#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 5.57 -0.11 1.61 1.04 -1.26 -5.06 113.70 115.48 2dmc s SER 2 Ca 0.00 -0.44 -0.03 0.00 0.48 0.00 0.00 55.95 55.97 2dmc s SER 2 Cb 0.00 -0.57 -0.06 0.00 0.10 0.00 0.00 66.02 65.49 2dmc s SER 2 CO 0.00 -0.85 -0.12 -1.54 0.98 0.00 0.00 173.24 171.70 2dmc n SER 3 N -1.93 1.93 0.00 7.02 3.41 -1.26 -5.13 113.62 117.66 2dmc n SER 3 Ca 0.09 0.05 0.00 0.00 -0.26 0.00 0.00 58.87 58.75 2dmc n SER 3 Cb 0.59 -0.26 0.00 0.00 -0.26 0.00 0.00 64.21 64.28 2dmc n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dmc n GLY 4 N 2.61 2.48 3.69 5.00 0.00 -1.26 -5.16 105.19 112.55 2dmc n GLY 4 Ca -0.21 -0.88 -0.30 0.00 0.00 0.00 0.00 46.02 44.63 2dmc n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dmc s SER 5 N 0.00 5.03 -0.23 1.61 1.04 -1.26 -5.11 113.70 114.78 2dmc s SER 5 Ca 0.00 -0.19 -0.07 0.00 0.48 0.00 0.00 55.95 56.18 2dmc s SER 5 Cb 0.00 -1.19 -0.03 0.00 0.10 0.00 0.00 66.02 64.90 2dmc s SER 5 CO 0.00 0.17 0.06 -0.94 0.98 0.00 0.00 173.24 173.51 2dmc s SER 6 N -2.35 5.18 0.00 7.02 1.04 -1.26 -4.93 113.70 118.40 2dmc s SER 6 Ca 0.26 -0.15 0.00 0.00 0.48 0.00 0.00 55.95 56.54 2dmc s SER 6 Cb -0.12 -1.92 0.00 0.00 0.10 0.00 0.00 66.02 64.09 2dmc s SER 6 CO 0.18 0.02 0.00 0.61 0.98 0.00 0.00 173.24 175.04 2dmc n GLY 7 N 4.54 0.95 3.45 7.32 0.00 -1.26 -4.97 105.19 115.22 2dmc n GLY 7 Ca -0.16 -0.01 -0.39 0.00 0.00 0.00 0.00 46.02 45.46 2dmc n GLY 7 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2dmc n ILE 8 N 0.00 2.00 -2.11 -0.61 -0.00 -1.26 -4.62 119.36 112.76 2dmc n ILE 8 Ca 0.00 -0.50 -0.43 0.00 -0.00 0.00 0.00 62.75 61.82 2dmc n ILE 8 Cb 0.00 -0.61 -0.03 0.00 -0.00 0.00 0.00 39.64 39.00 2dmc n ILE 8 CO 0.00 0.00 0.00 -2.16 -0.00 0.00 0.00 176.55 174.39 2dmc s PRO 9 N -1.92 3.68 0.09 6.28 0.04 -1.26 -4.75 135.00 137.15 2dmc s PRO 9 Ca 0.67 1.55 0.01 0.00 0.04 0.00 0.00 61.00 63.27 2dmc s PRO 9 Cb -0.47 -4.07 0.01 0.00 0.04 0.00 0.00 34.50 30.01 2dmc s PRO 9 CO 0.56 -1.44 0.05 0.41 0.04 0.00 0.00 177.00 176.62 2dmc n GLY 10 N 4.87 3.28 3.13 0.56 0.00 -1.26 -5.05 105.19 110.72 2dmc n GLY 10 Ca 0.20 -2.20 -0.38 0.00 0.00 0.00 0.00 46.02 43.64 2dmc n GLY 10 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dmc s SER 11 N -1.54 5.90 1.16 1.61 1.04 -1.26 -5.05 113.70 115.56 2dmc s SER 11 Ca 0.04 -3.38 -0.18 0.00 0.48 0.00 0.00 55.95 52.91 2dmc s SER 11 Cb -0.00 -1.93 0.27 0.00 0.10 0.00 0.00 66.02 64.45 2dmc s SER 11 CO 0.03 -0.27 1.11 -2.16 0.98 0.00 0.00 173.24 172.92 2dmc s PRO 12 N -0.85 -0.87 -0.13 4.02 0.04 -1.26 -5.01 135.00 130.94 2dmc s PRO 12 Ca 0.24 0.06 -0.22 0.00 0.04 0.00 0.00 61.00 61.12 2dmc s PRO 12 Cb -0.12 -1.63 -0.20 0.00 0.04 0.00 0.00 34.50 32.60 2dmc s PRO 12 CO -0.09 -3.51 0.59 0.35 0.04 0.00 0.00 177.00 174.38 2dmc h PHE 13 N -2.44 -0.00 -3.21 0.56 3.04 -1.97 -3.46 116.94 109.46 2dmc h PHE 13 Ca -0.47 -0.00 -0.66 0.00 3.98 0.00 0.00 57.97 60.82 2dmc h PHE 13 Cb 1.30 0.00 -0.12 0.00 2.56 0.00 0.00 35.95 39.70 2dmc h PHE 13 CO -1.56 0.76 -0.60 0.99 -2.02 0.00 0.00 178.31 175.88 2dmc s THR 14 N -2.07 4.49 0.38 4.41 2.01 -1.26 -5.12 115.64 118.48 2dmc s THR 14 Ca -0.15 -0.46 0.06 0.00 0.31 0.00 0.00 61.69 61.45 2dmc s THR 14 Cb -0.02 -3.02 -0.02 0.00 0.01 0.00 0.00 72.50 69.44 2dmc s THR 14 CO 0.53 0.38 0.22 0.00 -0.69 0.00 0.00 174.62 175.06 2dmc s ALA 15 N -1.13 2.48 -0.41 7.40 0.00 -1.26 -5.12 121.76 123.72 2dmc s ALA 15 Ca 0.21 -1.60 -0.15 0.00 0.00 0.00 0.00 51.96 50.42 2dmc s ALA 15 Cb -0.12 1.12 0.02 0.00 0.00 0.00 0.00 23.12 24.14 2dmc s ALA 15 CO 0.11 -0.50 0.31 0.15 0.00 0.00 0.00 175.76 175.83 2dmc s LYS 16 N -3.53 3.01 0.27 0.00 3.01 -1.26 -4.92 119.74 116.32 2dmc s LYS 16 Ca 0.31 -0.97 0.17 