#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dmc s SER 2 N 0.00 7.14 0.16 1.61 0.01 -1.26 -5.08 113.70 116.28 2dmc s SER 2 Ca 0.00 1.38 0.01 0.00 1.31 0.00 0.00 55.95 58.65 2dmc s SER 2 Cb 0.00 -2.40 -0.04 0.00 0.21 0.00 0.00 66.02 63.79 2dmc s SER 2 CO 0.00 0.22 0.31 -0.94 0.41 0.00 0.00 173.24 173.24 2dmc s SER 3 N -1.23 6.36 -0.13 2.44 1.04 -1.26 -5.02 113.70 115.90 2dmc s SER 3 Ca 0.33 0.25 -0.37 0.00 0.48 0.00 0.00 55.95 56.65 2dmc s SER 3 Cb -0.20 -1.95 -0.14 0.00 0.10 0.00 0.00 66.02 63.84 2dmc s SER 3 CO 0.21 0.03 1.77 0.61 0.98 0.00 0.00 173.24 176.85 2dmc n GLY 4 N -0.53 1.14 3.48 7.32 0.00 -1.26 -4.83 105.19 110.52 2dmc n GLY 4 Ca -0.06 0.86 -0.49 0.00 0.00 0.00 0.00 46.02 46.34 2dmc n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2dmc n SER 5 N 5.66 -0.14 -4.32 1.61 3.41 -1.26 -4.98 113.62 113.60 2dmc n SER 5 Ca 0.23 1.15 -0.16 0.00 -0.26 0.00 0.00 58.87 59.83 2dmc n SER 5 Cb 0.22 -1.06 -0.10 0.00 -0.26 0.00 0.00 64.21 63.01 2dmc n SER 5 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2dmc s SER 6 N -0.64 1.34 -0.35 4.04 1.04 -1.26 -5.10 113.70 112.77 2dmc s SER 6 Ca 0.67 -1.34 0.14 0.00 0.48 0.00 0.00 55.95 55.91 2dmc s SER 6 Cb -0.90 0.12 0.39 0.00 0.10 0.00 0.00 66.02 65.73 2dmc s SER 6 CO 0.56 -0.68 0.82 0.61 0.98 0.00 0.00 173.24 175.54 2dmc n GLY 7 N -0.44 2.81 3.79 7.32 0.00 -1.26 -5.07 105.19 112.33 2dmc n GLY 7 Ca -0.02 -1.52 -0.35 0.00 0.00 0.00 0.00 46.02 44.13 2dmc n GLY 7 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2dmc s ILE 8 N -2.65 3.86 0.53 -0.61 -5.25 -1.26 -5.02 121.20 110.79 2dmc s ILE 8 Ca 0.35 1.33 -0.20 0.00 -0.99 0.00 0.00 60.65 61.14 2dmc s ILE 8 Cb 0.39 -3.64 -0.06 0.00 2.95 0.00 0.00 42.46 42.10 2dmc s ILE 8 CO -0.04 -0.08 1.13 -2.16 -1.79 0.00 0.00 174.94 172.01 2dmc s PRO 9 N -2.72 3.43 0.81 0.37 0.04 -1.26 -5.03 135.00 130.63 2dmc s PRO 9 Ca 0.60 1.64 -0.08 0.00 0.04 0.00 0.00 61.00 63.20 2dmc s PRO 9 Cb -0.19 -2.07 0.14 0.00 0.04 0.00 0.00 34.50 32.42 2dmc s PRO 9 CO 0.24 -0.79 1.12 0.20 0.04 0.00 0.00 177.00 177.81 2dmc s GLY 10 N -1.71 1.75 0.17 0.56 0.00 -1.26 -4.92 107.32 101.91 2dmc s GLY 10 Ca 0.71 -1.35 -0.18 0.00 0.00 0.00 0.00 44.72 43.91 2dmc s GLY 10 CO 0.28 -0.74 0.64 -0.56 0.00 0.00 0.00 173.10 172.72 2dmc s SER 11 N -4.75 6.98 0.00 1.64 0.01 -1.26 -4.91 113.70 111.42 2dmc s SER 11 Ca 0.68 1.27 0.15 0.00 1.31 0.00 0.00 55.95 59.36 2dmc s SER 11 Cb -0.06 -2.36 0.76 0.00 0.21 0.00 0.00 66.02 64.57 2dmc s SER 11 CO 0.48 0.10 1.40 -0.81 0.41 0.00 0.00 173.24 174.82 2dmc n PRO 12 N 0.92 0.23 -1.53 12.44 -0.04 -1.26 -4.66 135.00 141.10 2dmc n PRO 12 Ca -0.05 0.13 -0.13 0.00 -0.04 0.00 0.00 63.50 63.41 2dmc n PRO 12 Cb 0.51 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.38 2dmc n PRO 12 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2dmc n PHE 13 N -1.26 0.91 -3.36 0.54 3.72 -1.26 -4.88 117.46 111.86 2dmc n PHE 13 Ca 0.07 -0.07 -0.38 0.00 -0.05 0.00 0.00 57.45 57.03 2dmc n PHE 13 Cb 0.11 -2.33 -0.06 0.00 -0.94 0.00 0.00 39.48 36.27 2dmc n PHE 13 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 2dmc s THR 14 N 13.79 5.14 -0.19 4.37 -4.23 -1.26 -5.06 115.64 128.20 2dmc s THR 14 Ca 0.87 0.91 -0.29 0.00 -1.18 0.00 0.00 61.69 62.00 2dmc s THR 14 Cb -0.15 -3.79 0.12 0.00 1.34 0.00 0.00 72.50 70.02 2dmc s THR 14 CO 0.15 0.39 0.99 0.00 -0.54 0.00 0.00 174.62 175.61 2dmc s ALA 15 N 0.20 -1.94 -0.02 3.99 0.00 -1.26 -5.07 121.76 117.67 2dmc s ALA 15 Ca 0.25 1.67 -0.25 0.00 0.00 0.00 0.00 51.96 53.62 2dmc s ALA 15 Cb -0.15 -0.90 -0.19 0.00 0.00 0.00 0.00 23.12 21.87 2dmc s ALA 15 CO 0.11 -0.29 1.19 0.87 0.00 0.00 0.00 175.76 177.64 2dmc h LYS 16 N 3.12 -0.09 -6.44 0.00 1.57 -2.05 -3.45 116.57 109.21 2dmc h LYS 16 Ca -0.22 0.01 -0.45 0.00 -1.87 0.00 