2nnc s LEU 77 Ca -0.01 1.80 -0.14 0.00 -1.03 0.00 0.00 54.13 54.75 2nnc s LEU 77 Cb 0.01 -4.53 0.03 0.00 0.03 0.00 0.00 46.19 41.74 2nnc s LEU 77 CO -0.07 -1.29 1.14 -2.84 0.23 0.00 0.00 176.35 173.53 2nnc s PRO 78 N -4.27 2.33 -0.41 1.29 0.02 -1.25 -3.74 135.00 128.97 2nnc s PRO 78 Ca 0.63 1.50 0.00 0.00 0.02 0.00 0.00 61.00 63.14 2nnc s PRO 78 Cb -0.16 -1.88 0.00 0.00 0.02 0.00 0.00 34.50 32.48 2nnc s PRO 78 CO 0.41 -1.63 0.00 2.89 -0.33 0.00 0.00 177.00 178.34 2nnc n ARG 79 N -2.84 -0.65 -0.12 5.54 -4.01 -0.38 -4.91 116.66 109.28 2nnc n ARG 79 Ca 0.11 0.48 0.12 0.00 -1.04 0.00 0.00 57.85 57.52 2nnc n ARG 79 Cb 0.52 -4.17 0.21 0.00 -3.04 0.00 0.00 32.46 25.98 2nnc n ARG 79 CO 0.00 0.00 0.00 -1.33 -3.04 0.00 0.00 177.63 173.26 2nnc n MET 80 N -2.13 2.36 -3.54 2.89 2.81 -1.25 -5.00 117.12 113.26 2nnc n MET 80 Ca -0.04 -2.03 -0.25 0.00 -1.81 0.00 0.00 57.70 53.57 2nnc n MET 80 Cb 0.22 -1.49 0.01 0.00 -0.71 0.00 0.00 33.22 31.25 2nnc n MET 80 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 2nnc n LYS 81 N 1.29 -1.45 -2.32 0.03 5.02 -1.26 -4.80 118.16 114.68 2nnc n LYS 81 Ca 0.18 0.80 -0.35 0.00 -2.02 0.00 0.00 58.31 56.91 2nnc n LYS 81 Cb 0.57 -1.89 -0.01 0.00 -0.02 0.00 0.00 35.03 33.68 2nnc n LYS 81 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 2nnc s PRO 82 N -4.00 3.57 0.04 1.97 0.04 -1.26 -4.85 135.00 130.51 2nnc s PRO 82 Ca 0.09 1.61 0.04 0.00 0.04 0.00 0.00 61.00 62.78 2nnc s PRO 82 Cb -0.01 -2.15 -0.02 0.00 0.04 0.00 0.00 34.50 32.36 2nnc s PRO 82 CO 0.79 -0.67 -0.12 -2.00 0.04 0.00 0.00 177.00 175.04 2nnc s GLU 83 N -3.08 0.76 -0.03 4.56 2.12 -1.26 -3.14 118.70 118.62 2nnc s GLU 83 Ca 0.69 -0.74 0.04 0.00 0.36 0.00 0.00 54.97 55.31 2nnc s GLU 83 Cb -0.24 -0.70 -0.00 0.00 0.26 0.00 0.00 34.13 33.44 2nnc s GLU 83 CO 0.28 0.16 -0.14 0.08 -0.54 0.00 0.00 175.26 175.10 2nnc s VAL 84 N -1.00 1.19 -0.03 3.70 1.01 -0.04 -5.00 120.40 120.22 2nnc s VAL 84 Ca -0.02 -0.60 0.03 0.00 0.00 0.00 0.00 61.98 61.39 2nnc s VAL 84 Cb -0.08 -1.02 0.00 0.00 0.00 0.00 0.00 36.38 35.28 2nnc s VAL 84 CO 0.01 0.35 -0.11 -0.55 0.00 0.00 0.00 175.10 174.80 2nnc s SER 85 N -0.01 1.47 0.30 3.32 0.15 -1.26 0.08 113.70 117.75 2nnc s SER 85 Ca -0.01 -0.23 -0.10 0.00 0.70 0.00 0.00 55.95 56.31 2nnc s SER 85 Cb -0.09 -0.43 0.01 0.00 -1.71 0.00 0.00 66.02 63.79 2nnc s SER 85 CO 0.01 0.08 0.52 -1.48 1.20 0.00 0.00 173.24 173.56 2nnc s LEU 86 N 0.22 0.52 -0.19 3.45 0.05 0.31 -5.01 118.68 118.04 2nnc s LEU 86 Ca -0.05 -1.15 -0.04 0.00 0.05 0.00 0.00 54.13 52.94 2nnc s LEU 86 Cb -0.10 1.80 -0.02 0.00 -2.05 0.00 0.00 46.19 45.81 2nnc s LEU 86 CO 0.01 -1.27 -0.03 -0.13 -0.55 0.00 0.00 176.35 174.39 2nnc s ARG 87 N -3.46 3.56 -0.06 1.48 1.81 -1.26 -0.71 118.95 120.31 2nnc s ARG 87 Ca 0.24 -0.56 0.05 0.00 -1.72 0.00 0.00 55.73 53.75 2nnc s ARG 87 Cb -0.01 -3.00 -0.01 0.00 -0.45 0.00 0.00 34.95 31.49 2nnc s ARG 87 CO 0.13 0.03 -0.22 -1.64 -0.68 0.00 0.00 175.30 172.92 2nnc s MET 88 N 0.93 2.38 -0.07 3.54 -1.94 -0.26 -4.83 119.30 119.05 2nnc s MET 88 Ca 0.00 -0.80 -0.30 0.00 -1.71 0.00 0.00 55.69 52.89 2nnc s MET 88 Cb -0.14 -1.98 -0.02 0.00 2.01 0.00 0.00 34.83 34.70 2nnc s MET 88 CO 0.01 0.29 1.00 0.50 -0.01 0.00 0.00 175.02 176.82 2nnc s ARG 89 N 0.02 4.47 -0.42 2.03 3.52 -1.26 -0.82 118.95 126.49 2nnc s ARG 89 Ca -0.07 1.41 -0.17 0.00 -0.13 0.00 0.00 55.73 56.77 2nnc s ARG 89 Cb -0.14 -3.51 0.02 0.00 -1.56 0.00 0.00 34.95 29.76 2nnc s ARG 89 CO 0.04 -0.23 0.40 -1.64 -0.81 0.00 0.00 175.30 173.07 2nnc s MET 90 N 1.67 3.06 -0.11 5.12 -1.94 -0.83 -4.95 119.30 121.31 2nnc s MET 90 Ca 0.50 -0.85 -0.11 0.00 -1.71 0.00 0.00 55.69 53.52 2nnc s MET 90 Cb -0.19 -3.98 -0.10 0.00 2.01 0.00 0.00 34.83 32.57 2nnc s MET 90 CO 0.21 -0.84 0.30 0.00 -0.01 0.00 0.00 175.02 174.69 2nnc h ALA 91 N 8.71 -0.00 -2.67 3.03 0.00 -1.90 -0.61 119.26 125.80 2nnc h ALA 91 Ca -0.27 -0.19 -0.09 0.00 0.00 0.00 0.00 54.91 54.37 2nnc h ALA 91 Cb 1.11 0.00 -0.12 0.00 0.00 0.00 0.00 17.79 18.78 2nnc h ALA 91 CO 0.78 -0.01 -0.27 0.15 0.00 0.00 0.00 179.25 179.91 2nnc s LYS 92 N -1.83 1.18 -0.28 0.00 1.02 -1.26 -4.58 119.74 114.00 2nnc s LYS 92 Ca -0.07 -1.12 -0.39 0.00 0.02 0.00 0.00 55.97 54.41 2nnc s LYS 92 Cb -0.01 0.40 -0.15 0.00 -0.52 0.00 0.00 37.83 37.55 2nnc s LYS 92 CO 0.26 -0.44 1.83 2.41 -0.92 0.00 0.00 175.35 178.49 2nnc