0.00 -1.01 0.00 0.00 55.97 54.46 2dmc s LYS 16 Cb 0.02 -3.97 0.07 0.00 -1.01 0.00 0.00 37.83 32.94 2dmc s LYS 16 CO 0.22 -0.74 1.37 0.82 0.51 0.00 0.00 175.35 177.53 2dmc h ILE 17 N 5.63 0.67 -3.40 2.17 2.04 -2.06 -3.44 117.51 119.12 2dmc h ILE 17 Ca -0.27 -1.98 -0.62 0.00 1.00 0.00 0.00 64.86 62.99 2dmc h ILE 17 Cb 1.12 2.28 -0.17 0.00 -0.74 0.00 0.00 36.82 39.32 2dmc h ILE 17 CO 0.73 0.38 -0.56 0.28 0.00 0.00 0.00 178.15 178.98 2dmc s THR 18 N -3.00 4.83 0.16 -0.27 -1.32 -1.26 -5.10 115.64 109.68 2dmc s THR 18 Ca 0.03 -0.01 0.08 0.00 -1.21 0.00 0.00 61.69 60.58 2dmc s THR 18 Cb 0.07 -3.21 -0.04 0.00 -1.51 0.00 0.00 72.50 67.82 2dmc s THR 18 CO 0.75 0.42 -0.07 -0.62 -2.21 0.00 0.00 174.62 172.88 2dmc s ASP 19 N 0.69 4.41 -0.08 8.08 2.15 -1.26 -5.05 116.67 125.61 2dmc s ASP 19 Ca 0.04 -0.49 -0.05 0.00 0.43 0.00 0.00 52.55 52.48 2dmc s ASP 19 Cb -0.13 -0.82 -0.04 0.00 -0.30 0.00 0.00 42.92 41.64 2dmc s ASP 19 CO 0.02 0.11 -0.11 0.47 -0.17 0.00 0.00 175.17 175.49 2dmc n ASP 20 N 0.13 0.70 -3.64 -0.34 8.00 -1.26 -5.03 116.55 115.10 2dmc n ASP 20 Ca -0.11 0.12 -0.24 0.00 0.71 0.00 0.00 54.79 55.27 2dmc n ASP 20 Cb 0.55 -0.28 0.07 0.00 -0.02 0.00 0.00 41.12 41.43 2dmc n ASP 20 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 2dmc n SER 21 N -3.44 -4.88 0.43 -2.24 7.64 -1.26 -4.93 113.62 104.94 2dmc n SER 21 Ca -0.16 -0.63 -0.17 0.00 1.01 0.00 0.00 58.87 58.92 2dmc n SER 21 Cb 0.58 -4.74 -0.08 0.00 -1.01 0.00 0.00 64.21 58.96 2dmc n SER 21 CO 0.00 0.00 0.00 0.03 -3.01 0.00 0.00 175.04 172.06 2dmc h ARG 22 N -2.38 -1.07 0.00 1.43 2.47 -2.02 -3.43 114.38 109.39 2dmc h ARG 22 Ca -0.58 0.07 -0.01 0.00 -1.26 0.00 0.00 59.98 58.20 2dmc h ARG 22 Cb 1.37 0.24 -0.00 0.00 -1.65 0.00 0.00 29.97 29.93 2dmc h ARG 22 CO 0.57 -0.71 -0.51 -2.13 0.56 0.00 0.00 179.97 177.75 2dmc n ARG 23 N -5.49 0.24 -4.65 0.04 0.63 -1.26 -5.02 116.66 101.15 2dmc n ARG 23 Ca -0.14 0.10 -0.33 0.00 -0.92 0.00 0.00 57.85 56.56 2dmc n ARG 23 Cb 0.44 -0.92 -0.14 0.00 0.45 0.00 0.00 32.46 32.29 2dmc n ARG 23 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2dmc s SER 25 N 0.39 6.82 -0.11 0.00 0.01 -1.26 -4.59 113.70 114.95 2dmc s SER 25 Ca -0.09 1.16 -0.30 0.00 1.31 0.00 0.00 55.95 58.04 2dmc s SER 25 Cb -0.15 -2.54 -0.03 0.00 0.21 0.00 0.00 66.02 63.51 2dmc s SER 25 CO 0.05 -0.96 1.30 -1.58 0.41 0.00 0.00 173.24 172.46 2dmc s GLN 26 N 3.87 4.26 0.08 12.44 0.74 -1.26 -4.36 119.66 135.44 2dmc s GLN 26 Ca 0.51 1.75 0.04 0.00 0.05 0.00 0.00 55.36 57.71 2dmc s GLN 26 Cb -0.15 -3.72 -0.03 0.00 1.10 0.00 0.00 33.01 30.21 2dmc s GLN 26 CO 0.19 -0.64 -0.11 0.08 -0.55 0.00 0.00 175.29 174.25 2dmc s VAL 27 N 3.13 0.95 -0.37 1.34 1.01 -1.26 -5.00 120.40 120.19 2dmc s VAL 27 Ca 0.58 -1.48 -0.19 0.00 0.00 0.00 0.00 61.98 60.89 2dmc s VAL 27 Cb -0.25 -1.19 0.00 0.00 0.00 0.00 0.00 36.38 34.94 2dmc s VAL 27 CO 0.19 -0.45 0.53 -0.54 0.00 0.00 0.00 175.10 174.84 2dmc s LYS 28 N -2.36 3.53 0.65 2.72 -0.14 -1.26 -3.88 119.74 119.00 2dmc s LYS 28 Ca 0.02 -0.23 -0.17 0.00 -1.36 0.00 0.00 55.97 54.22 2dmc s LYS 28 Cb -0.06 -3.84 -0.01 0.00 -1.68 0.00 0.00 37.83 32.24 2dmc s LYS 28 CO 0.01 -0.72 1.24 -1.17 -0.76 0.00 0.00 175.35 173.95 2dmc s LEU 29 N 2.45 3.54 -1.53 3.17 2.96 -1.26 -2.40 118.68 125.61 2dmc s LEU 29 Ca 0.19 2.47 0.00 0.00 -0.22 0.00 0.00 54.13 56.57 2dmc s LEU 29 Cb -0.15 -4.60 0.00 0.00 0.50 0.00 0.00 46.19 41.93 2dmc s LEU 29 CO 0.14 -1.93 0.00 0.61 -1.32 0.00 0.00 176.35 173.85 2dmc n GLY 30 N 0.62 1.40 2.71 7.98 0.00 -0.19 -4.90 105.19 112.82 2dmc n GLY 30 Ca 0.14 -0.06 -0.22 0.00 0.00 0.00 0.00 46.02 45.89 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 -2.59 1.42 -0.31 1.61 0.01 -1.01 -5.01 113.70 107.82 