0.00 60.65 58.12 2dmc h LYS 16 Cb 1.17 0.02 0.24 0.00 0.08 0.00 0.00 32.23 33.73 2dmc h LYS 16 CO 0.25 0.36 -1.52 0.44 -0.57 0.00 0.00 179.45 178.42 2dmc n ILE 17 N -4.91 0.00 -3.74 1.86 -5.35 -1.26 -5.00 119.36 100.97 2dmc n ILE 17 Ca -0.08 -0.20 -0.29 0.00 -0.27 0.00 0.00 62.75 61.90 2dmc n ILE 17 Cb 0.26 -0.43 -0.15 0.00 -1.74 0.00 0.00 39.64 37.58 2dmc n ILE 17 CO 0.00 0.00 0.00 0.42 -1.76 0.00 0.00 176.55 175.21 2dmc s THR 18 N -2.16 0.79 0.05 7.28 -4.23 -1.26 -5.00 115.64 111.12 2dmc s THR 18 Ca 0.49 -1.11 -0.18 0.00 -1.18 0.00 0.00 61.69 59.71 2dmc s THR 18 Cb -0.05 -1.47 -0.15 0.00 1.34 0.00 0.00 72.50 72.18 2dmc s THR 18 CO 0.64 -0.49 1.30 0.44 -0.54 0.00 0.00 174.62 175.97 2dmc h ASP 19 N 8.13 0.58 -0.28 3.99 5.19 -1.98 -3.40 116.42 128.65 2dmc h ASP 19 Ca -0.15 -0.56 -0.01 0.00 -0.62 0.00 0.00 57.03 55.69 2dmc h ASP 19 Cb 1.05 -0.17 -0.00 0.00 0.18 0.00 0.00 39.33 40.39 2dmc h ASP 19 CO 0.43 1.03 0.03 -1.81 -3.12 0.00 0.00 179.24 175.80 2dmc s ASP 20 N -6.49 3.75 -1.03 6.45 1.01 -1.26 -4.81 116.67 114.28 2dmc s ASP 20 Ca -0.13 -0.25 -0.25 0.00 0.71 0.00 0.00 52.55 52.63 2dmc s ASP 20 Cb 0.06 -2.56 -0.18 0.00 1.01 0.00 0.00 42.92 41.25 2dmc s ASP 20 CO 0.81 -4.15 1.99 -0.24 0.21 0.00 0.00 175.17 173.79 2dmc n SER 21 N 19.00 2.14 -4.48 0.27 2.88 -1.26 -4.85 113.62 127.31 2dmc n SER 21 Ca 0.45 -2.59 -0.23 0.00 -1.33 0.00 0.00 58.87 55.17 2dmc n SER 21 Cb 0.44 -1.61 -0.11 0.00 -0.75 0.00 0.00 64.21 62.19 2dmc n SER 21 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2dmc s ARG 22 N 7.32 1.67 -0.19 -1.46 1.70 -1.26 -5.08 118.95 121.64 2dmc s ARG 22 Ca 0.74 -1.88 -0.05 0.00 -0.47 0.00 0.00 55.73 54.07 2dmc s ARG 22 Cb -0.00 -1.24 -0.10 0.00 -0.57 0.00 0.00 34.95 33.04 2dmc s ARG 22 CO 0.17 -0.01 -0.21 0.54 -1.08 0.00 0.00 175.30 174.71 2dmc n ARG 23 N -0.69 0.43 -2.52 3.89 1.74 -1.26 -5.00 116.66 113.25 2dmc n ARG 23 Ca -0.05 0.15 -0.36 0.00 -0.77 0.00 0.00 57.85 56.82 2dmc n ARG 23 Cb 0.65 -1.27 -0.04 0.00 -1.02 0.00 0.00 32.46 30.78 2dmc n ARG 23 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2dmc s SER 25 N -1.57 7.19 -0.23 0.00 0.01 -1.26 -5.02 113.70 112.81 2dmc s SER 25 Ca 0.59 2.24 -0.08 0.00 1.31 0.00 0.00 55.95 60.00 2dmc s SER 25 Cb -0.22 -2.62 -0.04 0.00 0.21 0.00 0.00 66.02 63.36 2dmc s SER 25 CO 0.28 -0.25 0.09 -1.58 0.41 0.00 0.00 173.24 172.18 2dmc s GLN 26 N -0.83 3.85 0.06 12.44 -0.44 -1.26 -4.22 119.66 129.25 2dmc s GLN 26 Ca 0.48 -0.39 0.04 0.00 -2.50 0.00 0.00 55.36 52.99 2dmc s GLN 26 Cb -0.32 -3.35 -0.03 0.00 -1.64 0.00 0.00 33.01 27.68 2dmc s GLN 26 CO 0.39 0.01 -0.11 0.08 0.50 0.00 0.00 175.29 176.15 2dmc s VAL 27 N 1.12 0.84 -0.58 1.34 1.01 -1.26 -4.97 120.40 117.90 2dmc s VAL 27 Ca 0.05 -1.17 -0.22 0.00 0.00 0.00 0.00 61.98 60.64 2dmc s VAL 27 Cb -0.14 -0.84 0.06 0.00 0.00 0.00 0.00 36.38 35.46 2dmc s VAL 27 CO 0.04 -0.28 0.84 -0.54 0.00 0.00 0.00 175.10 175.16 2dmc s LYS 28 N -1.61 3.17 0.38 2.72 -0.14 -1.26 -4.28 119.74 118.72 2dmc s LYS 28 Ca -0.05 -0.73 -0.28 0.00 -1.36 0.00 0.00 55.97 53.54 2dmc s LYS 28 Cb -0.10 -4.15 -0.11 0.00 -1.68 0.00 0.00 37.83 31.79 2dmc s LYS 28 CO 0.01 -1.54 1.49 -1.17 -0.76 0.00 0.00 175.35 173.39 2dmc s LEU 29 N 3.52 4.31 -0.56 3.17 2.96 -1.26 -2.21 118.68 128.61 2dmc s LEU 29 Ca 0.22 3.07 0.00 0.00 -0.22 0.00 0.00 54.13 57.19 2dmc s LEU 29 Cb -0.17 -3.67 0.00 0.00 0.50 0.00 0.00 46.19 42.85 2dmc s LEU 29 CO 0.13 -0.89 0.00 0.61 -1.32 0.00 0.00 176.35 174.87 2dmc n GLY 30 N 0.44 0.79 3.17 7.98 0.00 -0.51 -5.01 105.19 112.04 2dmc n GLY 30 Ca 0.01 -0.82 -0.13 0.00 0.00 0.00 0.00 46.02 45.08 2dmc n GLY 30 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dmc s SER 31 N -2.94 -0.31 -0.19 1.61 0.01 -0.94 -5.01 113.70 105.93 2dmc s SER 31 Ca 0.00 0.60 -0.29 