n THR 93 N -0.23 0.31 -4.04 2.17 -1.04 -1.26 -4.69 114.28 105.51 2nnc n THR 93 Ca -0.08 -0.08 -0.10 0.00 -2.04 0.00 0.00 64.05 61.75 2nnc n THR 93 Cb 0.63 -1.32 -0.07 0.00 -1.82 0.00 0.00 70.33 67.74 2nnc n THR 93 CO 0.00 0.00 0.00 -1.83 -0.64 0.00 0.00 175.07 172.60 2nnc s GLU 94 N 4.03 1.26 -0.17 -2.82 -1.05 -0.90 -4.95 118.70 114.09 2nnc s GLU 94 Ca 1.00 -1.32 -0.07 0.00 -0.15 0.00 0.00 54.97 54.42 2nnc s GLU 94 Cb -1.02 0.37 -0.04 0.00 -0.44 0.00 0.00 34.13 32.99 2nnc s GLU 94 CO 0.63 -0.46 0.07 -0.80 0.95 0.00 0.00 175.26 175.65 2nnc s ASN 95 N -3.03 5.76 -0.17 0.83 0.01 -1.26 -0.35 114.94 116.72 2nnc s ASN 95 Ca 0.24 0.14 -0.25 0.00 -0.71 0.00 0.00 52.86 52.29 2nnc s ASN 95 Cb 0.03 -1.96 -0.02 0.00 0.41 0.00 0.00 41.25 39.72 2nnc s ASN 95 CO 0.05 0.21 0.80 -0.76 -1.51 0.00 0.00 177.10 175.89 2nnc s LEU 96 N 0.16 4.18 -0.18 0.60 1.43 0.19 -4.36 118.68 120.69 2nnc s LEU 96 Ca 0.05 1.13 -0.00 0.00 -1.03 0.00 0.00 54.13 54.28 2nnc s LEU 96 Cb -0.12 -3.18 0.01 0.00 0.03 0.00 0.00 46.19 42.93 2nnc s LEU 96 CO 0.00 -0.37 -0.15 -0.69 0.23 0.00 0.00 176.35 175.37 2nnc s VAL 97 N 2.06 2.52 -0.09 -1.59 1.01 -0.02 -0.57 120.40 123.72 2nnc s VAL 97 Ca 0.37 -0.80 0.02 0.00 0.00 0.00 0.00 61.98 61.57 2nnc s VAL 97 Cb -0.16 -2.08 -0.02 0.00 0.00 0.00 0.00 36.38 34.12 2nnc s VAL 97 CO 0.12 0.51 -0.14 -0.69 0.00 0.00 0.00 175.10 174.91 2nnc s VAL 98 N 1.16 3.06 -0.07 2.92 1.01 0.58 0.24 120.40 129.30 2nnc s VAL 98 Ca 0.01 -0.69 0.04 0.00 0.00 0.00 0.00 61.98 61.34 2nnc s VAL 98 Cb -0.14 -2.25 0.00 0.00 0.00 0.00 0.00 36.38 34.00 2nnc s VAL 98 CO -0.06 0.56 -0.17 -0.69 0.00 0.00 0.00 175.10 174.73 2nnc s VAL 99 N -0.16 1.51 -0.10 2.92 1.01 -0.45 -1.06 120.40 124.06 2nnc s VAL 99 Ca -0.00 -0.72 0.01 0.00 0.00 0.00 0.00 61.98 61.27 2nnc s VAL 99 Cb -0.13 -1.32 -0.02 0.00 0.00 0.00 0.00 36.38 34.91 2nnc s VAL 99 CO 0.03 0.44 -0.14 -0.69 0.00 0.00 0.00 175.10 174.74 2nnc s VAL 100 N 0.33 3.00 -0.19 2.92 1.01 0.32 -0.78 120.40 127.00 2nnc s VAL 100 Ca -0.11 -0.70 -0.13 0.00 0.00 0.00 0.00 61.98 61.04 2nnc s VAL 100 Cb -0.15 -2.23 -0.05 0.00 0.00 0.00 0.00 36.38 33.96 2nnc s VAL 100 CO 0.04 0.55 0.26 -1.58 