2dmc s SER 31 Ca 0.00 -0.04 -0.37 0.00 1.31 0.00 0.00 55.95 56.85 2dmc s SER 31 Cb 0.00 -0.29 -0.13 0.00 0.21 0.00 0.00 66.02 65.81 2dmc s SER 31 CO 0.00 -0.23 2.03 0.00 0.41 0.00 0.00 173.24 175.45 2dmc n ALA 32 N 5.23 0.64 -2.32 1.44 0.00 -1.26 -4.68 120.51 119.55 2dmc n ALA 32 Ca -0.05 0.12 -0.31 0.00 0.00 0.00 0.00 53.44 53.20 2dmc n ALA 32 Cb 0.50 -2.42 -0.16 0.00 0.00 0.00 0.00 19.45 17.37 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 5.82 2.19 0.56 0.00 0.00 -1.06 -4.96 121.76 124.30 2dmc s ALA 33 Ca 1.05 -1.11 -0.15 0.00 0.00 0.00 0.00 51.96 51.76 2dmc s ALA 33 Cb -0.95 -0.58 -0.06 0.00 0.00 0.00 0.00 23.12 21.54 2dmc s ALA 33 CO 0.55 0.53 1.00 0.34 0.00 0.00 0.00 175.76 178.19 2dmc s ASP 34 N -0.62 6.44 -0.07 0.00 2.15 -1.26 -3.80 116.67 119.51 2dmc s ASP 34 Ca 0.10 1.53 -0.03 0.00 0.43 0.00 0.00 52.55 54.59 2dmc s ASP 34 Cb -0.10 -2.50 0.04 0.00 -0.30 0.00 0.00 42.92 40.06 2dmc s ASP 34 CO -0.01 -0.72 0.08 -0.36 -0.17 0.00 0.00 175.17 173.99 2dmc s PHE 35 N -2.81 0.04 -0.33 -5.34 0.08 -0.89 -4.98 117.98 103.75 2dmc s PHE 35 Ca 0.58 0.22 -0.18 0.00 0.12 0.00 0.00 56.93 57.67 2dmc s PHE 35 Cb -0.11 -0.48 -0.01 0.00 -0.57 0.00 0.00 43.02 41.85 2dmc s PHE 35 CO 0.39 -0.25 0.51 -1.17 -0.10 0.00 0.00 175.22 174.60 2dmc s LEU 36 N 2.18 4.28 0.00 -0.37 2.96 -1.26 -2.21 118.68 124.26 2dmc s LEU 36 Ca 0.04 0.09 0.07 0.00 -0.22 0.00 0.00 54.13 54.11 2dmc s LEU 36 Cb -0.13 -2.60 -0.02 0.00 0.50 0.00 0.00 46.19 43.94 2dmc s LEU 36 CO -0.04 -0.44 -0.22 -1.48 -1.32 0.00 0.00 176.35 172.85 2dmc s LEU 37 N 2.38 2.08 -0.75 -0.68 2.34 -1.25 -5.06 118.68 117.75 2dmc s LEU 37 Ca 0.19 -0.43 -0.22 0.00 0.06 0.00 0.00 54.13 53.73 2dmc s LEU 37 Cb -0.15 -1.09 0.08 0.00 -0.56 0.00 0.00 46.19 44.46 2dmc s LEU 37 CO 0.13 0.24 1.06 -1.81 -1.06 0.00 0.00 176.35 174.91 2dmc s ASP 38 N -0.69 6.29 -0.08 1.48 1.01 -1.26 -4.73 116.67 118.69 2dmc s ASP 38 Ca 0.08 -1.19 0.04 0.00 0.71 0.00 0.00 52.55 52.19 2dmc s ASP 38 Cb -0.08 -2.44 0.00 0.00 1.01 0.00 0.00 42.92 41.41 2dmc s ASP 38 CO -0.00 -1.41 -0.19 0.27 0.21 0.00 0.00 175.17 174.05 2dmc s ILE 39 N 4.01 1.64 -0.00 0.77 -4.36 -1.26 -4.97 121.20 117.02 2dmc s ILE 39 Ca 0.27 -0.79 -0.03 0.00 -0.26 0.00 0.00 60.65 59.85 2dmc s ILE 39 Cb -0.12 -1.43 -0.12 0.00 1.25 0.00 0.00 42.46 42.03 2dmc s ILE 39 CO 0.05 0.47 2.74 -0.24 0.24 0.00 0.00 174.94 178.20 2dmc n SER 40 N 3.53 5.31 -3.81 4.36 2.88 -1.26 -4.74 113.62 119.88 2dmc n SER 40 Ca -0.20 -2.45 -0.25 0.00 -1.33 0.00 0.00 58.87 54.64 2dmc n SER 40 Cb 0.52 -1.26 -0.17 0.00 -0.75 0.00 0.00 64.21 62.55 2dmc n SER 40 CO 0.00 0.00 0.00 -1.61 -1.23 0.00 0.00 175.04 172.20 2dmc s GLU 41 N 0.44 0.91 -0.41 -1.46 0.41 -1.26 -5.01 118.70 112.32 2dmc s GLU 41 Ca 0.31 -0.11 0.05 0.00 -0.41 0.00 0.00 54.97 54.81 2dmc s GLU 41 Cb 0.15 -1.37 0.50 0.00 -1.78 0.00 0.00 34.13 31.63 2dmc s GLU 41 CO -0.00 -0.35 1.61 -2.37 -0.49 0.00 0.00 175.26 173.66 2dmc n THR 42 N 5.06 2.92 -3.71 3.63 5.66 -1.26 -4.80 114.28 121.77 2dmc n THR 42 Ca -0.09 -3.04 -0.28 0.00 -3.05 0.00 0.00 64.05 57.60 2dmc n THR 42 Cb 0.49 -0.74 -0.11 0.00 -1.55 0.00 0.00 70.33 68.42 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 -0.98 1.85 0.00 1.09 9.92 -1.26 -5.01 116.55 122.16 2dmc n ASP 43 Ca 0.47 -2.94 0.00 0.00 -0.53 0.00 0.00 54.79 51.79 2dmc n ASP 43 Cb 1.01 -0.69 0.00 0.00 -0.64 0.00 0.00 41.12 40.81 2dmc n ASP 43 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51 2dmc n LEU 44 N 2.21 0.00 -0.33 0.64 4.77 -1.26 -0.96 117.00 122.07 2dmc n LEU 44 Ca 0.24 0.75 -0.07 0.00 -0.03 0.00 0.00 56.01 56.89 2dmc n LEU 44 Cb 0.40 -0.25 -0.04 0.00 -2.33 0.00 0.00 43.42 41.20 2dmc n LEU 44 CO 0.21 -0.25 0.54 0.28 -1.33 0.00 0.00 177.39 