0.00 1.31 0.00 0.00 55.95 57.57 2dmc s SER 31 Cb 0.00 0.58 -0.07 0.00 0.21 0.00 0.00 66.02 66.74 2dmc s SER 31 CO 0.00 -0.12 2.17 0.00 0.41 0.00 0.00 173.24 175.70 2dmc n ALA 32 N 3.23 1.64 -2.67 1.44 0.00 -1.26 -4.48 120.51 118.42 2dmc n ALA 32 Ca -0.16 -0.14 -0.33 0.00 0.00 0.00 0.00 53.44 52.81 2dmc n ALA 32 Cb 0.57 -2.83 -0.13 0.00 0.00 0.00 0.00 19.45 17.06 2dmc n ALA 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2dmc s ALA 33 N 7.48 2.69 0.31 0.00 0.00 -1.08 -4.92 121.76 126.24 2dmc s ALA 33 Ca 1.00 -0.94 -0.12 0.00 0.00 0.00 0.00 51.96 51.90 2dmc s ALA 33 Cb -0.42 -1.08 -0.08 0.00 0.00 0.00 0.00 23.12 21.55 2dmc s ALA 33 CO 0.38 0.46 0.67 0.16 0.00 0.00 0.00 175.76 177.44 2dmc s ASP 34 N -0.41 6.65 -0.06 0.00 -4.77 -1.26 -3.51 116.67 113.31 2dmc s ASP 34 Ca 0.05 1.10 0.00 0.00 -3.30 0.00 0.00 52.55 50.40 2dmc s ASP 34 Cb -0.12 -2.30 0.02 0.00 -1.09 0.00 0.00 42.92 39.43 2dmc s ASP 34 CO 0.02 -0.20 -0.04 -0.36 0.70 0.00 0.00 175.17 175.29 2dmc s PHE 35 N -2.02 0.87 -0.41 2.11 0.08 -0.87 -4.96 117.98 112.78 2dmc s PHE 35 Ca 0.51 -0.29 -0.20 0.00 0.12 0.00 0.00 56.93 57.07 2dmc s PHE 35 Cb -0.11 -0.81 0.02 0.00 -0.57 0.00 0.00 43.02 41.55 2dmc s PHE 35 CO 0.22 -0.29 0.59 -1.17 -0.10 0.00 0.00 175.22 174.48 2dmc s LEU 36 N 1.35 4.48 -0.09 -0.37 2.96 -1.26 -2.74 118.68 122.99 2dmc s LEU 36 Ca -0.04 -0.25 0.04 0.00 -0.22 0.00 0.00 54.13 53.66 2dmc s LEU 36 Cb -0.13 -2.67 0.00 0.00 0.50 0.00 0.00 46.19 43.89 2dmc s LEU 36 CO -0.03 -0.67 -0.22 -1.48 -1.32 0.00 0.00 176.35 172.63 2dmc s LEU 37 N 2.65 2.02 -0.72 -0.68 2.34 -1.22 -5.06 118.68 118.00 2dmc s LEU 37 Ca 0.21 -0.52 -0.27 0.00 0.06 0.00 0.00 54.13 53.61 2dmc s LEU 37 Cb -0.15 -1.32 0.02 0.00 -0.56 0.00 0.00 46.19 44.18 2dmc s LEU 37 CO 0.17 0.14 1.39 -0.62 -1.06 0.00 0.00 176.35 176.36 2dmc s ASP 38 N 0.39 6.01 -0.02 1.48 -1.08 -1.26 -4.69 116.67 117.50 2dmc s ASP 38 Ca -0.18 -0.33 0.03 0.00 -0.52 0.00 0.00 52.55 51.55 2dmc s ASP 38 Cb -0.18 -2.55 -0.00 0.00 -1.46 0.00 0.00 42.92 38.72 2dmc s ASP 38 CO 0.08 -1.93 -0.11 0.27 0.52 0.00 0.00 175.17 174.00 2dmc s ILE 39 N 6.32 0.90 -0.14 4.11 -4.36 -1.26 -4.93 121.20 121.85 2dmc s ILE 39 Ca 0.41 -0.46 0.01 0.00 -0.26 0.00 0.00 60.65 60.35 2dmc s ILE 39 Cb -0.09 -0.77 0.20 0.00 1.25 0.00 0.00 42.46 43.05 2dmc s ILE 39 CO 0.15 0.26 1.26 -1.54 0.24 0.00 0.00 174.94 175.32 2dmc n SER 40 N 2.99 3.20 -4.09 4.36 3.41 -1.26 -4.76 113.62 117.47 2dmc n SER 40 Ca -0.16 -2.46 -0.32 0.00 -0.26 0.00 0.00 58.87 55.67 2dmc n SER 40 Cb 0.55 -0.60 -0.16 0.00 -0.26 0.00 0.00 64.21 63.75 2dmc n SER 40 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 2dmc s GLU 41 N -0.97 2.63 -0.37 4.33 8.01 -1.26 -4.99 118.70 126.07 2dmc s GLU 41 Ca 0.17 -1.01 0.05 0.00 0.01 0.00 0.00 54.97 54.19 2dmc s GLU 41 Cb 0.14 -2.66 0.46 0.00 -4.31 0.00 0.00 34.13 27.76 2dmc s GLU 41 CO 0.03 -0.36 1.40 -2.37 0.01 0.00 0.00 175.26 173.98 2dmc n THR 42 N 4.56 2.76 -3.45 3.63 5.66 -1.26 -4.82 114.28 121.36 2dmc n THR 42 Ca -0.18 -3.79 -0.26 0.00 -3.05 0.00 0.00 64.05 56.77 2dmc n THR 42 Cb 0.47 -1.05 -0.09 0.00 -1.55 0.00 0.00 70.33 68.12 2dmc n THR 42 CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 175.07 172.49 2dmc n ASP 43 N -0.80 2.28 -0.02 1.09 8.00 -1.26 -5.00 116.55 120.84 2dmc n ASP 43 Ca 0.46 -3.10 -0.01 0.00 0.71 0.00 0.00 54.79 52.86 2dmc n ASP 43 Cb 0.90 -0.67 -0.01 0.00 -0.02 0.00 0.00 41.12 41.33 2dmc n ASP 43 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2dmc n LEU 44 N 1.40 -0.05 -0.18 0.64 4.32 -1.26 -0.32 117.00 121.54 2dmc n LEU 44 Ca 0.26 0.87 -0.07 0.00 -0.02 0.00 0.00 56.01 57.05 2dmc n LEU 44 Cb 0.44 -0.40 -0.06 0.00 -1.62 0.00 0.00 43.42 41.78 2dmc n LEU 44 CO 0.29 -0.46 0.49 0.28 -1.22 0.00 0.00 177.39 176.77 2dmc h SER 45 