#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dmc n SER 2 N 0.00 -4.53 -4.86 1.61 2.88 -1.26 -4.96 113.62 102.51 2dmc n SER 2 Ca 0.00 -0.76 -0.37 0.00 -1.33 0.00 0.00 58.87 56.40 2dmc n SER 2 Cb 0.00 -4.01 -0.06 0.00 -0.75 0.00 0.00 64.21 59.39 2dmc n SER 2 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2dmc s SER 3 N -3.44 6.62 0.00 -3.46 1.04 -1.26 -4.89 113.70 108.31 2dmc s SER 3 Ca 0.58 0.74 0.00 0.00 0.48 0.00 0.00 55.95 57.75 2dmc s SER 3 Cb -0.29 -2.17 0.00 0.00 0.10 0.00 0.00 66.02 63.67 2dmc s SER 3 CO 0.82 0.36 0.00 0.61 0.98 0.00 0.00 173.24 176.01 2dmc n GLY 4 N 1.85 0.00 3.50 7.32 0.00 -1.26 -5.14 105.19 111.45 2dmc n GLY 4 Ca -0.16 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.43 2dmc n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2dmc n SER 5 N 0.00 -0.12 -0.11 1.61 7.64 -1.26 -4.94 113.62 116.43 2dmc n SER 5 Ca 0.00 1.02 -0.20 0.00 1.01 0.00 0.00 58.87 60.70 2dmc n SER 5 Cb 0.00 -1.17 -0.07 0.00 -1.01 0.00 0.00 64.21 61.97 2dmc n SER 5 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2dmc n SER 6 N 1.25 1.87 0.00 6.43 7.64 -1.26 -5.14 113.62 124.42 2dmc n SER 6 Ca 0.12 0.32 0.00 0.00 1.01 0.00 0.00 58.87 60.32 2dmc n SER 6 Cb 0.36 -0.75 0.00 0.00 -1.01 0.00 0.00 64.21 62.81 2dmc n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dmc n GLY 7 N 1.44 0.91 3.42 0.23 0.00 -1.26 -4.98 105.19 104.95 2dmc n GLY 7 Ca -0.35 -1.83 -0.42 0.00 0.00 0.00 0.00 46.02 43.41 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 1.04 1.58 -2.06 -0.61 -5.35 -1.26 -4.75 119.36 107.96 2dmc n ILE 8 Ca 0.00 -0.50 -0.27 0.00 -0.27 0.00 0.00 62.75 61.71 2dmc n ILE 8 Cb 0.00 -0.42 -0.06 0.00 -1.74 0.00 0.00 39.64 37.43 2dmc n ILE 8 CO 0.00 0.00 0.00 -2.16 -1.76 0.00 0.00 176.55 172.63 2dmc s PRO 9 N -1.43 2.52 0.07 6.28 0.04 -1.26 -4.94 135.00 136.28 2dmc s PRO 9 Ca 0.62 -0.71 -0.31 0.00 0.04 0.00 0.00 61.00 60.64 2dmc s PRO 9 Cb -0.64 -5.15 -0.07 0.00 0.04 0.00 0.00 34.50 28.69 2dmc s PRO 9 CO 0.59 -3.68 1.33 0.20 0.04 0.00 0.00 177.00 175.49 2dmc s GLY 10 N 7.29 2.07 -0.78 0.56 0.00 -1.26 -4.98 107.32 110.22 2dmc s GLY 10 Ca 0.69 0.97 -0.08 0.00 0.00 0.00 0.00 44.72 46.31 2dmc s GLY 10 CO 0.06 2.30 0.67 -1.35 0.00 0.00 0.00 173.10 174.77 2dmc s SER 11 N 1.29 6.10 0.00 1.64 1.04 -1.26 -4.89 113.70 117.62 2dmc s SER 11 Ca 0.63 -2.96 0.15 0.00 0.48 0.00 0.00 55.95 54.25 2dmc s SER 11 Cb -0.33 -2.03 0.78 0.00 0.10 0.00 0.00 66.02 64.54 2dmc s SER 11 CO 0.29 -0.42 1.40 -0.81 0.98 0.00 0.00 173.24 174.68 2dmc n PRO 12 N 3.47 0.26 -1.97 4.02 -0.04 -1.26 -4.74 135.00 134.73 2dmc n PRO 12 Ca 0.13 0.12 -0.43 0.00 -0.04 0.00 0.00 63.50 63.29 2dmc n PRO 12 Cb 0.41 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.35 2dmc n PRO 12 CO 0.00 0.00 0.00 0.12 -0.04 0.00 0.00 175.50 175.58 2dmc s PHE 13 N -2.47 1.87 0.19 0.54 5.36 -1.26 -4.97 117.98 117.24 2dmc s PHE 13 Ca 0.16 0.31 -0.01 0.00 -0.96 0.00 0.00 56.93 56.43 2dmc s PHE 13 Cb 0.10 -3.98 -0.04 0.00 -0.34 0.00 0.00 43.02 38.75 2dmc s PHE 13 CO 0.22 -3.67 0.11 0.95 -1.46 0.00 0.00 175.22 171.36 2dmc s THR 14 N 5.04 0.13 -0.17 0.12 -4.23 -1.26 -5.15 115.64 110.12 2dmc s THR 14 Ca 0.77 -1.98 -0.00 0.00 -1.18 0.00 0.00 61.69 59.29 2dmc s THR 14 Cb -0.31 -2.41 0.00 0.00 1.34 0.00 0.00 72.50 71.12 2dmc s THR 14 CO 0.31 -0.11 -0.14 0.00 -0.54 0.00 0.00 174.62 174.14 2dmc s ALA 15 N -4.06 2.52 -0.05 3.99 0.00 -1.26 -5.10 121.76 117.81 2dmc s ALA 15 Ca 0.35 -1.11 -0.02 0.00 0.00 0.00 0.00 51.96 51.18 2dmc s ALA 15 Cb 0.07 -1.31 0.03 0.00 0.00 0.00 0.00 23.12 21.91 2dmc s ALA 15 CO 0.10 -0.19 0.04 0.15 0.00 0.00 0.00 175.76 175.86 2dmc s LYS 16 N 1.07 0.13 -0.22 0.00 -0.14 -1.26 -5.03 119.74 114.29 2dmc s LYS 16 Ca -0.00 0.28 -0.02 0.00 -1.36 0.00 0.00 55.97 54.87 2dmc s LYS 16 Cb -0.14 -0.61 0.08 0.00 -1.68 0.00 0.00 37.83 35.47 2dmc s LYS 16 CO -0.04 -0.30 2.33 0.44 -0.76 0.00 0.00 175.35 177.02 2dmc n ILE 17 N 5.12 2.69 -3.63 2.17 -5.35 -1.26 -4.79 119.36 114.30 2dmc n ILE 17 Ca -0.07 -1.55 -0.13 0.00 -0.27 0.00 0.00 62.75 60.73 2dmc n ILE 17 Cb 0.50 -1.50 -0.07 0.00 -1.74 0.00 0.00 39.64 36.83 2dmc n ILE 17 CO 0.00 0.00 0.00 -0.89 -1.76 0.00 0.00 176.55 173.90 2dmc s THR 18 N -1.30 0.00 -0.14 7.28 2.01 -1.26 -5.16 115.64 117.07 2dmc s THR 18 Ca 0.32 0.00 -0.05 0.00 0.31 0.00 0.00 61.69 62.27 2dmc s THR 18 Cb 0.21 -1.00 0.07 0.00 0.01 0.00 0.00 72.50 71.79 2dmc s THR 18 CO -0.04 0.00 0.28 -1.81 -0.69 0.00 0.00 174.62 172.37 2dmc s ASP 19 N 0.33 0.24 0.47 3.53 1.11 -1.26 -5.15 116.67 115.94 2dmc s ASP 19 Ca 0.01 0.65 -0.19 0.00 0.18 0.00 0.00 52.55 53.20 2dmc s ASP 19 Cb -0.05 0.78 -0.10 0.00 1.07 0.00 0.00 42.92 44.62 2dmc s ASP 19 CO -0.01 -0.24 0.97 -1.81 1.18 0.00 0.00 175.17 175.26 2dmc s ASP 20 N 2.40 6.76 -0.30 0.27 1.01 -1.26 -4.95 116.67 120.59 2dmc s ASP 20 Ca 0.00 1.66 -0.01 0.00 0.71 0.00 0.00 52.55 54.91 2dmc s ASP 20 Cb -0.12 -2.53 0.16 0.00 1.01 0.00 0.00 42.92 41.44 2dmc s ASP 20 CO -0.09 -0.49 2.18 -1.20 0.21 0.00 0.00 175.17 175.78 2dmc n SER 21 N -1.04 6.35 -4.96 0.27 7.64 -1.26 -4.92 113.62 115.70 2dmc n SER 21 Ca 0.07 -3.02 -0.22 0.00 1.01 0.00 0.00 58.87 56.71 2dmc n SER 21 Cb 0.54 -1.10 0.03 0.00 -1.01 0.00 0.00 64.21 62.66 2dmc n SER 21 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 2dmc s ARG 22 N -1.58 2.79 -0.27 1.43 1.81 -1.26 -5.05 118.95 116.81 2dmc s ARG 22 Ca 0.34 -0.62 -0.12 0.00 -1.72 0.00 0.00 55.73 53.61 2dmc s ARG 22 Cb 0.25 -2.51 -0.14 0.00 -0.45 0.00 0.00 34.95 32.10 2dmc s ARG 22 CO -0.04 -0.52 -0.29 0.54 -0.68 0.00 0.00 175.30 174.32 2dmc n ARG 23 N -2.23 0.60 -1.24 3.54 5.12 -1.26 -4.94 116.66 116.25 2dmc n ARG 23 Ca 0.05 0.26 -0.57 0.00 -1.93 0.00 0.00 57.85 55.66 2dmc n ARG 23 Cb 0.59 -1.52 -0.11 0.00 -1.16 0.00 0.00 32.46 30.26 2dmc n ARG 23 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2dmc s SER 25 N 5.19 7.17 0.08 0.00 0.01 -1.26 -5.04 113.70 119.84 2dmc s SER 25 Ca 1.10 1.42 -0.22 0.00 1.31 0.00 0.00 55.95 59.56 2dmc s SER 25 Cb -1.40 -2.50 -0.07 0.00 0.21 0.00 0.00 66.02 62.26 2dmc s SER 25 CO 0.64 -0.28 0.66 -1.58 0.41 0.00 0.00 173.24 173.09 2dmc s GLN 26 N 1.32 4.37 0.19 12.44 0.74 -1.26 -4.37 119.66 133.09 2dmc s GLN 26 Ca 0.45 0.90 0.00 0.00 0.05 0.00 0.00 55.36 56.76 2dmc s GLN 26 Cb -0.19 -3.29 -0.04 0.00 1.10 0.00 0.00 33.01 30.59 2dmc s GLN 26 CO 0.21 0.51 0.07 0.08 -0.55 0.00 0.00 175.29 175.60 2dmc s VAL 27 N -0.76 0.32 -0.27 1.34 1.01 -1.26 -4.99 120.40 115.79 2dmc s VAL 27 Ca 0.33 -1.97 -0.08 0.00 0.00 0.00 0.00 61.98 60.25 2dmc s VAL 27 Cb -0.20 -2.30 -0.03 0.00 0.00 0.00 0.00 36.38 33.85 2dmc s VAL 27 CO 0.21 -0.26 0.11 -0.54 0.00 0.00 0.00 175.10 174.62 2dmc s LYS 28 N -4.04 3.61 -0.28 2.72 3.01 -1.26 -3.88 119.74 119.62 2dmc s LYS 28 Ca 0.31 -0.52 -0.29 0.00 -1.01 0.00 0.00 55.97 54.46 2dmc s LYS 28 Cb 0.07 -3.44 -0.02 0.00 -1.01 0.00 0.00 37.83 33.44 2dmc s LYS 28 CO 0.07 -0.25 1.66 -1.17 0.51 0.00 0.00 175.35 176.18 2dmc s LEU 29 N 1.63 3.70 0.00 3.17 2.96 -1.26 -2.30 118.68 126.59 2dmc s LEU 29 Ca 0.06 1.40 0.00 0.00 -0.22 0.00 0.00 54.13 55.37 2dmc s LEU 29 Cb -0.16 -3.53 0.00 0.00 0.50 0.00 0.00 46.19 43.00 2dmc s LEU 29 CO 0.05 -1.45 0.00 0.61 -1.32 0.00 0.00 176.35 174.24 2dmc n GLY 30 N 5.01 1.07 2.82 7.98 0.00 -0.93 -5.02 105.19 116.12 2dmc n GLY 30 Ca 0.20 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.07 2dmc n GLY 30 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dmc s SER 31 N -1.89 0.15 -0.04 1.61 1.04 -0.97 -5.02 113.70 108.59 2dmc s SER 31 Ca 0.00 0.01 -0.29 0.00 0.48 0.00 0.00 55.95 56.14 2dmc s SER 31 Cb 0.00 -0.08 -0.08 0.00 0.10 0.00 0.00 66.02 65.96 2dmc s SER 31 CO 0.00 -0.08 2.01 0.00 0.98 0.00 0.00 173.24 176.15 2dmc s ALA 32 N 0.72 3.35 0.20 5.32 0.00 -1.26 -4.45 121.76 125.63 2dmc s ALA 32 Ca -0.06 1.15 0.09 0.00 0.00 0.00 0.00 51.96 53.14 2dmc s ALA 32 Cb -0.09 -3.90 -0.04 0.00 0.00 0.00 0.00 23.12 19.08 2dmc s ALA 32 CO -0.02 -1.89 -0.10 0.00 0.00 0.00 0.00 175.76 173.75 2dmc s ALA 33 N 5.45 2.94 0.16 0.00 0.00 -0.86 -4.89 121.76 124.56 2dmc s ALA 33 Ca 0.90 -1.52 -0.01 0.00 0.00 0.00 0.00 51.96 51.33 2dmc s ALA 33 Cb -0.39 -0.70 -0.04 0.00 0.00 0.00 0.00 23.12 21.99 2dmc s ALA 33 CO 0.39 0.43 0.34 -0.51 0.00 0.00 0.00 175.76 176.42 2dmc s ASP 34 N -2.95 6.40 -0.14 0.00 1.01 -1.26 -2.85 116.67 116.88 2dmc s ASP 34 Ca 0.26 0.39 -0.02 0.00 0.71 0.00 0.00 52.55 53.89 2dmc s ASP 34 Cb -0.08 -2.01 0.04 0.00 1.01 0.00 0.00 42.92 41.88 2dmc s ASP 34 CO 0.15 0.02 -0.00 -0.36 0.21 0.00 0.00 175.17 175.20 2dmc s PHE 35 N -1.75 1.08 -0.28 4.23 0.40 -0.53 -4.97 117.98 116.16 2dmc s PHE 35 Ca 0.38 -0.67 -0.23 0.00 -0.60 0.00 0.00 56.93 55.80 2dmc s PHE 35 Cb -0.12 -1.03 -0.00 0.00 0.51 0.00 0.00 43.02 42.38 2dmc s PHE 35 CO 0.28 -0.51 0.78 -1.17 0.70 0.00 0.00 175.22 175.30 2dmc s LEU 36 N 1.84 4.08 -0.03 -0.37 2.96 -1.26 -2.66 118.68 123.25 2dmc s LEU 36 Ca 0.02 0.78 0.02 0.00 -0.22 0.00 0.00 54.13 54.72 2dmc s LEU 36 Cb -0.15 -3.08 0.01 0.00 0.50 0.00 0.00 46.19 43.46 2dmc s LEU 36 CO -0.07 -0.56 -0.08 -1.48 -1.32 0.00 0.00 176.35 172.85 2dmc s LEU 37 N 2.88 1.74 -0.65 -0.68 2.34 -1.23 -5.06 118.68 118.02 2dmc s LEU 37 Ca 0.32 -0.16 -0.26 0.00 0.06 0.00 0.00 54.13 54.09 2dmc s LEU 37 Cb -0.15 -0.49 0.04 0.00 -0.56 0.00 0.00 46.19 45.04 2dmc s LEU 37 CO 0.11 0.04 1.16 -1.81 -1.06 0.00 0.00 176.35 174.79 2dmc s ASP 38 N 0.27 6.28 -0.01 1.48 1.01 -1.26 -4.62 116.67 119.82 2dmc s ASP 38 Ca -0.04 -0.33 0.04 0.00 0.71 0.00 0.00 52.55 52.92 2dmc s ASP 38 Cb -0.09 -2.52 -0.01 0.00 1.01 0.00 0.00 42.92 41.31 2dmc s ASP 38 CO 0.00 -1.59 -0.12 0.27 0.21 0.00 0.00 175.17 173.95 2dmc s ILE 39 N 5.03 0.91 -0.00 0.77 -4.36 -1.26 -4.94 121.20 117.35 2dmc s ILE 39 Ca 0.35 -0.52 -0.04 0.00 -0.26 0.00 0.00 60.65 60.18 2dmc s ILE 39 Cb -0.10 -0.77 -0.19 0.00 1.25 0.00 0.00 42.46 42.65 2dmc s ILE 39 CO 0.18 0.24 3.16 -1.20 0.24 0.00 0.00 174.94 177.56 2dmc n SER 40 N 2.74 5.27 -3.76 4.36 7.64 -1.26 -4.73 113.62 123.88 2dmc n SER 40 Ca -0.14 -2.46 -0.26 0.00 1.01 0.00 0.00 58.87 57.02 2dmc n SER 40 Cb 0.56 -1.34 -0.17 0.00 -1.01 0.00 0.00 64.21 62.25 2dmc n SER 40 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 2dmc s GLU 41 N 0.71 0.68 -0.04 1.43 2.02 -1.26 -4.99 118.70 117.24 2dmc s GLU 41 Ca 0.48 -0.20 0.17 0.00 0.02 0.00 0.00 54.97 55.43 2dmc s GLU 41 Cb 0.23 -1.63 -0.21 0.00 0.10 0.00 0.00 34.13 32.62 2dmc s GLU 41 CO -0.00 -0.49 0.55 -2.37 0.02 0.00 0.00 175.26 172.97 2dmc n THR 42 N 5.08 1.22 -2.60 3.63 5.66 -1.26 -4.92 114.28 121.09 2dmc n THR 42 Ca -0.08 -0.74 -0.40 0.00 -3.05 0.00 0.00 64.05 59.78 2dmc n THR 42 Cb 0.48 -0.66 -0.05 0.00 -1.55 0.00 0.00 70.33 68.56 2dmc n THR 42 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 2dmc s ASP 43 N -5.64 7.35 -0.16 1.09 -1.08 -1.26 -4.99 116.67 111.99 2dmc s ASP 43 Ca -0.06 2.10 -0.15 0.00 -0.52 0.00 0.00 52.55 53.92 2dmc s ASP 43 Cb 0.08 -2.61 -0.06 0.00 -1.46 0.00 0.00 42.92 38.87 2dmc s ASP 43 CO 0.83 -0.07 -0.30 0.18 0.52 0.00 0.00 175.17 176.33 2dmc n LEU 44 N 1.12 1.81 -0.27 -1.34 4.32 -1.26 -4.30 117.00 117.07 2dmc n LEU 44 Ca -0.01 0.30 0.06 0.00 -0.02 0.00 0.00 56.01 56.34 2dmc n LEU 44 Cb 0.46 -0.69 0.20 0.00 -1.62 0.00 0.00 43.42 