176.84 2dmc h SER 45 N 0.00 -1.74 -1.21 -1.43 0.02 -1.98 0.81 113.55 108.03 2dmc h SER 45 Ca 0.00 0.30 0.37 0.00 -0.84 0.00 0.00 61.79 61.62 2dmc h SER 45 Cb 0.00 0.81 -0.12 0.00 0.14 0.00 0.00 62.40 63.23 2dmc h SER 45 CO 0.00 -0.29 0.78 0.28 -1.14 0.00 0.00 176.83 176.46 2dmc h SER 46 N -0.08 0.32 -3.18 3.07 0.02 -1.84 -3.40 113.55 108.45 2dmc h SER 46 Ca 0.22 0.12 -0.47 0.00 -0.84 0.00 0.00 61.79 60.82 2dmc h SER 46 Cb 0.52 0.08 0.04 0.00 0.14 0.00 0.00 62.40 63.18 2dmc h SER 46 CO -0.87 -0.09 0.02 -0.76 -1.14 0.00 0.00 176.83 174.00 2dmc s LEU 47 N -9.54 3.52 0.07 5.07 1.43 0.28 -2.68 118.68 116.84 2dmc s LEU 47 Ca -0.08 0.54 0.08 0.00 -1.03 0.00 0.00 54.13 53.64 2dmc s LEU 47 Cb 0.28 -3.41 -0.03 0.00 0.03 0.00 0.00 46.19 43.06 2dmc s LEU 47 CO 0.81 -0.79 -0.22 -0.89 0.23 0.00 0.00 176.35 175.50 2dmc s THR 48 N -2.72 1.76 -0.19 5.49 2.01 0.13 -4.91 115.64 117.21 2dmc s THR 48 Ca 0.50 -1.37 -0.01 0.00 0.31 0.00 0.00 61.69 61.12 2dmc s THR 48 Cb -0.10 -1.55 0.00 0.00 0.01 0.00 0.00 72.50 70.86 2dmc s THR 48 CO 0.41 0.12 -0.11 0.00 -0.69 0.00 0.00 174.62 174.35 2dmc s ALA 49 N -0.94 2.61 -0.13 7.40 0.00 -1.26 -3.71 121.76 125.72 2dmc s ALA 49 Ca 0.08 -1.13 -0.06 0.00 0.00 0.00 0.00 51.96 50.85 2dmc s ALA 49 Cb -0.09 -1.43 0.06 0.00 0.00 0.00 0.00 23.12 21.65 2dmc s ALA 49 CO 0.03 -0.28 0.30 -1.12 0.00 0.00 0.00 175.76 174.69 2dmc s SER 50 N 1.21 -0.08 0.04 0.00 0.01 -1.08 -4.89 113.70 108.90 2dmc s SER 50 Ca 0.02 0.66 0.05 0.00 1.31 0.00 0.00 55.95 57.98 2dmc s SER 50 Cb -0.14 0.67 -0.02 0.00 0.21 0.00 0.00 66.02 66.73 2dmc s SER 50 CO -0.05 -0.20 -0.14 -0.63 0.41 0.00 0.00 173.24 172.63 2dmc s ILE 51 N 1.84 1.11 -0.20 1.44 1.01 -1.26 0.56 121.20 125.69 2dmc s ILE 51 Ca -0.05 -0.97 -0.05 0.00 0.00 0.00 0.00 60.65 59.59 2dmc s ILE 51 Cb -0.11 -1.00 0.10 0.00 0.01 0.00 0.00 42.46 41.46 2dmc s ILE 51 CO -0.10 0.03 0.36 -0.75 0.00 0.00 0.00 174.94 174.48 2dmc s LYS 52 N -1.08 0.29 1.05 2.79 2.20 -1.23 -1.14 119.74 122.62 2dmc s LYS 52 Ca 0.02 0.74 -0.23 0.00 -0.36 0.00 0.00 55.97 56.14 2dmc s LYS 52 Cb -0.08 -0.15 -0.06 0.00 -1.51 0.00 0.00 37.83 36.03 2dmc s LYS 52 CO 0.01 -0.44 -0.79 0.00 -0.36 0.00 0.00 175.35 173.78 2dmc n ALA 53 N 5.37 -4.99 0.40 3.13 0.00 0.12 -4.06 120.51 120.47 2dmc n ALA 53 Ca -0.06 -1.27 0.12 0.00 0.00 0.00 0.00 53.44 52.23 2dmc n ALA 53 Cb 0.50 -1.16 0.49 0.00 0.00 0.00 0.00 19.45 19.28 2dmc n ALA 53 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2dmc n PRO 54 N 0.46 0.19 0.00 0.00 -0.04 -1.26 -2.01 135.00 132.34 2dmc n PRO 54 Ca -0.01 0.42 0.14 0.00 -0.04 0.00 0.00 63.50 64.02 2dmc n PRO 54 Cb 0.68 -1.86 0.53 0.00 -0.04 0.00 0.00 33.50 32.81 2dmc n PRO 54 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2dmc n SER 55 N -2.22 1.32 0.00 3.54 2.88 -1.26 -4.90 113.62 112.98 2dmc n SER 55 Ca 0.02 -1.36 0.00 0.00 -1.33 0.00 0.00 58.87 56.20 2dmc n SER 55 Cb 0.22 0.02 0.00 0.00 -0.75 0.00 0.00 64.21 63.70 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 1.19 0.64 3.48 0.46 0.00 -0.85 -5.05 105.19 105.06 2dmc n GLY 56 Ca 0.18 -0.67 -0.39 0.00 0.00 0.00 0.00 46.02 45.14 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 -1.29 3.40 0.49 1.61 0.52 -1.25 -4.90 118.95 117.52 2dmc s ARG 57 Ca 0.00 -0.69 -0.24 0.00 -0.52 0.00 0.00 55.73 54.28 2dmc s ARG 57 Cb 0.00 -3.68 -0.07 0.00 0.52 0.00 0.00 34.95 31.72 2dmc s ARG 57 CO 0.00 -0.43 1.40 -3.47 0.02 0.00 0.00 175.30 172.82 2dmc n ASP 58 N 5.04 3.06 -4.29 0.23 2.03 -1.26 -0.70 116.55 120.65 2dmc n ASP 58 Ca -0.13 1.06 -0.28 0.00 0.52 0.00 0.00 54.79 55.96 2dmc n ASP 58 Cb 0.49 -1.59 -0.15 0.00 -0.72 0.00 0.00 41.12 39.16 2dmc n ASP 58 CO 0.00 0.00 0.00 -1.61 -1.92 0.00 0.00 177.20 173.67 2dmc