N 0.00 -1.17 -1.23 -1.43 0.02 -1.98 0.84 113.55 108.60 2dmc h SER 45 Ca 0.01 0.17 0.36 0.00 -0.84 0.00 0.00 61.79 61.48 2dmc h SER 45 Cb 0.02 0.50 -0.05 0.00 0.14 0.00 0.00 62.40 63.02 2dmc h SER 45 CO -0.05 -0.17 0.91 0.28 -1.14 0.00 0.00 176.83 176.67 2dmc h SER 46 N -0.08 0.00 -2.79 3.07 0.02 -1.65 -3.40 113.55 108.72 2dmc h SER 46 Ca 0.07 0.00 -0.51 0.00 -0.84 0.00 0.00 61.79 60.52 2dmc h SER 46 Cb 0.27 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.80 2dmc h SER 46 CO -0.46 0.00 -0.28 -0.76 -1.14 0.00 0.00 176.83 174.19 2dmc s LEU 47 N -8.16 4.15 0.21 5.07 1.43 0.29 -2.79 118.68 118.88 2dmc s LEU 47 Ca -0.05 0.41 0.11 0.00 -1.03 0.00 0.00 54.13 53.57 2dmc s LEU 47 Cb 0.23 -3.22 -0.04 0.00 0.03 0.00 0.00 46.19 43.18 2dmc s LEU 47 CO 0.79 -0.14 -0.19 -0.89 0.23 0.00 0.00 176.35 176.15 2dmc s THR 48 N -2.05 2.64 -0.11 5.49 2.01 -0.31 -4.84 115.64 118.48 2dmc s THR 48 Ca 0.39 -2.00 0.00 0.00 0.31 0.00 0.00 61.69 60.39 2dmc s THR 48 Cb -0.10 -2.31 0.02 0.00 0.01 0.00 0.00 72.50 70.12 2dmc s THR 48 CO 0.31 -0.18 -0.10 0.00 -0.69 0.00 0.00 174.62 173.97 2dmc s ALA 49 N -1.86 1.40 -0.06 7.40 0.00 -1.26 -3.95 121.76 123.44 2dmc s ALA 49 Ca 0.24 -0.58 -0.07 0.00 0.00 0.00 0.00 51.96 51.55 2dmc s ALA 49 Cb -0.08 -0.86 0.02 0.00 0.00 0.00 0.00 23.12 22.20 2dmc s ALA 49 CO 0.13 -0.30 0.19 0.45 0.00 0.00 0.00 175.76 176.22 2dmc s SER 50 N 1.45 -0.16 -0.07 0.00 0.15 -1.01 -4.88 113.70 109.18 2dmc s SER 50 Ca 0.01 0.28 -0.03 0.00 0.70 0.00 0.00 55.95 56.91 2dmc s SER 50 Cb -0.13 0.36 0.04 0.00 -1.71 0.00 0.00 66.02 64.58 2dmc s SER 50 CO -0.06 -0.13 0.15 -0.63 1.20 0.00 0.00 173.24 173.77 2dmc s ILE 51 N -0.19 -0.09 -0.28 6.45 1.01 -1.26 0.07 121.20 126.91 2dmc s ILE 51 Ca -0.03 0.21 0.00 0.00 0.00 0.00 0.00 60.65 60.84 2dmc s ILE 51 Cb -0.03 -0.25 0.09 0.00 0.01 0.00 0.00 42.46 42.28 2dmc s ILE 51 CO 0.01 0.09 0.04 -0.75 0.00 0.00 0.00 174.94 174.32 2dmc s LYS 52 N 1.38 1.11 1.03 2.79 2.47 -1.23 -2.45 119.74 124.84 2dmc s LYS 52 Ca -0.07 -1.15 -0.24 0.00 -1.56 0.00 0.00 55.97 52.95 2dmc s LYS 52 Cb -0.12 -2.41 -0.11 0.00 -1.46 0.00 0.00 37.83 33.73 2dmc s LYS 52 CO -0.06 -0.84 -1.04 0.00 0.16 0.00 0.00 175.35 173.58 2dmc n ALA 53 N 4.70 -5.29 0.32 3.13 0.00 -0.08 -4.27 120.51 119.02 2dmc n ALA 53 Ca -0.04 -1.27 0.16 0.00 0.00 0.00 0.00 53.44 52.29 2dmc n ALA 53 Cb 0.43 -1.04 0.65 0.00 0.00 0.00 0.00 19.45 19.49 2dmc n ALA 53 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2dmc h PRO 54 N -1.28 0.00 -0.35 0.00 0.13 -1.88 -2.32 132.00 126.29 2dmc h PRO 54 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 2dmc h PRO 54 Cb 1.38 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.51 2dmc h PRO 54 CO 0.26 0.00 0.00 0.45 -0.23 0.00 0.00 178.00 178.48 2dmc n SER 55 N -2.83 2.86 0.00 1.44 2.88 -1.26 -4.92 113.62 111.80 2dmc n SER 55 Ca 0.01 -1.91 0.00 0.00 -1.33 0.00 0.00 58.87 55.63 2dmc n SER 55 Cb 0.27 -0.23 0.00 0.00 -0.75 0.00 0.00 64.21 63.51 2dmc n SER 55 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dmc n GLY 56 N 1.38 0.51 3.53 0.46 0.00 -0.87 -5.04 105.19 105.16 2dmc n GLY 56 Ca 0.18 -0.88 -0.38 0.00 0.00 0.00 0.00 46.02 44.94 2dmc n GLY 56 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2dmc s ARG 57 N -2.58 3.73 0.59 1.61 0.52 -1.26 -4.86 118.95 116.70 2dmc s ARG 57 Ca 0.00 -0.46 -0.18 0.00 -0.52 0.00 0.00 55.73 54.56 2dmc s ARG 57 Cb 0.00 -3.62 -0.04 0.00 0.52 0.00 0.00 34.95 31.82 2dmc s ARG 57 CO 0.00 -0.26 1.16 0.34 0.02 0.00 0.00 175.30 176.56 2dmc s ASP 58 N 1.71 5.37 0.01 0.23 2.15 -1.26 -0.90 116.67 123.98 2dmc s ASP 58 Ca 0.06 2.24 0.04 0.00 0.43 0.00 0.00 52.55 55.32 2dmc s ASP 58 Cb -0.16 -2.58 -0.01 0.00 -0.30 0.00 0.00 42.92 39.86 2dmc s ASP 58 CO 0.09 -1.46 -0.13 -1.61 -0.17 0.00 0.00 175.17 