#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 5.15 0.12 1.61 1.04 -1.26 -5.02 113.70 115.35 2dmc s SER 2 Ca 0.00 0.03 -0.19 0.00 0.48 0.00 0.00 55.95 56.27 2dmc s SER 2 Cb 0.00 -1.67 -0.06 0.00 0.10 0.00 0.00 66.02 64.39 2dmc s SER 2 CO 0.00 0.27 1.76 -1.28 0.98 0.00 0.00 173.24 174.97 2dmc h SER 3 N 6.00 0.28 0.00 7.02 0.87 -2.08 -3.48 113.55 122.16 2dmc h SER 3 Ca -0.41 -0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.12 2dmc h SER 3 Cb 1.19 -0.07 0.00 0.00 -0.44 0.00 0.00 62.40 63.08 2dmc h SER 3 CO 0.60 0.23 0.00 0.61 -0.53 0.00 0.00 176.83 177.74 2dmc n GLY 4 N -1.09 0.76 3.15 5.77 0.00 -1.26 -5.07 105.19 107.44 2dmc n GLY 4 Ca -0.03 -0.68 -0.38 0.00 0.00 0.00 0.00 46.02 44.94 2dmc n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dmc s SER 5 N -0.75 6.08 0.09 1.61 0.01 -1.26 -5.02 113.70 114.46 2dmc s SER 5 Ca 0.00 -3.51 -0.14 0.00 1.31 0.00 0.00 55.95 53.61 2dmc s SER 5 Cb 0.00 -1.95 0.02 0.00 0.21 0.00 0.00 66.02 64.30 2dmc s SER 5 CO 0.00 -0.25 0.34 -0.55 0.41 0.00 0.00 173.24 173.19 2dmc s SER 6 N 0.30 -0.15 -0.03 2.44 0.15 -1.26 -4.09 113.70 111.06 2dmc s SER 6 Ca 0.26 -0.31 -0.21 0.00 0.70 0.00 0.00 55.95 56.38 2dmc s SER 6 Cb -0.10 0.42 0.07 0.00 -1.71 0.00 0.00 66.02 64.70 2dmc s SER 6 CO -0.10 -0.75 0.94 0.61 1.20 0.00 0.00 173.24 175.13 2dmc n GLY 7 N 0.07 0.29 3.45 9.45 0.00 -1.26 -4.65 105.19 112.55 2dmc n GLY 7 Ca -0.17 -0.98 -0.44 0.00 0.00 0.00 0.00 46.02 44.43 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 -0.68 1.75 -2.12 -0.61 -6.64 -1.26 -4.82 119.36 104.98 2dmc n ILE 8 Ca 0.04 -0.50 -0.43 0.00 -1.77 0.00 0.00 62.75 60.09 2dmc n ILE 8 Cb 0.42 -0.42 -0.03 0.00 -1.44 0.00 0.00 39.64 38.17 2dmc n ILE 8 CO 0.00 0.00 0.00 -2.16 -1.77 0.00 0.00 176.55 172.62 2dmc s PRO 9 N -1.33 3.95 0.00 6.28 0.04 -1.26 -4.75 135.00 137.92 2dmc s PRO 9 Ca 0.62 1.80 0.00 0.00 0.04 0.00 0.00 61.00 63.46 2dmc s PRO 9 Cb -0.73 -3.99 0.00 0.00 0.04 0.00 0.00 34.50 29.82 2dmc s PRO 9 CO 0.58 -1.10 0.00 0.41 0.04 0.00 0.00 177.00 176.93 2dmc n GLY 10 N 4.39 -0.87 3.55 0.56 0.00 -1.26 -5.17 105.19 106.39 2dmc n GLY 10 Ca 0.18 0.22 -0.16 0.00 0.00 0.00 0.00 46.02 46.26 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 -0.28 -0.60 0.51 1.61 1.04 -1.26 -5.04 113.70 109.69 2dmc s SER 11 Ca 0.00 0.75 0.30 0.00 0.48 0.00 0.00 55.95 57.48 2dmc s SER 11 Cb 0.00 0.62 1.25 0.00 0.10 0.00 0.00 66.02 67.99 2dmc s SER 11 CO 0.00 -0.49 1.95 1.55 0.98 0.00 0.00 173.24 177.23 2dmc h PRO 12 N 3.20 0.00 -5.12 4.02 0.13 -2.00 -3.44 132.00 128.80 2dmc h PRO 12 Ca -0.25 0.00 -0.46 0.00 -0.87 0.00 0.00 66.00 64.42 2dmc h PRO 12 Cb 1.15 0.00 -0.29 0.00 0.13 0.00 0.00 31.00 31.99 2dmc h PRO 12 CO 0.32 0.09 -0.80 -0.06 -0.23 0.00 0.00 178.00 177.32 2dmc s PHE 13 N -3.73 1.13 -0.19 1.56 0.08 -1.26 -4.81 117.98 110.76 2dmc s PHE 13 Ca 0.00 -0.22 -0.17 0.00 0.12 0.00 0.00 56.93 56.67 2dmc s PHE 13 Cb 0.10 -0.73 -0.20 0.00 -0.57 0.00 0.00 43.02 41.61 2dmc s PHE 13 CO 0.58 -0.02 0.21 0.25 -0.10 0.00 0.00 175.22 176.13 2dmc n THR 14 N 2.78 1.60 -3.49 0.64 -2.24 -1.26 -4.98 114.28 107.33 2dmc n THR 14 Ca -0.14 -0.22 0.01 0.00 -2.27 0.00 0.00 64.05 61.43 2dmc n THR 14 Cb 0.56 -1.95 -0.04 0.00 -2.10 0.00 0.00 70.33 66.80 2dmc n THR 14 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2dmc s ALA 15 N -2.42 -2.48 -0.16 6.98 0.00 -1.26 -5.16 121.76 117.26 2dmc s ALA 15 Ca -0.28 2.15 -0.09 0.00 0.00 0.00 0.00 51.96 53.74 2dmc s ALA 15 Cb 0.07 -1.95 -0.05 0.00 0.00 0.00 0.00 23.12 21.19 2dmc s ALA 15 CO 0.63 -0.92 0.15 0.21 0.00 0.00 0.00 175.76 175.83 2dmc s LYS 16 N 2.55 3.88 -0.16 0.00 2.20 -1.26 -4.98 119.74 121.97 2dmc s LYS 16 Ca -0.04 -0.14 0.03 0.00 -0.36 0.00 0.00 55.97 55.46 2dmc s LYS 16 Cb -0.08 -3.32 -0.12 0.00 -1.51 0.00 0.00 37.83 32.81 2dmc s LYS 16 CO -0.18 0.50 -0.11 -0.89 -0.36 0.00 0.00 175.35 174.32 2dmc n ILE 17 N 2.84 0.92 -3.68 5.43 -0.00 -1.26 -4.99 119.36 118.62 2dmc n ILE 17 Ca -0.17 -0.39 -0.14 0.00 -0.00 0.00 0.00 62.75 62.04 2dmc n ILE 17 Cb 0.53 -1.00 -0.14 0.00 -0.00 0.00 0.00 39.64 39.03 2dmc n ILE 17 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.55 176.97 2dmc s THR 18 N -2.32 -0.27 -0.08 1.39 -4.23 -1.26 -5.11 115.64 103.76 2dmc s THR 18 Ca -0.19 0.28 -0.29 0.00 -1.18 0.00 0.00 61.69 60.31 2dmc s THR 18 Cb 0.05 -0.36 -0.07 0.00 1.34 0.00 0.00 72.50 73.46 2dmc s THR 18 CO 0.40 0.12 2.09 0.47 -0.54 0.00 0.00 174.62 177.16 2dmc n ASP 19 N 5.06 3.76 -4.04 3.99 9.92 -1.26 -4.91 116.55 129.06 2dmc n ASP 19 Ca -0.11 0.58 -0.36 0.00 -0.53 0.00 0.00 54.79 54.37 2dmc n ASP 19 Cb 0.50 -1.54 0.05 0.00 -0.64 0.00 0.00 41.12 39.49 2dmc n ASP 19 CO 0.00 0.00 0.00 0.47 0.13 0.00 0.00 177.20 177.80 2dmc n ASP 20 N 9.46 -5.19 -2.22 -2.24 8.00 -1.26 -4.89 116.55 118.21 2dmc n ASP 20 Ca 0.25 0.16 -0.29 0.00 0.71 0.00 0.00 54.79 55.62 2dmc n ASP 20 Cb 0.43 -0.77 0.04 0.00 -0.02 0.00 0.00 41.12 40.80 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 2.96 5.98 -5.01 -2.24 7.64 -1.26 -5.02 113.62 116.67 2dmc n SER 21 Ca -0.01 -3.77 -0.18 0.00 1.01 0.00 0.00 58.87 55.92 2dmc n SER 21 Cb 0.59 -0.61 0.03 0.00 -1.01 0.00 0.00 64.21 63.21 2dmc n SER 21 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2dmc s ARG 22 N -3.70 2.64 -0.27 1.43 1.70 -1.26 -5.07 118.95 114.42 2dmc s ARG 22 Ca 0.55 -1.36 -0.13 0.00 -0.47 0.00 0.00 55.73 54.32 2dmc s ARG 22 Cb 0.44 -2.71 -0.11 0.00 -0.57 0.00 0.00 34.95 32.00 2dmc s ARG 22 CO -0.03 -0.49 -0.34 0.54 -1.08 0.00 0.00 175.30 173.90 2dmc n ARG 23 N -2.00 0.56 -1.50 3.89 1.74 -1.26 -4.95 116.66 113.14 2dmc n ARG 23 Ca 0.11 0.25 -0.63 0.00 -0.77 0.00 0.00 57.85 56.80 2dmc n ARG 23 Cb 0.60 -1.44 -0.11 0.00 -1.02 0.00 0.00 32.46 30.49 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 4.58 6.19 0.25 0.00 0.01 -1.26 -5.04 113.70 118.44 2dmc s SER 25 Ca 1.12 -1.30 -0.30 0.00 1.31 0.00 0.00 