s GLU 59 N -2.61 1.65 -0.65 -0.67 0.41 -0.29 -4.83 118.70 111.71 2dmc s GLU 59 Ca 0.65 -1.00 -0.26 0.00 -0.41 0.00 0.00 54.97 53.95 2dmc s GLU 59 Cb -0.44 -1.77 -0.02 0.00 -1.78 0.00 0.00 34.13 30.12 2dmc s GLU 59 CO 0.54 0.46 1.87 -1.25 -0.49 0.00 0.00 175.26 176.39 2dmc s PRO 60 N -1.10 2.62 0.02 0.39 0.04 -1.26 -4.32 135.00 131.39 2dmc s PRO 60 Ca 0.10 0.50 0.04 0.00 0.04 0.00 0.00 61.00 61.68 2dmc s PRO 60 Cb -0.09 -4.47 -0.03 0.00 0.04 0.00 0.00 34.50 29.95 2dmc s PRO 60 CO 0.01 -2.81 -0.09 0.00 0.04 0.00 0.00 177.00 174.16 2dmc s LEU 62 N -1.53 0.17 0.17 0.00 1.98 0.19 -4.90 118.68 114.75 2dmc s LEU 62 Ca 0.17 0.18 -0.29 0.00 -2.89 0.00 0.00 54.13 51.30 2dmc s LEU 62 Cb -0.11 0.04 -0.07 0.00 0.66 0.00 0.00 46.19 46.70 2dmc s LEU 62 CO 0.08 -0.23 0.92 -0.76 -1.89 0.00 0.00 176.35 174.46 2dmc s LEU 63 N 2.08 4.57 0.08 -0.68 1.43 -1.26 -1.22 118.68 123.68 2dmc s LEU 63 Ca 0.02 1.82 -0.07 0.00 -1.03 0.00 0.00 54.13 54.88 2dmc s LEU 63 Cb -0.12 -3.54 -0.01 0.00 0.03 0.00 0.00 46.19 42.55 2dmc s LEU 63 CO -0.04 0.07 0.14 -1.59 0.23 0.00 0.00 176.35 175.16 2dmc s LYS 64 N -0.67 0.78 -0.29 1.70 -2.85 -1.16 -4.98 119.74 112.27 2dmc s LYS 64 Ca 0.42 -1.00 -0.21 0.00 -1.00 0.00 0.00 55.97 54.19 2dmc s LYS 64 Cb -0.24 0.31 -0.01 0.00 -2.06 0.00 0.00 37.83 35.83 2dmc s LYS 64 CO 0.30 -0.23 0.65 0.50 0.10 0.00 0.00 175.35 176.67 2dmc s ARG 65 N -3.80 3.96 0.35 1.78 3.00 -1.26 -3.33 118.95 119.65 2dmc s ARG 65 Ca 0.05 0.41 -0.08 0.00 -1.00 0.00 0.00 55.73 55.10 2dmc s ARG 65 Cb 0.05 -3.71 -0.06 0.00 0.00 0.00 0.00 34.95 31.23 2dmc s ARG 65 CO -0.10 -0.54 0.67 -0.51 0.00 0.00 0.00 175.30 174.82 2dmc s LEU 66 N 2.63 3.95 1.23 -0.88 1.43 0.13 -4.97 118.68 122.18 2dmc s LEU 66 Ca 0.26 0.97 -0.20 0.00 -1.03 0.00 0.00 54.13 54.13 2dmc s LEU 66 Cb -0.15 -3.81 0.30 0.00 0.03 0.00 0.00 46.19 42.56 2dmc s LEU 66 CO 0.11 -0.30 1.11 -2.16 0.23 0.00 0.00 176.35 175.35 2dmc s PRO 67 N -3.64 -1.41 -1.73 1.29 0.04 -1.26 -2.49 135.00 125.79 2dmc s PRO 67 Ca 0.48 -0.14 -0.00 0.00 0.04 0.00 0.00 61.00 61.38 2dmc s PRO 67 Cb -0.10 -1.58 0.00 0.00 0.04 0.00 0.00 34.50 32.86 2dmc s PRO 67 CO 0.30 -3.82 0.06 0.09 0.04 0.00 0.00 177.00 173.66 2dmc n ASN 68 N -4.83 -5.85 -3.48 6.66 4.13 -1.26 -2.13 115.26 108.50 2dmc n ASN 68 Ca 0.14 -0.03 -0.18 0.00 1.68 0.00 0.00 54.58 56.19 2dmc n ASN 68 Cb 0.60 -4.86 0.08 0.00 -1.54 0.00 0.00 39.78 34.06 2dmc n ASN 68 CO 0.00 0.00 0.00 0.59 0.28 0.00 0.00 177.26 178.13 2dmc n ASN 69 N -2.05 -2.38 -4.20 6.41 3.02 -1.26 -5.02 115.26 109.78 2dmc n ASN 69 Ca -0.23 -0.64 -0.12 0.00 -0.03 0.00 0.00 54.58 53.56 2dmc n ASN 69 Cb 0.68 -5.00 -0.10 0.00 -0.61 0.00 0.00 39.78 34.75 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 -3.39 1.06 -0.07 3.10 3.76 -0.90 -5.07 115.29 113.77 2dmc s HIS 70 Ca 0.06 -0.83 -0.06 0.00 -0.15 0.00 0.00 55.06 54.08 2dmc s HIS 70 Cb -0.03 -0.57 0.03 0.00 1.11 0.00 0.00 32.58 33.12 2dmc s HIS 70 CO 0.74 -0.04 0.19 0.42 -0.85 0.00 0.00 174.74 175.19 2dmc s ILE 71 N -3.43 -0.02 0.13 0.60 1.01 -1.26 0.19 121.20 118.43 2dmc s ILE 71 Ca 0.13 0.06 0.01 0.00 0.00 0.00 0.00 60.65 60.85 2dmc s ILE 71 Cb 0.04 -0.28 -0.00 0.00 0.01 0.00 0.00 42.46 42.22 2dmc s ILE 71 CO -0.02 0.02 0.15 0.61 0.00 0.00 0.00 174.94 175.70 2dmc n GLY 72 N 3.41 3.15 3.44 6.18 0.00 -1.21 -3.76 105.19 116.40 2dmc n GLY 72 Ca -0.17 -1.59 -0.30 0.00 0.00 0.00 0.00 46.02 43.96 2dmc n GLY 72 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2dmc s ILE 73 N -2.54 2.63 -0.14 -0.61 2.07 -0.94 -2.99 121.20 118.68 2dmc s ILE 73 Ca 0.12 -1.41 0.00 0.00 -1.41 0.00 0.00 60.65 57.96 2dmc s ILE 73 Cb 0.00 -2.14 0.02 0.00 0.13 0.00 0.00 42.46 40.48 2dmc s ILE 73 CO 0.09 0.22 -0.14 -0.55 -1.91 