171.89 2dmc s GLU 59 N -3.44 1.00 -0.86 4.34 0.41 -1.03 -4.89 118.70 114.24 2dmc s GLU 59 Ca 0.74 -0.55 -0.25 0.00 -0.41 0.00 0.00 54.97 54.50 2dmc s GLU 59 Cb -0.26 -0.98 -0.04 0.00 -1.78 0.00 0.00 34.13 31.07 2dmc s GLU 59 CO 0.32 0.26 1.93 -1.25 -0.49 0.00 0.00 175.26 176.03 2dmc s PRO 60 N -0.57 2.57 -0.08 0.39 0.04 -1.26 -4.53 135.00 131.56 2dmc s PRO 60 Ca 0.04 -0.16 -0.12 0.00 0.04 0.00 0.00 61.00 60.80 2dmc s PRO 60 Cb -0.06 -4.96 -0.05 0.00 0.04 0.00 0.00 34.50 29.47 2dmc s PRO 60 CO 0.00 -3.27 0.28 0.00 0.04 0.00 0.00 177.00 174.05 2dmc s LEU 62 N -0.67 0.64 0.10 0.00 1.98 0.30 -4.94 118.68 116.07 2dmc s LEU 62 Ca 0.19 -0.24 -0.30 0.00 -2.89 0.00 0.00 54.13 50.88 2dmc s LEU 62 Cb -0.14 -0.43 -0.06 0.00 0.66 0.00 0.00 46.19 46.23 2dmc s LEU 62 CO 0.08 -0.23 1.04 -0.76 -1.89 0.00 0.00 176.35 174.59 2dmc s LEU 63 N 1.98 4.45 0.04 -0.68 1.43 -1.26 -1.74 118.68 122.90 2dmc s LEU 63 Ca 0.04 1.88 -0.05 0.00 -1.03 0.00 0.00 54.13 54.97 2dmc s LEU 63 Cb -0.13 -3.59 -0.01 0.00 0.03 0.00 0.00 46.19 42.49 2dmc s LEU 63 CO -0.06 -0.22 0.09 -1.59 0.23 0.00 0.00 176.35 174.80 2dmc s LYS 64 N 0.30 0.61 0.12 1.70 -2.85 -1.15 -4.99 119.74 113.48 2dmc s LYS 64 Ca 0.51 -0.83 -0.27 0.00 -1.00 0.00 0.00 55.97 54.38 2dmc s LYS 64 Cb -0.25 0.24 -0.07 0.00 -2.06 0.00 0.00 37.83 35.68 2dmc s LYS 64 CO 0.31 -0.15 0.84 0.50 0.10 0.00 0.00 175.35 176.94 2dmc s ARG 65 N -2.87 4.61 0.18 1.78 6.06 -1.26 -3.14 118.95 124.30 2dmc s ARG 65 Ca -0.03 1.24 0.05 0.00 -2.50 0.00 0.00 55.73 54.49 2dmc s ARG 65 Cb 0.00 -3.33 -0.04 0.00 0.06 0.00 0.00 34.95 31.65 2dmc s ARG 65 CO -0.06 0.38 0.13 -0.51 -2.50 0.00 0.00 175.30 172.74 2dmc s LEU 66 N -0.50 3.75 0.98 -0.88 1.43 0.15 -4.92 118.68 118.69 2dmc s LEU 66 Ca 0.40 -0.17 -0.12 0.00 -1.03 0.00 0.00 54.13 53.21 2dmc s LEU 66 Cb -0.23 -2.36 0.18 0.00 0.03 0.00 0.00 46.19 43.81 2dmc s LEU 66 CO 0.27 0.06 1.09 -2.16 0.23 0.00 0.00 176.35 175.84 2dmc s PRO 67 N -3.17 0.61 -1.20 1.29 0.04 -1.26 -2.49 135.00 128.81 2dmc s PRO 67 Ca 0.31 0.59 -0.00 0.00 0.04 0.00 0.00 61.00 61.93 2dmc s PRO 67 Cb -0.10 -1.75 0.00 0.00 0.04 0.00 0.00 34.50 32.69 2dmc s PRO 67 CO 0.23 -2.63 0.06 0.09 0.04 0.00 0.00 177.00 174.80 2dmc n ASN 68 N -4.11 -4.42 -3.48 6.66 3.02 -1.26 -2.93 115.26 108.74 2dmc n ASN 68 Ca 0.06 -0.04 -0.18 0.00 -0.03 0.00 0.00 54.58 54.39 2dmc n ASN 68 Cb 0.57 -3.53 0.08 0.00 -0.61 0.00 0.00 39.78 36.28 2dmc n ASN 68 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2dmc n ASN 69 N -0.80 -1.87 -4.28 6.41 3.02 -1.26 -5.01 115.26 111.48 2dmc n ASN 69 Ca -0.16 -0.66 -0.15 0.00 -0.03 0.00 0.00 54.58 53.59 2dmc n ASN 69 Cb 0.62 -4.92 -0.10 0.00 -0.61 0.00 0.00 39.78 34.77 2dmc n ASN 69 CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 2dmc s HIS 70 N -3.42 1.36 0.03 3.10 3.76 -1.04 -5.06 115.29 114.02 2dmc s HIS 70 Ca 0.00 -1.07 -0.06 0.00 -0.15 0.00 0.00 55.06 53.78 2dmc s HIS 70 Cb -0.00 -0.78 -0.01 0.00 1.11 0.00 0.00 32.58 32.90 2dmc s HIS 70 CO 0.75 -0.25 0.11 0.42 -0.85 0.00 0.00 174.74 174.92 2dmc s ILE 71 N -3.68 0.12 0.34 0.60 1.01 -1.26 0.34 121.20 118.67 2dmc s ILE 71 Ca 0.29 -0.95 -0.18 0.00 0.00 0.00 0.00 60.65 59.82 2dmc s ILE 71 Cb 0.07 -0.71 0.04 0.00 0.01 0.00 0.00 42.46 41.87 2dmc s ILE 71 CO 0.08 -0.52 0.77 -0.83 0.00 0.00 0.00 174.94 174.43 2dmc s GLY 72 N -1.86 0.20 0.03 6.18 0.00 -1.19 -3.42 107.32 107.27 2dmc s GLY 72 Ca -0.09 -0.58 0.03 0.00 0.00 0.00 0.00 44.72 44.08 2dmc s GLY 72 CO -0.02 -0.21 -0.04 -1.50 0.00 0.00 0.00 173.10 171.33 2dmc s ILE 73 N -2.89 3.85 -0.15 0.90 2.07 -1.11 -2.93 121.20 120.95 2dmc s ILE 73 Ca 0.14 -0.82 0.00 0.00 -1.41 0.00 0.00 60.65 58.56 2dmc s ILE 73 Cb -0.05 -2.74 0.03 0.00 0.13 0.00 0.00 42.46 39.83 2dmc s ILE 73 CO 0.10 0.30 -0.10 -0.55 -1.91 0.00 0.00 