0.00 0.00 0.00 175.10 174.37 2nnc s GLN 101 N 0.01 4.20 -0.25 2.72 0.74 -0.71 -0.38 119.66 125.98 2nnc s GLN 101 Ca -0.04 -0.01 -0.03 0.00 0.05 0.00 0.00 55.36 55.32 2nnc s GLN 101 Cb -0.14 -3.47 0.08 0.00 1.10 0.00 0.00 33.01 30.59 2nnc s GLN 101 CO 0.04 0.17 0.09 0.00 -0.55 0.00 0.00 175.29 175.04 2nnc s ALA 102 N 0.71 0.89 0.00 1.58 0.00 -0.71 -0.85 121.76 123.38 2nnc s ALA 102 Ca 0.14 -1.01 0.00 0.00 0.00 0.00 0.00 51.96 51.09 2nnc s ALA 102 Cb -0.13 -1.34 0.00 0.00 0.00 0.00 0.00 23.12 21.65 2nnc s ALA 102 CO 0.04 -1.47 0.00 0.41 0.00 0.00 0.00 175.76 174.74 2nnc n GLY 103 N 5.11 0.77 2.10 0.00 0.00 -1.26 -3.14 105.19 108.77 2nnc n GLY 103 Ca -0.06 -0.70 -0.22 0.00 0.00 0.00 0.00 46.02 45.04 2nnc n GLY 103 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2nnc n GLY 104 N 0.00 4.64 3.31 -0.02 0.00 -1.26 -4.96 105.19 106.90 2nnc n GLY 104 Ca 0.00 -1.19 -0.27 0.00 0.00 0.00 0.00 46.02 44.56 2nnc n GLY 104 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2nnc s LYS 105 N -3.33 1.48 -0.10 1.61 3.01 -1.19 -4.35 119.74 116.88 2nnc s LYS 105 Ca 0.56 -1.09 -0.01 0.00 -1.01 0.00 0.00 55.97 54.42 2nnc s LYS 105 Cb 0.47 -1.70 -0.03 0.00 -1.01 0.00 0.00 37.83 35.56 2nnc s LYS 105 CO 0.09 0.43 -0.06 -0.51 0.51 0.00 0.00 175.35 175.81 2nnc s LEU 106 N -1.44 3.19 -0.05 3.17 1.43 0.13 -1.75 118.68 123.37 2nnc s LEU 106 Ca 0.10 -0.06 0.06 0.00 -1.03 0.00 0.00 54.13 53.20 2nnc s LEU 106 Cb -0.10 -1.72 -0.01 0.00 0.03 0.00 0.00 46.19 44.39 2nnc s LEU 106 CO 0.03 0.30 -0.23 -0.31 0.23 0.00 0.00 176.35 176.37 2nnc s TYR 107 N -0.41 2.18 0.01 0.29 1.51 0.48 -1.58 117.35 119.84 2nnc s TYR 107 Ca 0.06 -0.60 0.04 0.00 -1.01 0.00 0.00 57.07 55.56 2nnc s TYR 107 Cb -0.12 -1.43 -0.02 0.00 -0.11 0.00 0.00 41.96 40.28 2nnc s TYR 107 CO 0.02 -0.17 -0.13 0.50 -1.11 0.00 0.00 175.55 174.66 2nnc s ARG 108 N -0.18 0.98 0.01 -0.62 3.52 -0.04 -0.53 118.95 122.10 2nnc s ARG 108 Ca -0.01 -0.60 0.00 0.00 -0.13 0.00 0.00 55.73 54.99 2nnc s ARG 108 Cb -0.12 -0.97 -0.01 0.00 -1.56 0.00 0.00 34.95 32.29 2nnc s ARG 108 CO 0.02 0.25 -0.02 0.00 -0.81 0.00 0.00 175.30 174.75 2nnc s ALA 109 N -0.56 0.09 -0.02 6.12 0.00 -0.23 -0.85 