0.00 0.00 174.94 172.66 2dmc s SER 74 N -1.74 2.62 0.27 4.50 0.15 -0.36 -2.09 113.70 117.06 2dmc s SER 74 Ca 0.15 -0.46 -0.10 0.00 0.70 0.00 0.00 55.95 56.24 2dmc s SER 74 Cb -0.10 -1.14 -0.00 0.00 -1.71 0.00 0.00 66.02 63.07 2dmc s SER 74 CO 0.06 -0.06 0.48 0.72 1.20 0.00 0.00 173.24 175.65 2dmc s PHE 75 N 1.48 0.54 -0.35 3.44 -0.71 -1.25 0.54 117.98 121.67 2dmc s PHE 75 Ca 0.04 -0.89 0.02 0.00 -1.04 0.00 0.00 56.93 55.07 2dmc s PHE 75 Cb -0.13 0.14 0.10 0.00 -1.21 0.00 0.00 43.02 41.92 2dmc s PHE 75 CO -0.10 -1.05 0.08 0.42 -1.34 0.00 0.00 175.22 173.24 2dmc s ILE 76 N -3.70 2.55 0.16 -4.49 1.01 -1.16 -2.56 121.20 113.00 2dmc s ILE 76 Ca 0.25 -2.24 -0.31 0.00 0.00 0.00 0.00 60.65 58.35 2dmc s ILE 76 Cb -0.01 -2.83 -0.08 0.00 0.01 0.00 0.00 42.46 39.56 2dmc s ILE 76 CO 0.12 -0.60 1.33 -2.16 0.00 0.00 0.00 174.94 173.63 2dmc s PRO 77 N 0.97 4.36 0.00 2.79 0.04 -1.26 -4.59 135.00 137.32 2dmc s PRO 77 Ca 0.09 2.04 0.17 0.00 0.04 0.00 0.00 61.00 63.35 2dmc s PRO 77 Cb -0.20 -3.22 0.05 0.00 0.04 0.00 0.00 34.50 31.17 2dmc s PRO 77 CO -0.07 -0.33 0.94 0.54 0.04 0.00 0.00 177.00 178.13 2dmc n ARG 78 N 3.23 1.55 -4.18 4.56 3.00 -1.26 -1.02 116.66 122.54 2dmc n ARG 78 Ca 0.08 -1.12 -0.12 0.00 -0.01 0.00 0.00 57.85 56.68 2dmc n ARG 78 Cb 0.43 -1.30 -0.09 0.00 0.00 0.00 0.00 32.46 31.49 2dmc n ARG 78 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.63 176.42 2dmc s GLU 79 N -1.72 1.31 0.04 5.56 2.02 -1.26 -4.93 118.70 119.71 2dmc s GLU 79 Ca 0.16 -1.63 0.08 0.00 0.02 0.00 0.00 54.97 53.61 2dmc s GLU 79 Cb 0.14 0.30 -0.03 0.00 0.10 0.00 0.00 34.13 34.64 2dmc s GLU 79 CO 0.33 -0.45 -0.23 0.14 0.02 0.00 0.00 175.26 175.06 2dmc s VAL 80 N -4.05 2.37 -0.69 2.63 -7.23 -1.26 -4.83 120.40 107.34 2dmc s VAL 80 Ca 0.37 -1.29 0.00 0.00 -1.81 0.00 0.00 61.98 59.25 2dmc s VAL 80 Cb 0.06 -1.94 0.00 0.00 0.56 0.00 0.00 36.38 35.05 2dmc s VAL 80 CO 0.13 0.38 0.00 0.61 -0.31 0.00 0.00 175.10 175.91 2dmc n GLY 81 N 1.77 0.35 3.24 2.32 0.00 0.79 -4.93 105.19 108.73 2dmc n GLY 81 Ca -0.17 -1.20 -0.41 0.00 0.00 0.00 0.00 46.02 44.24 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 2.57 0.14 1.61 2.12 -1.26 -0.85 118.70 121.02 2dmc s GLU 82 Ca 0.00 -1.67 -0.19 0.00 0.36 0.00 0.00 54.97 53.47 2dmc s GLU 82 Cb 0.00 -3.93 -0.07 0.00 0.26 0.00 0.00 34.13 30.39 2dmc s GLU 82 CO 0.00 -1.14 0.64 -1.01 -0.54 0.00 0.00 175.26 173.21 2dmc s HIS 83 N 1.41 3.74 -0.25 5.30 3.76 0.71 -4.44 115.29 125.52 2dmc s HIS 83 Ca 0.05 1.32 -0.04 0.00 -0.15 0.00 0.00 55.06 56.23 2dmc s HIS 83 Cb -0.26 -2.54 0.00 0.00 1.11 0.00 0.00 32.58 30.89 2dmc s HIS 83 CO 0.01 0.48 0.00 -0.51 -0.85 0.00 0.00 174.74 173.86 2dmc s LEU 84 N -1.52 3.31 -0.37 0.89 1.43 -1.26 -0.82 118.68 120.34 2dmc s LEU 84 Ca 0.35 -0.60 -0.15 0.00 -1.03 0.00 0.00 54.13 52.71 2dmc s LEU 84 Cb -0.18 -1.78 -0.00 0.00 0.03 0.00 0.00 46.19 44.25 2dmc s LEU 84 CO 0.21 -0.10 0.33 -0.69 0.23 0.00 0.00 176.35 176.32 2dmc s VAL 85 N 1.46 5.21 -0.47 -1.59 1.01 0.10 -3.52 120.40 122.59 2dmc s VAL 85 Ca 0.03 -0.21 -0.27 0.00 0.00 0.00 0.00 61.98 61.53 2dmc s VAL 85 Cb -0.16 -3.84 0.03 0.00 0.00 0.00 0.00 36.38 32.41 2dmc s VAL 85 CO -0.01 -0.16 1.03 -0.44 0.00 0.00 0.00 175.10 175.52 2dmc s SER 86 N 1.73 6.56 -0.26 3.32 0.01 0.19 0.78 113.70 126.03 2dmc s SER 86 Ca 0.09 0.28 0.00 0.00 1.31 0.00 0.00 55.95 57.63 2dmc s SER 86 Cb -0.17 -2.50 0.04 0.00 0.21 0.00 0.00 66.02 63.60 2dmc s SER 86 CO 0.11 -1.16 -0.08 -0.63 0.41 0.00 0.00 173.24 171.89 2dmc s ILE 87 N 4.12 2.55 0.33 1.44 -1.09 -1.26 -2.63 121.20 124.65 2dmc s ILE 87 Ca 0.42 -1.35 0.03 0.00 -2.23 0.00 0.00 60.65 57.52 2dmc s ILE 87 Cb -0.09 -2.40 -0.05 0.00 -1.58 0.00 0.00 42.46 38.35 2dmc s ILE 87 CO 0.29 