174.94 172.77 2dmc s SER 74 N -1.74 2.62 0.09 4.50 0.15 -0.71 -2.06 113.70 116.56 2dmc s SER 74 Ca 0.20 -0.50 -0.14 0.00 0.70 0.00 0.00 55.95 56.21 2dmc s SER 74 Cb -0.11 -1.04 0.02 0.00 -1.71 0.00 0.00 66.02 63.18 2dmc s SER 74 CO 0.11 -0.10 0.33 0.72 1.20 0.00 0.00 173.24 175.50 2dmc s PHE 75 N 1.57 -0.10 -0.58 3.44 -0.71 -1.23 -0.54 117.98 119.82 2dmc s PHE 75 Ca 0.04 -0.18 -0.13 0.00 -1.04 0.00 0.00 56.93 55.62 2dmc s PHE 75 Cb -0.13 0.15 0.15 0.00 -1.21 0.00 0.00 43.02 41.97 2dmc s PHE 75 CO -0.09 -0.61 0.51 0.42 -1.34 0.00 0.00 175.22 174.10 2dmc s ILE 76 N -3.45 4.95 -0.03 -4.49 1.01 -1.25 -2.65 121.20 115.30 2dmc s ILE 76 Ca 0.01 -1.84 -0.30 0.00 0.00 0.00 0.00 60.65 58.52 2dmc s ILE 76 Cb 0.02 -4.17 -0.05 0.00 0.01 0.00 0.00 42.46 38.27 2dmc s ILE 76 CO -0.09 -0.88 1.47 -2.16 0.00 0.00 0.00 174.94 173.28 2dmc s PRO 77 N 1.17 4.24 0.07 2.79 0.04 -1.26 -4.66 135.00 137.40 2dmc s PRO 77 Ca 0.07 2.02 0.12 0.00 0.04 0.00 0.00 61.00 63.26 2dmc s PRO 77 Cb -0.25 -3.71 -0.16 0.00 0.04 0.00 0.00 34.50 30.42 2dmc s PRO 77 CO -0.01 -0.68 0.98 0.00 0.04 0.00 0.00 177.00 177.34 2dmc h ARG 78 N 8.38 0.00 -5.56 4.56 -0.00 -1.96 -1.36 114.38 118.44 2dmc h ARG 78 Ca -0.37 0.00 -0.60 0.00 -0.50 0.00 0.00 59.98 58.51 2dmc h ARG 78 Cb 1.17 0.00 -0.13 0.00 0.00 0.00 0.00 29.97 31.01 2dmc h ARG 78 CO 0.93 0.58 -0.60 -2.00 0.00 0.00 0.00 179.97 178.88 2dmc s GLU 79 N -2.76 1.91 0.02 0.04 2.12 -1.26 -4.82 118.70 113.95 2dmc s GLU 79 Ca -0.01 -2.08 0.08 0.00 0.36 0.00 0.00 54.97 53.31 2dmc s GLU 79 Cb 0.09 -1.48 -0.03 0.00 0.26 0.00 0.00 34.13 32.97 2dmc s GLU 79 CO 0.81 -0.09 -0.23 0.14 -0.54 0.00 0.00 175.26 175.34 2dmc s VAL 80 N -2.83 2.34 -2.33 3.70 -7.23 -1.26 -4.88 120.40 107.91 2dmc s VAL 80 Ca 0.34 -1.22 0.00 0.00 -1.81 0.00 0.00 61.98 59.29 2dmc s VAL 80 Cb 0.09 -1.91 0.00 0.00 0.56 0.00 0.00 36.38 35.13 2dmc s VAL 80 CO 0.17 0.43 0.00 0.61 -0.31 0.00 0.00 175.10 176.00 2dmc n GLY 81 N 1.93 0.02 3.30 2.32 0.00 0.47 -4.93 105.19 108.30 2dmc n GLY 81 Ca -0.17 -0.98 -0.46 0.00 0.00 0.00 0.00 46.02 44.41 2dmc n GLY 81 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2dmc s GLU 82 N -2.00 2.99 0.09 1.61 2.12 -1.26 -0.63 118.70 121.61 2dmc s GLU 82 Ca 0.00 -1.77 -0.13 0.00 0.36 0.00 0.00 54.97 53.43 2dmc s GLU 82 Cb 0.00 -4.28 -0.06 0.00 0.26 0.00 0.00 34.13 30.05 2dmc s GLU 82 CO 0.00 -1.32 0.47 -1.01 -0.54 0.00 0.00 175.26 172.86 2dmc s HIS 83 N 1.48 3.64 -0.26 5.30 3.76 -0.27 -4.42 115.29 124.53 2dmc s HIS 83 Ca 0.04 0.98 -0.02 0.00 -0.15 0.00 0.00 55.06 55.91 2dmc s HIS 83 Cb -0.28 -2.29 0.03 0.00 1.11 0.00 0.00 32.58 31.14 2dmc s HIS 83 CO 0.02 0.52 -0.04 -0.51 -0.85 0.00 0.00 174.74 173.88 2dmc s LEU 84 N -1.67 3.38 -0.39 0.89 1.43 -1.26 -1.69 118.68 119.37 2dmc s LEU 84 Ca 0.32 -0.92 -0.19 0.00 -1.03 0.00 0.00 54.13 52.31 2dmc s LEU 84 Cb -0.15 -1.70 0.01 0.00 0.03 0.00 0.00 46.19 44.38 2dmc s LEU 84 CO 0.17 -0.16 0.56 -0.69 0.23 0.00 0.00 176.35 176.47 2dmc s VAL 85 N 1.33 4.95 -0.47 -1.59 1.01 -0.33 -3.47 120.40 121.83 2dmc s VAL 85 Ca -0.00 0.20 -0.28 0.00 0.00 0.00 0.00 61.98 61.89 2dmc s VAL 85 Cb -0.17 -4.07 0.03 0.00 0.00 0.00 0.00 36.38 32.17 2dmc s VAL 85 CO -0.03 -0.38 1.07 -0.44 0.00 0.00 0.00 175.10 175.31 2dmc s SER 86 N 1.85 6.59 -0.21 3.32 0.01 0.11 0.13 113.70 125.50 2dmc s SER 86 Ca 0.20 0.35 0.02 0.00 1.31 0.00 0.00 55.95 57.82 2dmc s SER 86 Cb -0.15 -2.52 0.04 0.00 0.21 0.00 0.00 66.02 63.60 2dmc s SER 86 CO 0.15 -1.18 -0.15 -0.63 0.41 0.00 0.00 173.24 171.84 2dmc s ILE 87 N 4.22 2.02 0.29 1.44 -1.09 -1.26 -2.42 121.20 124.41 2dmc s ILE 87 Ca 0.44 -1.17 0.02 0.00 -2.23 0.00 0.00 60.65 57.71 2dmc s ILE 87 Cb -0.08 -1.97 -0.05 0.00 -1.58 0.00 0.00 42.46 38.79 2dmc s ILE 87 CO 0.30 0.29 0.12 -0.54 -1.23 0.00 0.00 