55.95 56.78 2dmc s SER 25 Cb -1.47 -2.29 -0.10 0.00 0.21 0.00 0.00 66.02 62.37 2dmc s SER 25 CO 0.73 -1.02 1.48 -1.58 0.41 0.00 0.00 173.24 173.26 2dmc s GLN 26 N 2.57 4.23 0.20 12.44 0.74 -1.26 -4.68 119.66 133.90 2dmc s GLN 26 Ca 0.12 2.36 0.05 0.00 0.05 0.00 0.00 55.36 57.94 2dmc s GLN 26 Cb -0.23 -3.09 -0.05 0.00 1.10 0.00 0.00 33.01 30.74 2dmc s GLN 26 CO 0.08 -0.47 -0.07 0.08 -0.55 0.00 0.00 175.29 174.36 2dmc s VAL 27 N 0.06 1.28 -0.49 1.34 1.01 -1.26 -5.03 120.40 117.31 2dmc s VAL 27 Ca 0.61 -2.09 -0.18 0.00 0.00 0.00 0.00 61.98 60.32 2dmc s VAL 27 Cb -0.43 -2.14 0.06 0.00 0.00 0.00 0.00 36.38 33.87 2dmc s VAL 27 CO 0.44 -0.51 0.53 -0.54 0.00 0.00 0.00 175.10 175.02 2dmc s LYS 28 N -3.77 3.08 0.36 2.72 -0.14 -1.26 -4.58 119.74 116.15 2dmc s LYS 28 Ca 0.24 -1.02 -0.28 0.00 -1.36 0.00 0.00 55.97 53.54 2dmc s LYS 28 Cb 0.03 -4.09 -0.11 0.00 -1.68 0.00 0.00 37.83 31.98 2dmc s LYS 28 CO 0.06 -1.12 1.47 -0.11 -0.76 0.00 0.00 175.35 174.89 2dmc n LEU 29 N 5.80 4.54 -0.72 3.17 7.94 -1.26 -1.99 117.00 134.47 2dmc n LEU 29 Ca -0.08 1.22 -0.09 0.00 -1.11 0.00 0.00 56.01 55.94 2dmc n LEU 29 Cb 0.45 -1.60 -0.03 0.00 0.53 0.00 0.00 43.42 42.77 2dmc n LEU 29 CO 0.51 0.06 -0.09 0.61 -1.11 0.00 0.00 177.39 177.37 2dmc n GLY 30 N 0.71 0.89 3.10 -3.96 0.00 0.51 -5.00 105.19 101.44 2dmc n GLY 30 Ca 0.03 -0.62 -0.12 0.00 0.00 0.00 0.00 46.02 45.30 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 -2.86 -0.21 0.16 1.61 0.01 -0.84 -5.01 113.70 106.56 2dmc s SER 31 Ca 0.00 0.63 -0.34 0.00 1.31 0.00 0.00 55.95 57.55 2dmc s SER 31 Cb 0.00 0.58 -0.14 0.00 0.21 0.00 0.00 66.02 66.66 2dmc s SER 31 CO 0.00 -0.19 1.51 0.00 0.41 0.00 0.00 173.24 174.98 2dmc n ALA 32 N 4.49 0.96 -2.96 1.44 0.00 -1.26 -4.55 120.51 118.62 2dmc n ALA 32 Ca -0.21 0.45 -0.10 0.00 0.00 0.00 0.00 53.44 53.59 2dmc n ALA 32 Cb 0.53 -2.30 -0.12 0.00 0.00 0.00 0.00 19.45 17.56 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 0.71 0.05 0.44 0.00 0.00 -1.10 -5.01 121.76 116.85 2dmc s ALA 33 Ca 0.78 -0.40 -0.19 0.00 0.00 0.00 0.00 51.96 52.15 2dmc s ALA 33 Cb -0.72 0.10 -0.10 0.00 0.00 0.00 0.00 23.12 22.40 2dmc s ALA 33 CO 0.41 -0.12 0.94 0.34 0.00 0.00 0.00 175.76 177.33 2dmc s ASP 34 N -1.07 6.85 -0.17 0.00 2.15 -1.26 -3.63 116.67 119.55 2dmc s ASP 34 Ca -0.12 1.63 -0.03 0.00 0.43 0.00 0.00 52.55 54.46 2dmc s ASP 34 Cb -0.07 -2.52 0.05 0.00 -0.30 0.00 0.00 42.92 40.08 2dmc s ASP 34 CO -0.01 -0.40 0.04 -0.36 -0.17 0.00 0.00 175.17 174.27 2dmc s PHE 35 N -2.26 0.84 -0.18 -5.34 0.40 -0.59 -4.97 117.98 105.88 2dmc s PHE 35 Ca 0.61 -0.64 -0.21 0.00 -0.60 0.00 0.00 56.93 56.08 2dmc s PHE 35 Cb -0.09 -0.94 -0.03 0.00 0.51 0.00 0.00 43.02 42.47 2dmc s PHE 35 CO 0.17 -0.54 0.64 -1.17 0.70 0.00 0.00 175.22 175.02 2dmc s LEU 36 N 1.92 4.17 -0.01 -0.37 2.96 -1.26 -1.52 118.68 124.56 2dmc s LEU 36 Ca 0.01 0.89 0.03 0.00 -0.22 0.00 0.00 54.13 54.84 2dmc s LEU 36 Cb -0.16 -2.92 -0.00 0.00 0.50 0.00 0.00 46.19 43.61 2dmc s LEU 36 CO -0.08 -0.25 -0.10 -1.48 -1.32 0.00 0.00 176.35 173.12 2dmc s LEU 37 N 1.74 1.95 -0.75 -0.68 2.34 -1.26 -5.04 118.68 116.98 2dmc s LEU 37 Ca 0.30 -0.19 -0.26 0.00 0.06 0.00 0.00 54.13 54.03 2dmc s LEU 37 Cb -0.16 -0.56 0.03 0.00 -0.56 0.00 0.00 46.19 44.95 2dmc s LEU 37 CO 0.11 0.11 1.26 -1.81 -1.06 0.00 0.00 176.35 174.97 2dmc s ASP 38 N -0.12 6.18 -0.03 1.48 1.01 -1.26 -4.85 116.67 119.09 2dmc s ASP 38 Ca 0.02 -0.56 0.05 0.00 0.71 0.00 0.00 52.55 52.77 2dmc s ASP 38 Cb -0.05 -2.55 -0.01 0.00 1.01 0.00 0.00 42.92 41.32 2dmc s ASP 38 CO -0.00 -1.79 -0.18 0.27 0.21 0.00 0.00 175.17 173.68 2dmc s ILE 39 N 5.55 1.47 -0.13 0.77 -4.36 -1.26 -4.91 121.20 118.33 2dmc s ILE 39 Ca 0.35 -0.77 -0.00 0.00 -0.26 0.00 0.00 60.65 59.96 2dmc s ILE 39 Cb -0.08 -1.24 0.11 0.00 1.25 0.00 0.00 42.46 42.49 2dmc s ILE 39 CO 0.13 0.42 1.83 -0.24 0.24 0.00 0.00 174.94 177.32 2dmc n SER 40 N 2.86 5.25 -3.87 4.36 2.88 -1.26 -4.77 113.62 119.07 2dmc n SER 40 Ca -0.16 -2.62 -0.23 0.00 -1.33 0.00 0.00 58.87 54.53 2dmc n SER 40 Cb 0.53 -0.98 -0.17 0.00 -0.75 0.00 0.00 64.21 62.84 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 -0.78 1.01 -0.07 -1.46 0.41 -1.26 -5.05 118.70 111.49 2dmc s GLU 41 Ca 0.13 -0.10 -0.05 0.00 -0.41 0.00 0.00 54.97 54.55 2dmc s GLU 41 Cb 0.11 -1.12 -0.02 0.00 -1.78 0.00 0.00 34.13 31.32 2dmc s GLU 41 CO 0.00 -0.19 -0.09 0.25 -0.49 0.00 0.00 175.26 174.74 2dmc n THR 42 N 4.61 0.72 -1.23 3.63 -2.24 -1.26 -4.93 114.28 113.58 2dmc n THR 42 Ca -0.16 0.36 -0.48 0.00 -2.27 0.00 0.00 64.05 61.50 2dmc n THR 42 Cb 0.50 -1.96 -0.07 0.00 -2.10 0.00 0.00 70.33 66.71 2dmc n THR 42 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2dmc n ASP 43 N -3.46 0.37 -0.05 3.42 9.92 -1.26 -4.88 116.55 120.61 2dmc n ASP 43 Ca -0.04 0.90 -0.01 0.00 -0.53 0.00 0.00 54.79 55.11 2dmc n ASP 43 Cb 0.13 -0.70 -0.00 0.00 -0.64 0.00 0.00 41.12 39.91 2dmc n ASP 43 CO 0.00 0.00 0.00 -0.07 0.13 0.00 0.00 177.20 177.26 2dmc h LEU 44 N 2.94 0.00 -0.77 0.64 3.38 -1.92 -3.31 115.31 116.26 2dmc h LEU 44 Ca -0.37 0.00 0.12 0.00 0.09 0.00 0.00 57.88 57.72 2dmc h LEU 44 Cb 1.08 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 41.75 2dmc h LEU 44 CO 0.60 0.53 0.38 -1.28 0.09 0.00 0.00 178.44 178.76 2dmc h SER 45 N -0.89 0.47 -0.15 -0.43 0.87 -1.96 0.21 113.55 111.67 2dmc h SER 45 Ca 0.00 0.08 0.04 0.00 -1.23 0.00 0.00 61.79 60.68 2dmc h SER 45 Cb 0.17 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.12 2dmc h SER 45 CO 0.00 0.23 0.24 0.28 -0.53 0.00 0.00 176.83 177.05 2dmc h SER 46 N 0.60 0.00 -1.70 6.23 0.02 -1.96 -3.42 113.55 113.32 2dmc h SER 46 Ca 0.40 0.00 -0.43 0.00 -0.84 0.00 0.00 61.79 60.92 2dmc h SER 46 Cb 0.50 0.00 0.01 0.00 0.14 0.00 0.00 62.40 63.05 2dmc h SER 46 CO -0.32 0.00 -0.31 -0.76 -1.14 0.00 0.00 176.83 174.30 2dmc s LEU 47 N -6.98 3.86 0.22 5.07 1.43 0.73 -2.16 118.68 120.85 