0.06 0.10 -0.54 -1.23 0.00 0.00 174.94 173.62 2dmc s LYS 88 N 1.21 1.65 -0.26 2.79 1.02 -1.24 -1.40 119.74 123.51 2dmc s LYS 88 Ca -0.04 -1.94 0.00 0.00 0.02 0.00 0.00 55.97 54.01 2dmc s LYS 88 Cb -0.18 -0.57 0.08 0.00 -0.52 0.00 0.00 37.83 36.63 2dmc s LYS 88 CO -0.05 -0.31 0.01 0.21 -0.92 0.00 0.00 175.35 174.29 2dmc s LYS 89 N -3.88 1.27 -1.67 1.68 2.20 0.88 0.18 119.74 120.40 2dmc s LYS 89 Ca 0.34 -1.08 0.00 0.00 -0.36 0.00 0.00 55.97 54.87 2dmc s LYS 89 Cb 0.07 -2.48 0.00 0.00 -1.51 0.00 0.00 37.83 33.90 2dmc s LYS 89 CO 0.15 -0.75 0.00 0.09 -0.36 0.00 0.00 175.35 174.48 2dmc n ASN 90 N 4.69 -5.32 0.00 1.43 3.02 -1.09 -1.90 115.26 116.09 2dmc n ASN 90 Ca -0.07 0.09 0.00 0.00 -0.03 0.00 0.00 54.58 54.57 2dmc n ASN 90 Cb 0.44 -4.40 0.00 0.00 -0.61 0.00 0.00 39.78 35.21 2dmc n ASN 90 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2dmc n GLY 91 N -0.95 0.85 2.78 7.41 0.00 -1.26 -5.06 105.19 108.96 2dmc n GLY 91 Ca -0.21 -0.21 -0.30 0.00 0.00 0.00 0.00 46.02 45.30 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 -2.19 3.84 0.34 1.61 0.01 -0.80 -5.09 114.94 112.65 2dmc s ASN 92 Ca 0.00 -1.45 -0.23 0.00 -0.71 0.00 0.00 52.86 50.47 2dmc s ASN 92 Cb 0.00 -0.90 -0.16 0.00 0.41 0.00 0.00 41.25 40.60 2dmc s ASN 92 CO 0.00 -0.37 0.20 1.41 -1.51 0.00 0.00 177.10 176.83 2dmc n HIS 93 N 4.83 -1.66 -3.73 2.20 8.25 -1.26 -0.08 115.22 123.76 2dmc n HIS 93 Ca -0.04 0.71 -0.21 0.00 -0.26 0.00 0.00 57.72 57.91 2dmc n HIS 93 Cb 0.43 -1.80 0.01 0.00 1.12 0.00 0.00 29.99 29.75 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 -0.74 0.00 -2.07 1.59 0.24 -0.49 -4.67 118.33 112.19 2dmc n VAL 94 Ca 0.13 -1.83 -0.35 0.00 -2.04 0.00 0.00 64.34 60.25 2dmc n VAL 94 Cb 0.35 -0.15 0.02 0.00 -1.47 0.00 0.00 33.84 32.59 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 -2.66 2.59 -1.74 2.33 0.00 -1.26 -3.04 121.76 117.98 2dmc s ALA 95 Ca 0.29 0.81 0.00 0.00 0.00 0.00 0.00 51.96 53.06 2dmc s ALA 95 Cb -0.02 -3.38 0.00 0.00 0.00 0.00 0.00 23.12 19.72 2dmc s ALA 95 CO 0.19 -1.00 0.00 0.09 0.00 0.00 0.00 175.76 175.04 2dmc n ASN 96 N -1.65 -5.75 -4.08 0.00 3.02 -1.26 -4.93 115.26 100.61 2dmc n ASN 96 Ca 0.12 0.01 -0.19 0.00 -0.03 0.00 0.00 54.58 54.49 2dmc n ASN 96 Cb 0.51 -4.80 -0.14 0.00 -0.61 0.00 0.00 39.78 34.74 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 -2.06 1.34 0.63 6.41 0.15 -1.17 -3.43 113.70 115.57 2dmc s SER 97 Ca 0.00 -0.33 -0.16 0.00 0.70 0.00 0.00 55.95 56.16 2dmc s SER 97 Cb 0.00 -0.10 -0.01 0.00 -1.71 0.00 0.00 66.02 64.19 2dmc s SER 97 CO 0.00 0.05 1.11 -2.16 1.20 0.00 0.00 173.24 173.45 2dmc s PRO 98 N -0.74 2.93 -0.27 5.44 0.04 -1.26 -4.82 135.00 136.32 2dmc s PRO 98 Ca 0.01 1.44 -0.24 0.00 0.04 0.00 0.00 61.00 62.26 2dmc s PRO 98 Cb -0.06 -1.96 -0.00 0.00 0.04 0.00 0.00 34.50 32.51 2dmc s PRO 98 CO 0.00 -1.16 0.79 0.08 0.04 0.00 0.00 177.00 176.76 2dmc s VAL 99 N -2.21 4.83 0.14 -0.36 1.01 0.23 -4.74 120.40 119.30 2dmc s VAL 99 Ca 0.68 1.36 -0.29 0.00 0.00 0.00 0.00 61.98 63.73 2dmc s VAL 99 Cb -0.21 -4.11 -0.07 0.00 0.00 0.00 0.00 36.38 31.99 2dmc s VAL 99 CO 0.38 -0.14 0.94 -0.55 0.00 0.00 0.00 175.10 175.73 2dmc s SER 100 N 1.47 7.51 0.02 3.32 0.15 -1.26 -0.72 113.70 124.18 2dmc s SER 100 Ca 0.33 1.80 0.03 0.00 0.70 0.00 0.00 55.95 58.80 2dmc s SER 100 Cb -0.15 -2.58 -0.01 0.00 -1.71 0.00 0.00 66.02 61.57 2dmc s SER 100 CO 0.10 -0.00 -0.09 -0.63 1.20 0.00 0.00 173.24 173.81 2dmc s ILE 101 N -0.29 0.70 -0.21 6.45 1.01 -0.00 -4.98 121.20 123.87 2dmc s ILE 101 Ca 0.45 -0.67 -0.07 0.00 0.00 0.00 0.00 60.65 60.36 2dmc s ILE 101 Cb -0.24 -0.64 -0.03 0.00 0.01 0.00 0.00 42.46 41.56 2dmc s ILE 101 CO 0.30 -0.01 0.05 -0.32 0.00 0.00 0.00 174.94 174.96 2dmc s MET 