174.94 173.88 2dmc s LYS 88 N 1.25 1.55 -0.22 2.79 1.02 -1.25 -1.62 119.74 123.24 2dmc s LYS 88 Ca -0.01 -1.87 -0.01 0.00 0.02 0.00 0.00 55.97 54.11 2dmc s LYS 88 Cb -0.16 -0.30 0.06 0.00 -0.52 0.00 0.00 37.83 36.92 2dmc s LYS 88 CO -0.10 -0.36 -0.02 0.21 -0.92 0.00 0.00 175.35 174.17 2dmc s LYS 89 N -3.92 1.26 -1.80 1.68 2.20 0.54 -1.16 119.74 118.54 2dmc s LYS 89 Ca 0.36 -0.80 0.00 0.00 -0.36 0.00 0.00 55.97 55.17 2dmc s LYS 89 Cb 0.06 -2.41 0.00 0.00 -1.51 0.00 0.00 37.83 33.97 2dmc s LYS 89 CO 0.15 -0.63 0.00 0.09 -0.36 0.00 0.00 175.35 174.61 2dmc n ASN 90 N 4.81 -5.56 0.00 1.43 5.03 -1.12 -1.57 115.26 118.27 2dmc n ASN 90 Ca -0.11 0.13 0.00 0.00 0.87 0.00 0.00 54.58 55.47 2dmc n ASN 90 Cb 0.45 -4.65 0.00 0.00 -1.02 0.00 0.00 39.78 34.56 2dmc n ASN 90 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2dmc n GLY 91 N -0.89 0.81 2.78 7.41 0.00 -1.26 -5.06 105.19 108.99 2dmc n GLY 91 Ca -0.22 -0.24 -0.30 0.00 0.00 0.00 0.00 46.02 45.26 2dmc n GLY 91 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2dmc s ASN 92 N -2.22 3.82 0.24 1.61 0.01 -0.61 -5.10 114.94 112.71 2dmc s ASN 92 Ca 0.00 -1.43 -0.20 0.00 -0.71 0.00 0.00 52.86 50.51 2dmc s ASN 92 Cb 0.00 -0.90 -0.13 0.00 0.41 0.00 0.00 41.25 40.62 2dmc s ASN 92 CO 0.00 -0.36 0.25 1.41 -1.51 0.00 0.00 177.10 176.89 2dmc n HIS 93 N 4.83 -1.05 -3.35 2.20 8.25 -1.26 -0.34 115.22 124.50 2dmc n HIS 93 Ca -0.05 0.66 -0.15 0.00 -0.26 0.00 0.00 57.72 57.92 2dmc n HIS 93 Cb 0.43 -1.53 0.03 0.00 1.12 0.00 0.00 29.99 30.04 2dmc n HIS 93 CO 0.00 0.00 0.00 1.33 0.64 0.00 0.00 176.34 178.31 2dmc n VAL 94 N -0.40 0.00 -2.32 1.59 0.24 -0.64 -4.64 118.33 112.15 2dmc n VAL 94 Ca 0.12 -1.39 -0.36 0.00 -2.04 0.00 0.00 64.34 60.67 2dmc n VAL 94 Cb 0.26 -0.46 -0.01 0.00 -1.47 0.00 0.00 33.84 32.16 2dmc n VAL 94 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2dmc s ALA 95 N -2.50 2.94 -1.62 2.33 0.00 -1.26 -3.12 121.76 118.53 2dmc s ALA 95 Ca 0.33 0.86 0.00 0.00 0.00 0.00 0.00 51.96 53.15 2dmc s ALA 95 Cb -0.03 -3.35 0.00 0.00 0.00 0.00 0.00 23.12 19.74 2dmc s ALA 95 CO 0.21 -0.58 0.00 0.09 0.00 0.00 0.00 175.76 175.48 2dmc n ASN 96 N -0.58 -5.44 -4.09 0.00 3.02 -1.26 -4.95 115.26 101.96 2dmc n ASN 96 Ca 0.08 -0.01 -0.19 0.00 -0.03 0.00 0.00 54.58 54.43 2dmc n ASN 96 Cb 0.49 -4.50 -0.14 0.00 -0.61 0.00 0.00 39.78 35.03 2dmc n ASN 96 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 2dmc s SER 97 N -2.16 1.36 0.56 6.41 0.15 -1.18 -3.31 113.70 115.53 2dmc s SER 97 Ca 0.00 -0.33 -0.19 0.00 0.70 0.00 0.00 55.95 56.13 2dmc s SER 97 Cb 0.00 -0.11 -0.05 0.00 -1.71 0.00 0.00 66.02 64.16 2dmc s SER 97 CO 0.00 0.06 1.13 -2.16 1.20 0.00 0.00 173.24 173.46 2dmc s PRO 98 N -0.74 3.27 -0.27 5.44 0.04 -1.26 -4.81 135.00 136.67 2dmc s PRO 98 Ca 0.02 1.57 -0.28 0.00 0.04 0.00 0.00 61.00 62.35 2dmc s PRO 98 Cb -0.06 -2.00 0.01 0.00 0.04 0.00 0.00 34.50 32.49 2dmc s PRO 98 CO 0.00 -0.91 1.02 0.08 0.04 0.00 0.00 177.00 177.23 2dmc s VAL 99 N -1.87 4.63 -0.14 -0.36 1.01 0.12 -4.75 120.40 119.04 2dmc s VAL 99 Ca 0.72 1.81 -0.27 0.00 0.00 0.00 0.00 61.98 64.24 2dmc s VAL 99 Cb -0.23 -4.33 -0.01 0.00 0.00 0.00 0.00 36.38 31.80 2dmc s VAL 99 CO 0.29 -0.31 0.90 -0.94 0.00 0.00 0.00 175.10 175.04 2dmc s SER 100 N 1.44 7.08 -0.02 3.32 1.04 -1.26 -1.18 113.70 124.11 2dmc s SER 100 Ca 0.43 1.32 0.05 0.00 0.48 0.00 0.00 55.95 58.23 2dmc s SER 100 Cb -0.14 -2.49 -0.01 0.00 0.10 0.00 0.00 66.02 63.48 2dmc s SER 100 CO 0.11 -0.41 -0.17 -0.63 0.98 0.00 0.00 173.24 173.12 2dmc s ILE 101 N 2.03 1.35 -0.29 -1.02 1.01 -0.68 -5.01 121.20 118.59 2dmc s ILE 101 Ca 0.42 -0.72 -0.09 0.00 0.00 0.00 0.00 60.65 60.27 2dmc s ILE 101 Cb -0.17 -1.13 -0.02 0.00 0.01 0.00 0.00 42.46 41.15 2dmc s ILE 101 CO 0.15 0.38 0.12 -0.32 0.00 0.00 0.00 