2dmc s LEU 47 Ca -0.04 -0.26 0.08 0.00 -1.03 0.00 0.00 54.13 52.88 2dmc s LEU 47 Cb 0.14 -2.73 -0.05 0.00 0.03 0.00 0.00 46.19 43.58 2dmc s LEU 47 CO 0.47 -0.55 -0.14 -0.89 0.23 0.00 0.00 176.35 175.47 2dmc s THR 48 N -2.24 1.77 -0.05 5.49 2.01 0.17 -4.87 115.64 117.92 2dmc s THR 48 Ca 0.48 -2.21 -0.00 0.00 0.31 0.00 0.00 61.69 60.27 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 0.32 -0.55 -0.01 0.00 -0.69 0.00 0.00 174.62 173.69 2dmc s ALA 49 N -2.95 0.61 -0.14 7.40 0.00 -1.26 -3.87 121.76 121.55 2dmc s ALA 49 Ca 0.24 -0.04 -0.10 0.00 0.00 0.00 0.00 51.96 52.05 2dmc s ALA 49 Cb -0.00 -0.57 0.05 0.00 0.00 0.00 0.00 23.12 22.60 2dmc s ALA 49 CO 0.08 -0.25 0.37 -1.12 0.00 0.00 0.00 175.76 174.83 2dmc s SER 50 N 1.48 -0.41 -0.04 0.00 0.01 -1.08 -4.85 113.70 108.81 2dmc s SER 50 Ca -0.03 0.77 -0.04 0.00 1.31 0.00 0.00 55.95 57.96 2dmc s SER 50 Cb -0.13 0.71 0.01 0.00 0.21 0.00 0.00 66.02 66.82 2dmc s SER 50 CO -0.03 -0.16 0.10 -0.63 0.41 0.00 0.00 173.24 172.94 2dmc s ILE 51 N 0.76 0.01 -0.12 1.44 1.01 -1.26 0.85 121.20 123.89 2dmc s ILE 51 Ca -0.05 -0.08 -0.04 0.00 0.00 0.00 0.00 60.65 60.49 2dmc s ILE 51 Cb -0.06 -0.18 0.05 0.00 0.01 0.00 0.00 42.46 42.28 2dmc s ILE 51 CO -0.05 -0.04 0.08 -0.75 0.00 0.00 0.00 174.94 174.18 2dmc s LYS 52 N -0.09 0.00 1.04 2.79 2.20 -1.21 -1.36 119.74 123.12 2dmc s LYS 52 Ca -0.01 0.12 -0.24 0.00 -0.36 0.00 0.00 55.97 55.47 2dmc s LYS 52 Cb -0.01 -1.26 -0.09 0.00 -1.51 0.00 0.00 37.83 34.96 2dmc s LYS 52 CO 0.00 -0.53 -0.96 0.00 -0.36 0.00 0.00 175.35 173.51 2dmc n ALA 53 N 5.29 -5.20 0.36 3.13 0.00 0.10 -4.26 120.51 119.93 2dmc n ALA 53 Ca -0.05 -1.33 0.14 0.00 0.00 0.00 0.00 53.44 52.19 2dmc n ALA 53 Cb 0.49 -1.07 0.57 0.00 0.00 0.00 0.00 19.45 19.44 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 -1.39 0.00 -0.14 0.00 0.13 -1.89 -2.27 132.00 126.44 2dmc h PRO 54 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 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 0.27 0.00 0.00 0.43 -0.23 0.00 0.00 178.00 178.47 2dmc n SER 55 N -2.52 1.93 0.00 1.44 7.64 -1.26 -4.90 113.62 115.96 2dmc n SER 55 Ca 0.01 -1.71 0.00 0.00 1.01 0.00 0.00 58.87 58.19 2dmc n SER 55 Cb 0.25 -0.09 0.00 0.00 -1.01 0.00 0.00 64.21 63.36 2dmc n SER 55 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dmc n GLY 56 N 1.20 0.70 3.54 0.23 0.00 -0.85 -5.02 105.19 104.99 2dmc n GLY 56 Ca 0.17 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.76 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 -0.38 3.40 0.39 1.61 1.81 -1.26 -4.84 118.95 119.68 2dmc s ARG 57 Ca 0.00 -0.15 -0.27 0.00 -1.72 0.00 0.00 55.73 53.59 2dmc s ARG 57 Cb 0.00 -3.93 -0.09 0.00 -0.45 0.00 0.00 34.95 30.47 2dmc s ARG 57 CO 0.00 -1.07 1.34 0.34 -0.68 0.00 0.00 175.30 175.22 2dmc s ASP 58 N 2.08 6.36 -0.01 0.23 -1.08 -1.26 -0.72 116.67 122.27 2dmc s ASP 58 Ca 0.28 2.73 0.05 0.00 -0.52 0.00 0.00 52.55 55.09 2dmc s ASP 58 Cb -0.13 -2.65 -0.03 0.00 -1.46 0.00 0.00 42.92 38.66 2dmc s ASP 58 CO 0.21 -0.82 -0.15 -1.61 0.52 0.00 0.00 175.17 173.32 2dmc s GLU 59 N -2.16 2.35 -0.80 4.34 8.01 -0.46 -4.87 118.70 125.10 2dmc s GLU 59 Ca 0.55 -0.80 -0.25 0.00 0.01 0.00 0.00 54.97 54.48 2dmc s GLU 59 Cb -0.40 -2.31 -0.04 0.00 -4.31 0.00 0.00 34.13 27.07 2dmc s GLU 59 CO 0.52 0.59 1.91 -1.25 0.01 0.00 0.00 175.26 177.04 2dmc s PRO 60 N -1.03 2.59 0.06 0.39 0.04 -1.26 -4.41 135.00 131.37 2dmc s PRO 60 Ca 0.13 0.01 0.02 0.00 0.04 0.00 0.00 61.00 61.20 2dmc s PRO 60 Cb -0.11 -4.83 -0.04 0.00 0.04 0.00 0.00 34.50 29.56 2dmc s PRO 60 CO 0.03 -3.15 0.11 0.00 0.04 0.00 0.00 177.00 174.03 2dmc s LEU 62 N -2.30 0.42 0.14 0.00 1.98 0.10 -4.90 118.68 114.12 2dmc s LEU 62 Ca 0.29 0.42 -0.30 0.00 -2.89 0.00 0.00 54.13 51.65 2dmc s LEU 62 Cb -0.12 0.53 -0.07 0.00 0.66 0.00 0.00 46.19 47.19 2dmc s LEU 62 CO 0.22 -0.17 1.02 -0.76 -1.89 0.00 0.00 176.35 174.77 2dmc s LEU 63 N 1.45 4.50 0.28 -0.68 1.43 -1.26 -1.15 118.68 123.25 2dmc s LEU 63 Ca -0.07 1.92 0.02 0.00 -1.03 0.00 0.00 54.13 54.97 2dmc s LEU 63 Cb -0.11 -3.59 -0.03 0.00 0.03 0.00 0.00 46.19 42.49 2dmc s LEU 63 CO -0.07 -0.14 0.26 -1.59 0.23 0.00 0.00 176.35 175.05 2dmc s LYS 64 N -0.14 1.56 -0.24 1.70 -2.85 -1.18 -4.97 119.74 113.62 2dmc s LYS 64 Ca 0.48 -1.79 -0.07 0.00 -1.00 0.00 0.00 55.97 53.59 2dmc s LYS 64 Cb -0.26 0.33 -0.03 0.00 -2.06 0.00 0.00 37.83 35.81 2dmc s LYS 64 CO 0.32 -0.58 0.06 0.50 0.10 0.00 0.00 175.35 175.75 2dmc s ARG 65 N -3.68 3.63 0.31 1.78 3.00 -1.26 -3.64 118.95 119.09 2dmc s ARG 65 Ca 0.38 -0.49 -0.07 0.00 -1.00 0.00 0.00 55.73 54.55 2dmc s ARG 65 Cb 0.03 -3.28 -0.06 0.00 0.00 0.00 0.00 34.95 31.64 2dmc s ARG 65 CO 0.20 -0.18 0.61 -0.51 0.00 0.00 0.00 175.30 175.42 2dmc s LEU 66 N 1.57 4.02 0.00 -0.88 1.43 0.18 -4.97 118.68 120.02 2dmc s LEU 66 Ca 0.06 0.85 -0.12 0.00 -1.03 0.00 0.00 54.13 53.88 2dmc s LEU 66 Cb -0.15 -3.67 0.18 0.00 0.03 0.00 0.00 46.19 42.58 2dmc s LEU 66 CO 0.03 -0.23 0.65 -0.81 0.23 0.00 0.00 176.35 176.22 2dmc n PRO 67 N -0.91 -2.30 -2.22 1.29 -0.04 -1.26 -2.34 135.00 127.22 2dmc n PRO 67 Ca -0.00 -1.04 -0.16 0.00 -0.04 0.00 0.00 63.50 62.26 2dmc n PRO 67 Cb 0.54 -0.98 -0.02 0.00 -0.04 0.00 0.00 33.50 33.00 2dmc n PRO 67 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2dmc n ASN 68 N -4.12 -4.55 -3.13 3.54 3.02 -1.26 -1.63 115.26 107.13 2dmc n ASN 68 Ca 0.09 0.17 -0.15 0.00 -0.03 0.00 0.00 54.58 54.67 2dmc n ASN 68 Cb 0.35 -3.89 0.08 0.00 -0.61 0.00 0.00 39.78 35.70 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 -1.64 -2.77 -4.16 6.41 3.02 -1.26 -5.03 115.26 109.83 2dmc n ASN 69 Ca -0.18 -0.56 -0.10 0.00 -0.03 0.00 0.00 54.58 53.71 2dmc n ASN 69 Cb 0.61 -4.61 -0.10 0.00 -0.61 0.00 0.00 39.78 35.07 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 -3.32 0.86 -0.07 3.10 3.76 -0.64 -5.06 115.29 113.90 2dmc s HIS 70 Ca 0.07 -0.95 -0.06 0.00 -0.15 0.00 