41.77 2dmc n LEU 44 CO 0.51 -0.22 1.06 0.28 -1.22 0.00 0.00 177.39 177.80 2dmc h SER 45 N -0.86 0.42 -0.04 -1.43 0.02 -1.96 0.30 113.55 109.99 2dmc h SER 45 Ca -0.09 0.09 0.01 0.00 -0.84 0.00 0.00 61.79 60.97 2dmc h SER 45 Cb 0.96 0.04 -0.00 0.00 0.14 0.00 0.00 62.40 63.53 2dmc h SER 45 CO -0.05 0.18 0.05 0.28 -1.14 0.00 0.00 176.83 176.15 2dmc h SER 46 N 0.55 0.00 -2.59 3.07 0.02 -1.96 -3.42 113.55 109.21 2dmc h SER 46 Ca 0.43 0.00 -0.44 0.00 -0.84 0.00 0.00 61.79 60.94 2dmc h SER 46 Cb 0.61 0.00 0.05 0.00 0.14 0.00 0.00 62.40 63.19 2dmc h SER 46 CO -0.37 0.00 -0.02 -0.76 -1.14 0.00 0.00 176.83 174.55 2dmc s LEU 47 N -7.75 3.24 0.15 5.07 1.43 0.11 -2.96 118.68 117.97 2dmc s LEU 47 Ca -0.05 0.01 0.11 0.00 -1.03 0.00 0.00 54.13 53.17 2dmc s LEU 47 Cb 0.15 -2.88 -0.04 0.00 0.03 0.00 0.00 46.19 43.45 2dmc s LEU 47 CO 0.55 -1.18 -0.24 -0.89 0.23 0.00 0.00 176.35 174.83 2dmc s THR 48 N -2.80 2.42 -0.17 5.49 2.01 0.30 -4.89 115.64 118.02 2dmc s THR 48 Ca 0.58 -1.79 0.00 0.00 0.31 0.00 0.00 61.69 60.79 2dmc s THR 48 Cb -0.10 -2.11 0.03 0.00 0.01 0.00 0.00 72.50 70.33 2dmc s THR 48 CO 0.39 0.03 -0.10 0.00 -0.69 0.00 0.00 174.62 174.25 2dmc s ALA 49 N -1.27 1.75 -0.15 7.40 0.00 -1.26 -3.88 121.76 124.35 2dmc s ALA 49 Ca 0.17 -0.95 -0.09 0.00 0.00 0.00 0.00 51.96 51.09 2dmc s ALA 49 Cb -0.09 -1.13 0.05 0.00 0.00 0.00 0.00 23.12 21.94 2dmc s ALA 49 CO 0.08 -0.64 0.37 -1.12 0.00 0.00 0.00 175.76 174.45 2dmc s SER 50 N 1.52 -0.44 0.03 0.00 0.01 -1.06 -4.89 113.70 108.87 2dmc s SER 50 Ca 0.02 0.78 -0.01 0.00 1.31 0.00 0.00 55.95 58.05 2dmc s SER 50 Cb -0.15 0.69 -0.02 0.00 0.21 0.00 0.00 66.02 66.75 2dmc s SER 50 CO -0.09 -0.18 -0.00 -0.63 0.41 0.00 0.00 173.24 172.75 2dmc s ILE 51 N 1.16 0.13 -0.29 1.44 1.01 -1.26 0.27 121.20 123.66 2dmc s ILE 51 Ca -0.08 -1.07 -0.10 0.00 0.00 0.00 0.00 60.65 59.40 2dmc s ILE 51 Cb -0.08 -0.57 0.12 0.00 0.01 0.00 0.00 42.46 41.95 2dmc s ILE 51 CO -0.10 -0.59 0.63 -0.75 0.00 0.00 0.00 174.94 174.13 2dmc s LYS 52 N -2.01 0.56 1.06 2.79 2.20 -1.25 -1.42 119.74 121.68 2dmc s LYS 52 Ca -0.11 1.38 -0.21 0.00 -0.36 0.00 0.00 55.97 56.68 2dmc s LYS 52 Cb -0.06 0.74 -0.01 0.00 -1.51 0.00 0.00 37.83 36.99 2dmc s LYS 52 CO -0.03 -0.20 -0.48 0.00 -0.36 0.00 0.00 175.35 174.29 2dmc n ALA 53 N 5.31 -4.61 0.37 3.13 0.00 0.98 -4.18 120.51 121.52 2dmc n ALA 53 Ca -0.13 -1.23 0.13 0.00 0.00 0.00 0.00 53.44 52.22 2dmc n ALA 53 Cb 0.50 -1.30 0.53 0.00 0.00 0.00 0.00 19.45 19.18 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 -1.64 0.00 -0.01 0.00 0.13 -1.89 -2.28 132.00 126.31 2dmc h PRO 54 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 2dmc h PRO 54 Cb 1.36 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.49 2dmc h PRO 54 CO 0.32 0.00 -0.05 0.45 -0.23 0.00 0.00 178.00 178.49 2dmc n SER 55 N -2.38 1.20 0.00 1.44 2.88 -1.26 -4.90 113.62 110.60 2dmc n SER 55 Ca 0.02 -1.29 0.00 0.00 -1.33 0.00 0.00 58.87 56.27 2dmc n SER 55 Cb 0.24 0.02 0.00 0.00 -0.75 0.00 0.00 64.21 63.71 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 0.73 3.40 0.46 0.00 -0.86 -5.05 105.19 105.06 2dmc n GLY 56 Ca 0.18 -0.53 -0.41 0.00 0.00 0.00 0.00 46.02 45.27 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 -1.05 2.95 0.97 1.61 1.81 -1.25 -4.89 118.95 119.10 2dmc s ARG 57 Ca 0.00 -1.00 -0.13 0.00 -1.72 0.00 0.00 55.73 52.88 2dmc s ARG 57 Cb 0.00 -3.74 0.07 0.00 -0.45 0.00 0.00 34.95 30.83 2dmc s ARG 57 CO 0.00 -0.65 0.51 -3.47 -0.68 0.00 0.00 175.30 171.00 2dmc n ASP 58 N 5.02 -1.71 -3.89 0.23 -0.08 -1.26 -0.01 116.55 114.84 2dmc n ASP 58 Ca -0.12 0.29 -0.11 0.00 -1.51 0.00 0.00 54.79 53.34 2dmc n ASP 58 Cb 0.47 -1.23 -0.12 0.00 2.34 0.00 0.00 41.12 42.57 2dmc n ASP 58 CO 0.00 0.00 0.00 -1.61 0.12 0.00 0.00 177.20 175.71 2dmc s GLU 59 N -3.80 0.18 -0.63 -0.67 0.41 -0.50 -4.67 118.70 109.01 2dmc s GLU 59 Ca 0.59 -0.17 -0.26 0.00 -0.41 0.00 0.00 54.97 54.71 2dmc s GLU 59 Cb -0.21 0.07 -0.02 0.00 -1.78 0.00 0.00 34.13 32.19 2dmc s GLU 59 CO 0.66 -0.03 1.87 -1.25 -0.49 0.00 0.00 175.26 176.01 2dmc s PRO 60 N -0.55 2.62 -0.09 0.39 0.04 -1.26 -4.26 135.00 131.88 2dmc s PRO 60 Ca -0.06 0.56 -0.01 0.00 0.04 0.00 0.00 61.00 61.52 2dmc s PRO 60 Cb -0.04 -4.43 -0.03 0.00 0.04 0.00 0.00 34.50 30.04 2dmc s PRO 60 CO -0.00 -2.78 -0.03 0.00 0.04 0.00 0.00 177.00 174.23 2dmc s LEU 62 N -0.60 0.52 0.01 0.00 1.98 0.15 -4.85 118.68 115.88 2dmc s LEU 62 Ca 0.09 -0.07 -0.29 0.00 -2.89 0.00 0.00 54.13 50.97 2dmc s LEU 62 Cb -0.12 -0.40 -0.03 0.00 0.66 0.00 0.00 46.19 46.30 2dmc s LEU 62 CO 0.02 -0.20 0.95 -0.76 -1.89 0.00 0.00 176.35 174.46 2dmc s LEU 63 N 2.00 4.38 0.17 -0.68 1.43 -1.26 -1.02 118.68 123.70 2dmc s LEU 63 Ca 0.05 1.63 0.00 0.00 -1.03 0.00 0.00 54.13 54.78 2dmc s LEU 63 Cb -0.12 -3.52 -0.04 0.00 0.03 0.00 0.00 46.19 42.53 2dmc s LEU 63 CO -0.05 -0.22 0.05 -1.59 0.23 0.00 0.00 176.35 174.78 2dmc s LYS 64 N 0.83 1.08 -0.09 1.70 -2.85 -1.08 -4.98 119.74 114.35 2dmc s LYS 64 Ca 0.50 -1.53 -0.16 0.00 -1.00 0.00 0.00 55.97 53.77 2dmc s LYS 64 Cb -0.21 0.03 -0.05 0.00 -2.06 0.00 0.00 37.83 35.54 2dmc s LYS 64 CO 0.27 -0.24 0.43 0.50 0.10 0.00 0.00 175.35 176.41 2dmc s ARG 65 N -4.02 4.19 0.15 1.78 6.06 -1.26 -3.23 118.95 122.63 2dmc s ARG 65 Ca 0.28 0.38 0.04 0.00 -2.50 0.00 0.00 55.73 53.93 2dmc s ARG 65 Cb 0.07 -3.36 -0.04 0.00 0.06 0.00 0.00 34.95 31.68 2dmc s ARG 65 CO 0.05 0.34 0.15 -0.51 -2.50 0.00 0.00 175.30 172.84 2dmc s LEU 66 N 0.04 3.88 1.08 -0.88 1.43 0.33 -4.92 118.68 119.66 2dmc s LEU 66 Ca 0.24 -0.08 -0.15 0.00 -1.03 0.00 0.00 54.13 53.11 2dmc s LEU 66 Cb -0.15 -2.49 0.23 0.00 0.03 0.00 0.00 46.19 43.81 2dmc s LEU 66 CO 0.10 0.08 1.10 -2.16 0.23 0.00 0.00 176.35 175.70 2dmc s PRO 67 N -3.05 -0.26 -1.25 1.29 0.04 -1.26 -2.71 135.00 127.79 2dmc s PRO 67 Ca 0.31 0.27 -0.07 0.00 0.04 0.00 0.00 61.00 61.55 2dmc s PRO 67 Cb -0.10 -1.68 0.01 0.00 0.04 0.00 0.00 34.50 32.77 2dmc s PRO 67 CO 0.24 -3.14 1.09 0.09 0.04 0.00 0.00 177.00 175.31 2dmc n ASN 68 N -4.42 -5.59 -3.89 6.66 4.13 -1.26 -2.61 115.26 108.28 2dmc n ASN 68 Ca 0.08 -0.51 -0.24 0.00 1.68 0.00 0.00 54.58 55.58 2dmc n ASN 68 Cb 0.58 -4.74 -0.01 0.00 -1.54 0.00 0.00 39.78 34.08 2dmc n ASN 68 CO 0.00 0.00 0.00 -3.20 0.28 0.00 0.00 177.26 174.34 2dmc n ASN 69 N -2.74 -0.51 -4.26 6.41 2.85 -1.26 -4.97 115.26 110.77 2dmc n ASN 69 Ca -0.03 -0.96 -0.14 0.00 -0.11 0.00 0.00 54.58 53.34 2dmc n ASN 69 Cb 0.57 -3.29 -0.10 0.00 1.24 0.00 0.00 39.78 38.20 2dmc n ASN 69 CO 0.00 0.00 0.00 -1.00 -2.11 0.00 0.00 177.26 174.15 2dmc s HIS 70 N -3.89 1.28 -0.04 1.20 0.09 -1.07 -5.07 115.29 107.78 2dmc s HIS 70 Ca 0.01 -0.92 -0.06 0.00 -0.00 0.00 0.00 55.06 54.09 2dmc s HIS 70 Cb -0.00 -0.71 0.01 0.00 -0.00 0.00 0.00 32.58 31.87 2dmc s HIS 70 CO 0.87 -0.08 0.15 0.42 -0.00 0.00 0.00 174.74 176.09 2dmc s ILE 71 N -3.51 0.02 0.24 0.60 1.01 -1.26 -0.51 121.20 117.79 2dmc s ILE 71 Ca 0.22 -0.16 -0.13 0.00 0.00 0.00 0.00 60.65 60.58 2dmc s ILE 71 Cb 0.05 -0.27 -0.00 0.00 0.01 0.00 0.00 42.46 42.25 2dmc s ILE 71 CO 0.03 -0.09 0.46 -0.83 0.00 0.00 0.00 174.94 174.52 2dmc s GLY 72 N -0.25 0.52 0.16 6.18 0.00 -1.20 -3.49 107.32 109.24 2dmc s GLY 72 Ca -0.03 -0.86 0.05 0.00 0.00 0.00 0.00 44.72 43.87 2dmc s GLY 72 CO 0.00 -0.63 0.14 -1.50 0.00 0.00 0.00 173.10 171.11 2dmc s ILE 73 N -4.01 4.55 -0.09 0.90 2.07 -1.09 -2.65 121.20 120.89 2dmc s ILE 73 Ca 0.22 -1.03 -0.00 0.00 -1.41 0.00 0.00 60.65 58.43 2dmc s ILE 73 Cb -0.00 -3.32 0.02 0.00 0.13 