174.94 175.27 2dmc s MET 102 N -0.30 3.47 -0.13 2.79 -2.45 -1.26 -1.11 119.30 120.31 2dmc s MET 102 Ca 0.04 -0.62 -0.04 0.00 -1.25 0.00 0.00 55.69 53.82 2dmc s MET 102 Cb -0.08 -3.47 -0.04 0.00 1.25 0.00 0.00 34.83 32.50 2dmc s MET 102 CO -0.00 -0.32 0.03 0.08 1.05 0.00 0.00 175.02 175.85 2dmc s VAL 103 N 1.61 4.51 0.11 10.11 1.01 0.19 -4.33 120.40 133.61 2dmc s VAL 103 Ca 0.05 -0.16 0.01 0.00 0.00 0.00 0.00 61.98 61.89 2dmc s VAL 103 Cb -0.16 -2.95 -0.04 0.00 0.00 0.00 0.00 36.38 33.22 2dmc s VAL 103 CO 0.05 0.55 -0.04 0.68 0.00 0.00 0.00 175.10 176.34 2dmc s VAL 104 N -0.35 0.62 -0.28 2.92 -7.23 -1.26 -0.39 120.40 114.43 2dmc s VAL 104 Ca 0.08 -1.93 -0.20 0.00 -1.81 0.00 0.00 61.98 58.11 2dmc s VAL 104 Cb -0.12 -1.76 -0.01 0.00 0.56 0.00 0.00 36.38 35.04 2dmc s VAL 104 CO 0.02 -0.80 0.63 -1.10 -0.31 0.00 0.00 175.10 173.54 2dmc s GLN 105 N -3.87 4.01 -0.46 4.82 -0.21 -1.26 -4.17 119.66 118.52 2dmc s GLN 105 Ca 0.14 0.42 -0.46 0.00 0.02 0.00 0.00 55.36 55.48 2dmc s GLN 105 Cb 0.06 -3.69 -0.20 0.00 1.00 0.00 0.00 33.01 30.18 2dmc s GLN 105 CO -0.03 -0.49 1.53 0.45 -2.12 0.00 0.00 175.29 174.63 2dmc n SER 106 N 5.79 1.11 -4.58 5.90 2.88 -1.26 -4.74 113.62 118.72 2dmc n SER 106 Ca -0.01 1.16 -0.41 0.00 -1.33 0.00 0.00 58.87 58.28 2dmc n SER 106 Cb 0.49 -0.86 -0.03 0.00 -0.75 0.00 0.00 64.21 63.06 2dmc n SER 106 CO 0.00 0.00 0.00 -0.70 -1.23 0.00 0.00 175.04 173.11 2dmc s GLU 107 N 2.76 2.94 -1.20 -1.46 2.12 -1.26 -3.45 118.70 119.15 2dmc s GLU 107 Ca 1.02 1.51 -0.08 0.00 0.36 0.00 0.00 54.97 57.78 2dmc s GLU 107 Cb -1.45 -4.35 0.08 0.00 0.26 0.00 0.00 34.13 28.66 2dmc s GLU 107 CO 0.79 -2.33 0.19 -0.89 -0.54 0.00 0.00 175.26 172.48 2dmc n ILE 108 N 7.61 -0.38 -3.47 -3.70 5.41 -1.26 -4.32 119.36 119.25 2dmc n ILE 108 Ca 0.27 -0.19 0.00 0.00 1.00 0.00 0.00 62.75 63.83 2dmc n ILE 108 Cb 0.48 -0.54 0.00 0.00 -0.71 0.00 0.00 39.64 38.87 2dmc n ILE 108 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2dmc n GLY 109 N -1.56 -1.59 3.65 7.39 0.00 -1.22 -4.91 105.19 106.95 2dmc n GLY 109 Ca -0.09 -1.41 -0.31 0.00 0.00 0.00 0.00 46.02 44.22 2dmc n GLY 109 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2dmc s ASP 110 N -4.00 4.86 0.08 1.61 1.11 -1.26 -4.93 116.67 114.14 2dmc s ASP 110 Ca 0.00 -0.18 -0.34 0.00 0.18 0.00 0.00 52.55 52.20 2dmc s ASP 110 Cb 0.00 -1.13 -0.18 0.00 1.07 0.00 0.00 42.92 42.67 2dmc s ASP 110 CO 0.00 0.21 0.82 -1.54 1.18 0.00 0.00 175.17 175.84 2dmc n SER 111 N 0.87 -0.51 0.00 0.27 3.41 -1.26 -4.61 113.62 111.79 2dmc n SER 111 Ca -0.12 1.12 0.00 0.00 -0.26 0.00 0.00 58.87 59.61 2dmc n SER 111 Cb 0.52 -0.91 0.00 0.00 -0.26 0.00 0.00 64.21 63.56 2dmc n SER 111 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dmc n GLY 112 N 1.66 -1.28 0.13 5.00 0.00 -1.26 -4.88 105.19 104.56 2dmc n GLY 112 Ca 0.19 -1.34 -0.13 0.00 0.00 0.00 0.00 46.02 44.74 2dmc n GLY 112 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dmc h PRO 113 N 0.00 0.32 -3.34 1.61 0.13 -2.02 -3.47 132.00 125.23 2dmc h PRO 113 Ca 0.00 -0.17 -0.04 0.00 -0.87 0.00 0.00 66.00 64.93 2dmc h PRO 113 Cb 0.00 0.00 -0.12 0.00 0.13 0.00 0.00 31.00 31.02 2dmc h PRO 113 CO 0.00 0.71 -0.01 0.45 -0.23 0.00 0.00 178.00 178.91 2dmc s SER 114 N -6.07 -0.27 -0.78 1.44 0.15 -1.26 -5.07 113.70 101.84 2dmc s SER 114 Ca -0.14 -0.36 -0.11 0.00 0.70 0.00 0.00 55.95 56.04 2dmc s SER 114 Cb 0.05 0.52 0.21 0.00 -1.71 0.00 0.00 66.02 65.09 2dmc s SER 114 CO 0.74 -0.94 0.70 -0.55 1.20 0.00 0.00 173.24 174.39 2dmc s SER 115 N -2.83 6.41 0.00 5.45 0.15 -1.26 -5.12 113.70 116.50 2dmc s SER 115 Ca 0.05 -2.75 0.00 0.00 0.70 0.00 0.00 55.95 53.96 2dmc s SER 115 Cb 0.01 -2.13 0.00 0.00 -1.71 0.00 0.00 66.02 62.19 2dmc s SER 115 CO -0.09 -0.52 0.00 0.61 1.20 0.00 0.00 173.24 174.44