102 N -0.76 3.81 -0.14 2.79 1.75 -1.26 -0.20 119.30 125.28 2dmc s MET 102 Ca -0.01 -0.42 0.02 0.00 -1.25 0.00 0.00 55.69 54.03 2dmc s MET 102 Cb -0.06 -3.23 0.00 0.00 2.84 0.00 0.00 34.83 34.39 2dmc s MET 102 CO 0.00 0.08 -0.19 0.08 -0.65 0.00 0.00 175.02 174.34 2dmc s VAL 103 N 0.88 2.37 0.12 10.11 1.01 -0.03 -4.38 120.40 130.48 2dmc s VAL 103 Ca 0.03 -0.88 0.07 0.00 0.00 0.00 0.00 61.98 61.21 2dmc s VAL 103 Cb -0.14 -1.97 -0.04 0.00 0.00 0.00 0.00 36.38 34.24 2dmc s VAL 103 CO 0.02 0.53 -0.17 0.68 0.00 0.00 0.00 175.10 176.16 2dmc s VAL 104 N 0.75 1.58 -1.01 2.92 -7.23 -1.26 -0.15 120.40 115.99 2dmc s VAL 104 Ca -0.08 -1.69 -0.21 0.00 -1.81 0.00 0.00 61.98 58.19 2dmc s VAL 104 Cb -0.16 -1.59 0.08 0.00 0.56 0.00 0.00 36.38 35.27 2dmc s VAL 104 CO 0.00 -0.26 1.36 -1.10 -0.31 0.00 0.00 175.10 174.79 2dmc s GLN 105 N -2.39 3.63 -0.29 4.82 -0.21 -1.26 -4.18 119.66 119.78 2dmc s GLN 105 Ca 0.09 -1.43 -0.39 0.00 0.02 0.00 0.00 55.36 53.65 2dmc s GLN 105 Cb -0.07 -5.21 -0.15 0.00 1.00 0.00 0.00 33.01 28.58 2dmc s GLN 105 CO 0.04 -2.05 1.87 0.43 -2.12 0.00 0.00 175.29 173.47 2dmc n SER 106 N 7.98 2.36 -4.69 5.90 7.64 -1.25 -4.89 113.62 126.67 2dmc n SER 106 Ca 0.31 0.91 -0.34 0.00 1.01 0.00 0.00 58.87 60.76 2dmc n SER 106 Cb 0.50 -1.17 0.12 0.00 -1.01 0.00 0.00 64.21 62.64 2dmc n SER 106 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2dmc n GLU 107 N 6.22 0.33 -0.03 1.43 4.71 -1.26 -4.64 120.64 127.40 2dmc n GLU 107 Ca 0.31 0.18 -0.00 0.00 -0.01 0.00 0.00 57.16 57.64 2dmc n GLU 107 Cb 0.16 -2.44 -0.00 0.00 -1.01 0.00 0.00 31.44 28.14 2dmc n GLU 107 CO 0.00 0.00 0.00 0.82 0.09 0.00 0.00 177.13 178.04 2dmc h ILE 108 N -0.68 0.00 0.00 -3.67 2.04 -1.85 -3.49 117.51 109.86 2dmc h ILE 108 Ca -0.47 -0.74 0.00 0.00 1.00 0.00 0.00 64.86 64.65 2dmc h ILE 108 Cb 1.31 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 37.39 2dmc h ILE 108 CO 0.47 0.00 0.00 0.61 0.00 0.00 0.00 178.15 179.23 2dmc n GLY 109 N 1.76 3.10 3.95 5.37 0.00 -1.26 -4.94 105.19 113.17 2dmc n GLY 109 Ca -0.00 -0.41 -0.23 0.00 0.00 0.00 0.00 46.02 45.37 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 0.00 5.95 0.09 1.61 1.11 -1.26 -5.11 116.67 119.05 2dmc s ASP 110 Ca 0.00 0.33 0.09 0.00 0.18 0.00 0.00 52.55 53.15 2dmc s ASP 110 Cb 0.00 -1.65 -0.03 0.00 1.07 0.00 0.00 42.92 42.31 2dmc s ASP 110 CO 0.00 -0.61 -0.24 -0.55 1.18 0.00 0.00 175.17 174.96 2dmc s SER 111 N -4.17 2.88 0.00 0.27 0.15 -1.26 -5.11 113.70 106.46 2dmc s SER 111 Ca 0.46 -0.67 0.00 0.00 0.70 0.00 0.00 55.95 56.45 2dmc s SER 111 Cb -0.10 -0.20 0.00 0.00 -1.71 0.00 0.00 66.02 64.01 2dmc s SER 111 CO 0.38 0.15 0.00 0.61 1.20 0.00 0.00 173.24 175.57 2dmc n GLY 112 N 1.26 2.43 3.71 9.45 0.00 -1.26 -5.09 105.19 115.69 2dmc n GLY 112 Ca -0.18 -1.81 -0.42 0.00 0.00 0.00 0.00 46.02 43.61 2dmc n GLY 112 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dmc s PRO 113 N -1.64 4.32 -0.29 1.61 0.04 -1.26 -5.00 135.00 132.78 2dmc s PRO 113 Ca 0.00 2.03 -0.16 0.00 0.04 0.00 0.00 61.00 62.91 2dmc s PRO 113 Cb 0.00 -3.33 0.16 0.00 0.04 0.00 0.00 34.50 31.37 2dmc s PRO 113 CO 0.00 -0.45 1.03 -1.54 0.04 0.00 0.00 177.00 176.07 2dmc s SER 114 N 1.29 -0.43 -0.08 6.66 1.04 -1.26 -5.18 113.70 115.74 2dmc s SER 114 Ca 0.64 0.68 -0.30 0.00 0.48 0.00 0.00 55.95 57.45 2dmc s SER 114 Cb -0.35 1.19 0.07 0.00 0.10 0.00 0.00 66.02 67.03 2dmc s SER 114 CO 0.29 -0.11 0.69 -0.55 0.98 0.00 0.00 173.24 174.54 2dmc s SER 115 N 1.33 -0.67 0.00 7.02 0.15 -1.26 -4.94 113.70 115.33 2dmc s SER 115 Ca -0.09 0.80 0.00 0.00 0.70 0.00 0.00 55.95 57.36 2dmc s SER 115 Cb -0.03 0.64 0.00 0.00 -1.71 0.00 0.00 66.02 64.92 2dmc s SER 115 CO -0.14 -0.57 0.00 0.61 1.20 0.00 0.00 173.24 174.34