0.00 0.00 42.46 39.29 2dmc s ILE 73 CO 0.08 -0.09 -0.07 -0.55 -1.91 0.00 0.00 174.94 172.40 2dmc s SER 74 N -3.07 1.87 0.11 4.50 0.15 -0.19 -1.46 113.70 115.62 2dmc s SER 74 Ca 0.31 -0.24 -0.15 0.00 0.70 0.00 0.00 55.95 56.57 2dmc s SER 74 Cb -0.10 -0.72 0.03 0.00 -1.71 0.00 0.00 66.02 63.52 2dmc s SER 74 CO 0.24 -0.10 0.37 0.72 1.20 0.00 0.00 173.24 175.67 2dmc s PHE 75 N 1.50 -0.16 -0.50 3.44 -0.71 -1.13 0.29 117.98 120.71 2dmc s PHE 75 Ca 0.00 -0.15 -0.13 0.00 -1.04 0.00 0.00 56.93 55.60 2dmc s PHE 75 Cb -0.13 0.21 0.12 0.00 -1.21 0.00 0.00 43.02 42.00 2dmc s PHE 75 CO -0.05 -0.67 0.42 0.42 -1.34 0.00 0.00 175.22 174.01 2dmc s ILE 76 N -3.69 4.83 -0.04 -4.49 1.01 -1.20 -2.03 121.20 115.59 2dmc s ILE 76 Ca 0.02 -1.54 -0.30 0.00 0.00 0.00 0.00 60.65 58.84 2dmc s ILE 76 Cb 0.02 -4.09 -0.05 0.00 0.01 0.00 0.00 42.46 38.35 2dmc s ILE 76 CO -0.11 -0.78 1.48 -2.16 0.00 0.00 0.00 174.94 173.37 2dmc s PRO 77 N 1.52 4.23 -0.00 2.79 0.04 -1.26 -4.62 135.00 137.70 2dmc s PRO 77 Ca 0.04 2.02 0.11 0.00 0.04 0.00 0.00 61.00 63.21 2dmc s PRO 77 Cb -0.28 -3.75 -0.23 0.00 0.04 0.00 0.00 34.50 30.29 2dmc s PRO 77 CO 0.02 -0.70 0.81 -0.09 0.04 0.00 0.00 177.00 177.08 2dmc h ARG 78 N 8.52 0.00 -5.58 4.56 9.65 -1.94 -2.47 114.38 127.12 2dmc h ARG 78 Ca -0.37 -0.01 -0.64 0.00 -1.10 0.00 0.00 59.98 57.87 2dmc h ARG 78 Cb 1.17 0.00 -0.13 0.00 -1.39 0.00 0.00 29.97 29.62 2dmc h ARG 78 CO 0.93 0.63 -0.59 -2.00 2.80 0.00 0.00 179.97 181.75 2dmc s GLU 79 N -2.63 1.99 -0.00 0.20 2.12 -1.26 -4.84 118.70 114.29 2dmc s GLU 79 Ca -0.03 -2.15 0.06 0.00 0.36 0.00 0.00 54.97 53.20 2dmc s GLU 79 Cb 0.08 -1.61 -0.03 0.00 0.26 0.00 0.00 34.13 32.83 2dmc s GLU 79 CO 0.82 -0.10 -0.17 0.14 -0.54 0.00 0.00 175.26 175.42 2dmc s VAL 80 N -2.74 2.88 -1.42 3.70 -7.23 -1.26 -4.88 120.40 109.45 2dmc s VAL 80 Ca 0.30 -0.96 0.00 0.00 -1.81 0.00 0.00 61.98 59.51 2dmc s VAL 80 Cb 0.09 -2.16 0.00 0.00 0.56 0.00 0.00 36.38 34.86 2dmc s VAL 80 CO 0.16 0.47 0.00 0.61 -0.31 0.00 0.00 175.10 176.02 2dmc n GLY 81 N 1.94 0.24 3.32 2.32 0.00 0.11 -4.93 105.19 108.20 2dmc n GLY 81 Ca -0.16 -1.13 -0.43 0.00 0.00 0.00 0.00 46.02 44.30 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 2.82 0.12 1.61 2.12 -1.26 -0.46 118.70 121.65 2dmc s GLU 82 Ca 0.00 -1.47 -0.11 0.00 0.36 0.00 0.00 54.97 53.75 2dmc s GLU 82 Cb 0.00 -4.02 -0.06 0.00 0.26 0.00 0.00 34.13 30.30 2dmc s GLU 82 CO 0.00 -1.06 0.47 -1.01 -0.54 0.00 0.00 175.26 173.12 2dmc s HIS 83 N 1.54 3.57 -0.24 5.30 3.76 0.02 -4.40 115.29 124.83 2dmc s HIS 83 Ca 0.04 0.88 -0.02 0.00 -0.15 0.00 0.00 55.06 55.80 2dmc s HIS 83 Cb -0.25 -2.23 0.02 0.00 1.11 0.00 0.00 32.58 31.23 2dmc s HIS 83 CO 0.04 0.45 -0.06 -0.51 -0.85 0.00 0.00 174.74 173.82 2dmc s LEU 84 N -2.08 3.11 -0.38 0.89 1.43 -1.26 -1.42 118.68 118.97 2dmc s LEU 84 Ca 0.37 -0.76 -0.16 0.00 -1.03 0.00 0.00 54.13 52.55 2dmc s LEU 84 Cb -0.14 -1.68 0.00 0.00 0.03 0.00 0.00 46.19 44.41 2dmc s LEU 84 CO 0.19 -0.10 0.40 -0.69 0.23 0.00 0.00 176.35 176.38 2dmc s VAL 85 N 1.36 5.13 -0.54 -1.59 1.01 0.12 -3.82 120.40 122.08 2dmc s VAL 85 Ca 0.02 -0.15 -0.26 0.00 0.00 0.00 0.00 61.98 61.59 2dmc s VAL 85 Cb -0.16 -3.93 0.03 0.00 0.00 0.00 0.00 36.38 32.32 2dmc s VAL 85 CO -0.04 -0.26 1.02 -0.44 0.00 0.00 0.00 175.10 175.38 2dmc s SER 86 N 1.77 6.42 -0.24 3.32 0.01 0.14 -0.14 113.70 124.98 2dmc s SER 86 Ca 0.12 -0.09 0.01 0.00 1.31 0.00 0.00 55.95 57.30 2dmc s SER 86 Cb -0.17 -2.48 0.04 0.00 0.21 0.00 0.00 66.02 63.62 2dmc s SER 86 CO 0.13 -1.27 -0.12 -0.63 0.41 0.00 0.00 173.24 171.75 2dmc s ILE 87 N 4.24 2.36 0.33 1.44 -1.09 -1.26 -2.57 121.20 124.65 2dmc s ILE 87 Ca 0.36 -1.27 0.03 0.00 -2.23 0.00 0.00 60.65 57.55 2dmc s ILE 87 Cb -0.10 -2.22 -0.05 