121.76 126.31 2nnc s ALA 109 Ca 0.03 -0.35 0.03 0.00 0.00 0.00 0.00 51.96 51.68 2nnc s ALA 109 Cb -0.06 0.08 -0.00 0.00 0.00 0.00 0.00 23.12 23.14 2nnc s ALA 109 CO 0.00 -0.09 -0.12 0.08 0.00 0.00 0.00 175.76 175.63 2nnc s VAL 110 N -0.84 0.99 -0.04 0.00 1.01 -1.26 -0.31 120.40 119.94 2nnc s VAL 110 Ca -0.09 -0.50 -0.01 0.00 0.00 0.00 0.00 61.98 61.37 2nnc s VAL 110 Cb -0.06 -0.85 0.03 0.00 0.00 0.00 0.00 36.38 35.51 2nnc s VAL 110 CO -0.01 0.29 0.08 -0.60 0.00 0.00 0.00 175.10 174.87 2nnc s ARG 111 N -0.06 0.01 0.03 2.72 3.52 0.27 -4.98 118.95 120.45 2nnc s ARG 111 Ca 0.01 0.30 -0.23 0.00 -0.13 0.00 0.00 55.73 55.68 2nnc s ARG 111 Cb -0.07 -0.25 -0.06 0.00 -1.56 0.00 0.00 34.95 33.01 2nnc s ARG 111 CO 0.00 -0.19 0.67 -2.00 -0.81 0.00 0.00 175.30 172.97 2nnc s GLU 112 N 1.29 4.40 -0.26 5.12 2.12 -1.26 0.52 118.70 130.63 2nnc s GLU 112 Ca -0.07 0.89 -0.02 0.00 0.36 0.00 0.00 54.97 56.13 2nnc s GLU 112 Cb -0.12 -3.34 0.03 0.00 0.26 0.00 0.00 34.13 30.95 2nnc s GLU 112 CO -0.04 0.36 -0.03 0.08 -0.54 0.00 0.00 175.26 175.08 2nnc s VAL 113 N -0.23 3.05 0.36 3.70 1.01 0.52 -4.85 120.40 123.97 2nnc s VAL 113 Ca 0.34 -1.01 -0.26 0.00 0.00 0.00 0.00 61.98 61.05 2nnc s VAL 113 Cb -0.19 -2.57 -0.09 0.00 0.00 0.00 0.00 36.38 33.52 2nnc s VAL 113 CO 0.20 0.15 1.11 -0.54 0.00 0.00 0.00 175.10 176.02 2nnc s LYS 114 N 1.34 4.29 -0.03 2.72 1.02 -0.66 -2.12 119.74 126.30 2nnc s LYS 114 Ca -0.00 1.73 0.06 0.00 0.02 0.00 0.00 55.97 57.77 2nnc s LYS 114 Cb -0.17 -2.81 -0.01 0.00 -0.52 0.00 0.00 37.83 34.32 2nnc s LYS 114 CO -0.03 -0.08 -0.21 0.08 -0.92 0.00 0.00 175.35 174.19 2nnc s VAL 115 N -1.41 1.66 0.73 3.17 1.01 -1.26 -0.33 120.40 123.97 2nnc s VAL 115 Ca 0.53 -0.88 -0.06 0.00 0.00 0.00 0.00 61.98 61.57 2nnc s VAL 115 Cb -0.28 -1.40 0.09 0.00 0.00 0.00 0.00 36.38 34.79 2nnc s VAL 115 CO 0.36 0.47 1.03 0.42 0.00 0.00 0.00 175.10 177.38 2nnc s THR 116 N -0.28 2.24 0.00 3.92 -4.23 -0.13 -4.56 115.64 112.60 2nnc s THR 116 Ca 0.02 -0.34 0.00 0.00 -1.18 0.00 0.00 61.69 60.20 2nnc s THR 116 Cb -0.10 -2.90 0.00 0.00 1.34 0.00 0.00 72.50 70.84 2nnc s THR 116 CO 0.01 0.00 0.00 -0.38 -0.54 0.00 0.00 174.62 173.71