0.00 55.06 53.98 2dmc s HIS 70 Cb -0.01 -0.51 0.03 0.00 1.11 0.00 0.00 32.58 33.20 2dmc s HIS 70 CO 0.65 -0.19 0.19 0.42 -0.85 0.00 0.00 174.74 174.95 2dmc s ILE 71 N -3.68 -0.02 0.00 0.60 1.01 -1.26 0.48 121.20 118.33 2dmc s ILE 71 Ca 0.12 0.06 0.00 0.00 0.00 0.00 0.00 60.65 60.83 2dmc s ILE 71 Cb 0.06 -0.28 0.00 0.00 0.01 0.00 0.00 42.46 42.25 2dmc s ILE 71 CO -0.05 0.02 0.00 0.61 0.00 0.00 0.00 174.94 175.52 2dmc n GLY 72 N 3.41 3.85 3.43 6.18 0.00 -1.24 -3.98 105.19 116.84 2dmc n GLY 72 Ca -0.17 -1.42 -0.30 0.00 0.00 0.00 0.00 46.02 44.12 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 -2.03 2.61 -0.21 -0.61 2.07 -0.58 -3.08 121.20 119.38 2dmc s ILE 73 Ca 0.00 -1.37 0.02 0.00 -1.41 0.00 0.00 60.65 57.88 2dmc s ILE 73 Cb 0.00 -2.12 0.04 0.00 0.13 0.00 0.00 42.46 40.51 2dmc s ILE 73 CO 0.00 0.26 -0.15 -0.55 -1.91 0.00 0.00 174.94 172.59 2dmc s SER 74 N -1.65 3.63 0.19 4.50 0.15 -0.30 -1.55 113.70 118.68 2dmc s SER 74 Ca 0.15 -0.96 -0.12 0.00 0.70 0.00 0.00 55.95 55.73 2dmc s SER 74 Cb -0.10 -1.45 0.00 0.00 -1.71 0.00 0.00 66.02 62.76 2dmc s SER 74 CO 0.06 -0.10 0.37 0.72 1.20 0.00 0.00 173.24 175.49 2dmc s PHE 75 N 1.25 0.28 -0.34 3.44 -0.71 -1.24 0.02 117.98 120.68 2dmc s PHE 75 Ca -0.01 -0.63 -0.03 0.00 -1.04 0.00 0.00 56.93 55.22 2dmc s PHE 75 Cb -0.16 0.08 0.07 0.00 -1.21 0.00 0.00 43.02 41.80 2dmc s PHE 75 CO -0.09 -0.81 0.08 0.42 -1.34 0.00 0.00 175.22 173.48 2dmc s ILE 76 N -3.96 3.17 0.15 -4.49 1.01 -1.24 -2.73 121.20 113.12 2dmc s ILE 76 Ca 0.16 -1.58 -0.31 0.00 0.00 0.00 0.00 60.65 58.93 2dmc s ILE 76 Cb 0.02 -2.94 -0.08 0.00 0.01 0.00 0.00 42.46 39.47 2dmc s ILE 76 CO 0.01 -0.31 1.34 -2.16 0.00 0.00 0.00 174.94 173.82 2dmc s PRO 77 N 1.23 4.36 -0.11 2.79 0.04 -1.26 -4.60 135.00 137.44 2dmc s PRO 77 Ca -0.00 2.04 0.17 0.00 0.04 0.00 0.00 61.00 63.25 2dmc s PRO 77 Cb -0.21 -3.23 -0.24 0.00 0.04 0.00 0.00 34.50 30.86 2dmc s PRO 77 CO -0.02 -0.34 0.33 0.54 0.04 0.00 0.00 177.00 177.56 2dmc n ARG 78 N 3.37 0.67 -4.57 4.56 5.12 -1.26 -0.36 116.66 124.18 2dmc n ARG 78 Ca 0.09 0.05 -0.29 0.00 -1.93 0.00 0.00 57.85 55.78 2dmc n ARG 78 Cb 0.43 -1.61 -0.07 0.00 -1.16 0.00 0.00 32.46 30.05 2dmc n ARG 78 CO 0.00 0.00 0.00 0.39 -1.93 0.00 0.00 177.63 176.09 2dmc n GLU 79 N -2.76 0.63 -4.49 5.56 -0.58 -1.26 -4.78 120.64 112.97 2dmc n GLU 79 Ca -0.23 -3.64 -0.26 0.00 -0.42 0.00 0.00 57.16 52.61 2dmc n GLU 79 Cb 1.02 1.61 -0.13 0.00 -0.57 0.00 0.00 31.44 33.37 2dmc n GLU 79 CO 0.00 0.00 0.00 0.14 -0.48 0.00 0.00 177.13 176.79 2dmc s VAL 80 N -3.04 1.82 0.00 2.62 -7.23 -1.26 -4.84 120.40 108.46 2dmc s VAL 80 Ca 0.14 -1.44 0.00 0.00 -1.81 0.00 0.00 61.98 58.87 2dmc s VAL 80 Cb 0.01 -1.61 0.00 0.00 0.56 0.00 0.00 36.38 35.34 2dmc s VAL 80 CO 0.10 0.10 0.00 0.61 -0.31 0.00 0.00 175.10 175.59 2dmc n GLY 81 N 1.39 0.40 3.30 2.32 0.00 0.22 -4.93 105.19 107.89 2dmc n GLY 81 Ca -0.18 -1.03 -0.42 0.00 0.00 0.00 0.00 46.02 44.39 