0.00 -1.58 0.00 0.00 42.46 38.51 2dmc s ILE 87 CO 0.23 0.19 0.10 -0.54 -1.23 0.00 0.00 174.94 173.69 2dmc s LYS 88 N 1.22 1.68 -0.27 2.79 1.02 -1.25 -1.41 119.74 123.52 2dmc s LYS 88 Ca -0.02 -1.96 0.01 0.00 0.02 0.00 0.00 55.97 54.01 2dmc s LYS 88 Cb -0.17 -0.57 0.08 0.00 -0.52 0.00 0.00 37.83 36.65 2dmc s LYS 88 CO -0.07 -0.33 0.01 0.21 -0.92 0.00 0.00 175.35 174.25 2dmc s LYS 89 N -3.86 1.28 -1.84 1.68 2.20 0.95 0.11 119.74 120.25 2dmc s LYS 89 Ca 0.33 -1.15 0.00 0.00 -0.36 0.00 0.00 55.97 54.79 2dmc s LYS 89 Cb 0.06 -2.52 0.00 0.00 -1.51 0.00 0.00 37.83 33.87 2dmc s LYS 89 CO 0.15 -0.78 0.00 0.09 -0.36 0.00 0.00 175.35 174.46 2dmc n ASN 90 N 4.66 -5.79 0.00 1.43 3.02 -1.15 -1.68 115.26 115.75 2dmc n ASN 90 Ca -0.06 0.08 0.00 0.00 -0.03 0.00 0.00 54.58 54.57 2dmc n ASN 90 Cb 0.43 -4.86 0.00 0.00 -0.61 0.00 0.00 39.78 34.74 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 -0.91 0.88 2.78 7.41 0.00 -1.26 -5.06 105.19 109.02 2dmc n GLY 91 Ca -0.24 -0.17 -0.30 0.00 0.00 0.00 0.00 46.02 45.32 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 -2.15 3.90 0.30 1.61 0.01 -0.67 -5.10 114.94 112.84 2dmc s ASN 92 Ca 0.00 -1.51 -0.22 0.00 -0.71 0.00 0.00 52.86 50.42 2dmc s ASN 92 Cb 0.00 -0.92 -0.15 0.00 0.41 0.00 0.00 41.25 40.59 2dmc s ASN 92 CO 0.00 -0.38 0.25 1.41 -1.51 0.00 0.00 177.10 176.87 2dmc n HIS 93 N 4.81 -1.33 -3.29 2.20 8.25 -1.26 -0.03 115.22 124.56 2dmc n HIS 93 Ca -0.04 0.72 -0.19 0.00 -0.26 0.00 0.00 57.72 57.95 2dmc n HIS 93 Cb 0.43 -1.73 0.04 0.00 1.12 0.00 0.00 29.99 29.85 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 -0.55 0.00 -2.33 1.59 0.24 -0.50 -4.66 118.33 112.12 2dmc n VAL 94 Ca 0.13 -1.74 -0.37 0.00 -2.04 0.00 0.00 64.34 60.32 2dmc n VAL 94 Cb 0.31 -0.43 -0.02 0.00 -1.47 0.00 0.00 33.84 32.24 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 -2.63 2.97 -1.64 2.33 0.00 -1.26 -3.06 121.76 118.47 2dmc s ALA 95 Ca 0.45 0.87 0.00 0.00 0.00 0.00 0.00 51.96 53.27 2dmc s ALA 95 Cb -0.04 -3.35 0.00 0.00 0.00 0.00 0.00 23.12 19.73 2dmc s ALA 95 CO 0.28 -0.56 0.00 0.09 0.00 0.00 0.00 175.76 175.57 2dmc n ASN 96 N -0.49 -5.27 -4.15 0.00 3.02 -1.26 -4.90 115.26 102.21 2dmc n ASN 96 Ca 0.07 0.09 -0.21 0.00 -0.03 0.00 0.00 54.58 54.50 2dmc n ASN 96 Cb 0.49 -4.34 -0.14 0.00 -0.61 0.00 0.00 39.78 35.18 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 -2.32 1.79 0.43 6.41 0.15 -1.17 -3.06 113.70 115.93 2dmc s SER 97 Ca 0.00 -0.42 -0.24 0.00 0.70 0.00 0.00 55.95 55.99 2dmc s SER 97 Cb 0.00 -0.14 -0.08 0.00 -1.71 0.00 0.00 66.02 64.09 2dmc s SER 97 CO 0.00 0.09 1.17 -2.16 1.20 0.00 0.00 173.24 173.54 2dmc s PRO 98 N -0.94 3.89 -0.09 5.44 0.04 -1.26 -4.81 135.00 137.27 2dmc s PRO 98 Ca 0.03 1.82 -0.30 0.00 0.04 0.00 0.00 61.00 62.60 2dmc s PRO 98 Cb -0.07 -2.53 -0.02 0.00 0.04 0.00 0.00 34.50 31.91 2dmc s PRO 98 CO 0.01 -0.46 1.12 0.08 0.04 0.00 0.00 177.00 177.79 2dmc s VAL 99 N -1.48 4.48 -0.04 -0.36 1.01 0.81 -4.72 120.40 120.10 2dmc s VAL 99 Ca 0.61 1.78 -0.22 0.00 0.00 0.00 0.00 61.98 64.15 2dmc s VAL 99 Cb -0.30 -4.15 -0.04 0.00 0.00 0.00 0.00 36.38 31.89 2dmc s VAL 99 CO 0.37 -0.01 0.66 -0.94 0.00 0.00 0.00 175.10 175.18 2dmc s SER 100 N 1.33 6.98 0.05 3.32 1.04 -1.26 -0.70 113.70 124.46 2dmc s SER 100 Ca 0.52 1.17 0.06 0.00 0.48 0.00 0.00 55.95 58.18 2dmc s SER 100 Cb -0.22 -2.39 -0.02 0.00 0.10 0.00 0.00 66.02 63.49 2dmc s SER 100 CO 0.19 -0.03 -0.16 -0.63 0.98 0.00 0.00 173.24 173.59 2dmc s ILE 101 N 0.43 1.29 -0.23 -1.02 1.01 -0.51 -4.99 121.20 117.18 2dmc s ILE 101 Ca 0.35 -1.13 -0.04 0.00 0.00 0.00 0.00 60.65 59.83 2dmc s ILE 101 Cb -0.18 -1.16 -0.00 0.00 0.01 0.00 0.00 42.46 41.12 2dmc s ILE 101 CO 0.18 0.02 -0.02 -0.32 0.00 0.00 0.00 174.94 174.79 2dmc s MET 102 N -1.28 3.32 -0.13 2.79 1.75 -1.26 -0.80 119.30 123.68 2dmc s MET 102 Ca 0.03 -0.67 -0.01 0.00 -1.25 0.00 0.00 55.69 53.78 2dmc s MET 102 Cb -0.08 -3.08 -0.02 0.00 2.84 0.00 0.00 34.83 34.48 2dmc s MET 102 CO 0.02 -0.25 -0.08 0.08 -0.65 0.00 0.00 175.02 174.14 2dmc s VAL 103 N 1.48 3.48 0.01 10.11 1.01 0.39 -4.30 120.40 132.59 2dmc s VAL 103 Ca 0.05 -0.51 0.02 0.00 0.00 0.00 0.00 61.98 61.53 2dmc s VAL 103 Cb -0.15 -2.49 -0.01 0.00 0.00 0.00 0.00 36.38 33.73 2dmc s VAL 103 CO -0.02 0.52 -0.06 0.68 0.00 0.00 0.00 175.10 176.22 2dmc s VAL 104 N 0.21 0.41 -0.94 2.92 -7.23 -1.26 0.05 120.40 114.55 2dmc s VAL 104 Ca -0.05 -0.52 -0.25 0.00 -1.81 0.00 0.00 61.98 59.36 2dmc s VAL 104 Cb -0.15 -0.40 -0.09 0.00 0.56 0.00 0.00 36.38 36.31 2dmc s VAL 104 CO 0.04 -0.08 2.05 -1.10 -0.31 0.00 0.00 175.10 175.70 2dmc s GLN 105 N -0.65 2.24 -1.01 4.82 -0.21 -1.26 -4.23 119.66 119.36 2dmc s GLN 105 Ca -0.03 -0.29 -0.15 0.00 0.02 0.00 0.00 55.36 54.91 2dmc s GLN 105 Cb -0.05 -5.03 0.19 0.00 1.00 0.00 0.00 33.01 29.12 2dmc s GLN 105 CO -0.00 -3.87 1.12 -1.54 -2.12 0.00 0.00 175.29 168.88 2dmc s SER 106 N 8.40 6.91 -0.30 5.90 1.04 -1.25 -5.00 113.70 129.39 2dmc s SER 106 Ca 0.75 -2.73 -0.14 0.00 0.48 0.00 0.00 55.95 54.31 2dmc s SER 106 Cb -0.07 -2.32 -0.03 0.00 0.10 0.00 0.00 66.02 63.70 2dmc s SER 106 CO 0.05 -0.72 0.32 -0.70 0.98 0.00 0.00 173.24 173.16 2dmc s GLU 107 N 1.07 3.80 -0.19 4.02 2.56 -1.26 -4.88 118.70 123.82 2dmc s GLU 107 Ca 0.31 -0.26 -0.17 0.00 0.00 0.00 0.00 54.97 54.86 2dmc s GLU 107 Cb -0.06 -3.72 -0.13 0.00 2.00 0.00 0.00 34.13 32.22 2dmc s GLU 107 CO -0.07 -0.36 -0.01 -0.89 -0.56 0.00 0.00 175.26 173.38 2dmc n ILE 108 N 5.15 1.50 0.00 -3.70 5.41 -1.26 -5.04 119.36 121.42 2dmc n ILE 108 Ca -0.10 0.02 0.00 0.00 1.00 0.00 0.00 62.75 63.66 2dmc n ILE 108 Cb 0.50 -2.15 0.00 0.00 -0.71 0.00 0.00 39.64 37.29 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 1.47 0.02 3.62 7.39 0.00 -1.26 -5.10 105.19 111.32 2dmc n GLY 109 Ca -0.26 -0.04 -0.43 0.00 0.00 0.00 0.00 46.02 45.29 2dmc n GLY 109 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2dmc s ASP 110 N 0.00 6.19 -0.27 1.61 -1.08 -1.26 -4.97 116.67 116.90 2dmc s ASP 110 Ca 0.00 1.51 0.02 0.00 -0.52 0.00 0.00 52.55 53.57 2dmc s ASP 110 Cb 0.00 -2.53 0.07 0.00 -1.46 0.00 0.00 42.92 39.00 2dmc s ASP 110 CO 0.00 -1.43 -0.06 -0.55 0.52 0.00 0.00 175.17 173.65 2dmc s SER 111 N 4.95 4.30 0.22 -0.34 0.15 -1.26 -5.10 113.70 116.62 2dmc s SER 111 Ca 0.75 -1.45 -0.16 0.00 0.70 0.00 0.00 55.95 55.79 2dmc s SER 111 Cb -0.24 -1.42 0.02 0.00 -1.71 0.00 0.00 66.02 62.66 2dmc s SER 111 CO 0.31 -0.24 0.53 -0.83 1.20 0.00 0.00 173.24 174.21 2dmc s GLY 112 N 1.18 0.10 0.76 9.45 0.00 -1.26 -5.17 107.32 112.39 2dmc s GLY 112 Ca -0.04 -0.44 -0.11 0.00 0.00 0.00 0.00 44.72 44.13 2dmc s GLY 112 CO -0.06 -0.36 1.09 2.56 0.00 0.00 0.00 173.10 176.33 2dmc s PRO 113 N -3.92 2.29 -0.07 2.90 0.04 -1.26 -4.97 135.00 130.01 2dmc s PRO 113 Ca 0.13 1.19 0.16 0.00 0.04 0.00 0.00 61.00 62.53 2dmc s PRO 113 Cb -0.01 -1.90 0.55 0.00 0.04 0.00 0.00 34.50 33.18 2dmc s PRO 113 CO 0.02 -1.62 1.47 -1.13 0.04 0.00 0.00 177.00 175.78 2dmc n SER 114 N -3.43 3.94 -3.15 6.66 3.41 -1.26 -4.85 113.62 114.94 2dmc n SER 114 Ca 0.09 -2.34 0.05 0.00 -0.26 0.00 0.00 58.87 56.41 2dmc n SER 114 Cb 0.53 -0.45 -0.01 0.00 -0.26 0.00 0.00 64.21 64.02 2dmc n SER 114 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2dmc s SER 115 N -1.12 -0.89 0.00 4.04 0.15 -1.26 -5.14 113.70 109.48 2dmc s SER 115 Ca 0.41 0.41 0.29 0.00 0.70 0.00 0.00 55.95 57.76 2dmc s SER 115 Cb 0.26 1.68 1.75 0.00 -1.71 0.00 0.00 66.02 68.00 2dmc s SER 115 CO 0.21 -0.16 2.08 0.61 1.20 0.00 0.00 173.24 177.17