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 -1.00 2.72 -0.07 1.61 2.12 -1.26 -0.92 118.70 121.89 2dmc s GLU 82 Ca 0.00 -1.46 -0.10 0.00 0.36 0.00 0.00 54.97 53.77 2dmc s GLU 82 Cb 0.00 -3.91 -0.05 0.00 0.26 0.00 0.00 34.13 30.43 2dmc s GLU 82 CO 0.00 -1.01 0.25 -1.01 -0.54 0.00 0.00 175.26 172.96 2dmc s HIS 83 N 1.49 3.65 -0.15 5.30 3.76 -0.47 -4.34 115.29 124.53 2dmc s HIS 83 Ca 0.03 0.72 -0.02 0.00 -0.15 0.00 0.00 55.06 55.65 2dmc s HIS 83 Cb -0.24 -2.08 -0.02 0.00 1.11 0.00 0.00 32.58 31.35 2dmc s HIS 83 CO 0.03 0.70 -0.10 -0.51 -0.85 0.00 0.00 174.74 174.01 2dmc s LEU 84 N -1.07 2.87 -0.33 0.89 1.43 -1.26 -1.72 118.68 119.49 2dmc s LEU 84 Ca 0.19 -0.29 -0.08 0.00 -1.03 0.00 0.00 54.13 52.92 2dmc s LEU 84 Cb -0.14 -1.67 0.02 0.00 0.03 0.00 0.00 46.19 44.43 2dmc s LEU 84 CO 0.08 0.14 0.12 -0.69 0.23 0.00 0.00 176.35 176.24 2dmc s VAL 85 N 0.50 4.13 -0.62 -1.59 1.01 0.20 -3.33 120.40 120.70 2dmc s VAL 85 Ca -0.07 -0.82 -0.26 0.00 0.00 0.00 0.00 61.98 60.83 2dmc s VAL 85 Cb -0.15 -3.23 0.04 0.00 0.00 0.00 0.00 36.38 33.04 2dmc s VAL 85 CO 0.04 -0.07 1.10 -0.44 0.00 0.00 0.00 175.10 175.73 2dmc s SER 86 N 1.50 6.31 -0.18 3.32 0.01 0.25 0.02 113.70 124.93 2dmc s SER 86 Ca 0.01 -0.31 -0.04 0.00 1.31 0.00 0.00 55.95 56.92 2dmc s SER 86 Cb -0.18 -2.50 -0.02 0.00 0.21 0.00 0.00 66.02 63.52 2dmc s SER 86 CO 0.04 -1.48 -0.02 -0.63 0.41 0.00 0.00 173.24 171.56 2dmc s ILE 87 N 4.69 3.83 0.22 1.44 -1.09 -1.26 -2.64 121.20 126.40 2dmc s ILE 87 Ca 0.34 -0.36 -0.02 0.00 -2.23 0.00 0.00 60.65 58.38 2dmc s ILE 87 Cb -0.10 -2.71 -0.03 0.00 -1.58 0.00 0.00 42.46 38.04 2dmc s ILE 87 CO 0.19 0.46 0.20 -0.54 -1.23 0.00 0.00 174.94 174.02 2dmc s LYS 88 N 0.78 1.32 -0.27 2.79 1.02 -1.25 -1.85 119.74 122.28 2dmc s LYS 88 Ca -0.01 -1.62 0.01 0.00 0.02 0.00 0.00 55.97 54.38 2dmc s LYS 88 Cb -0.14 0.31 0.08 0.00 -0.52 0.00 0.00 37.83 37.55 2dmc s LYS 88 CO 0.02 -0.46 0.00 0.21 -0.92 0.00 0.00 175.35 174.20 2dmc s LYS 89 N -4.04 1.40 -1.73 1.68 2.20 0.86 0.46 119.74 120.57 2dmc s LYS 89 Ca 0.37 -1.21 0.00 0.00 -0.36 0.00 0.00 55.97 54.77 2dmc s LYS 89 Cb 0.05 -2.60 0.00 0.00 -1.51 0.00 0.00 37.83 33.77 2dmc s LYS 89 CO 0.13 -0.76 0.00 0.09 -0.36 0.00 0.00 175.35 174.46 2dmc n ASN 90 N 4.61 -5.32 0.00 1.43 3.02 -0.92 -1.86 115.26 116.22 2dmc n ASN 90 Ca -0.06 0.16 0.00 0.00 -0.03 0.00 0.00 54.58 54.65 2dmc n ASN 90 Cb 0.43 -4.41 0.00 0.00 -0.61 0.00 0.00 39.78 35.19 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 -0.90 0.92 2.77 7.41 0.00 -1.26 -5.07 105.19 109.07 2dmc n GLY 91 Ca -0.21 -0.10 -0.30 0.00 0.00 0.00 0.00 46.02 45.41 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 -2.10 3.90 0.46 1.61 0.01 -0.78 -5.09 114.94 112.95 2dmc s ASN 92 Ca 0.00 -1.50 -0.15 0.00 -0.71 0.00 0.00 52.86 50.50 2dmc s ASN 92 Cb 0.00 -0.91 -0.12 0.00 0.41 0.00 0.00 41.25 40.63 2dmc s ASN 92 CO 0.00 -0.38 -0.16 1.41 -1.51 0.00 0.00 177.10 176.46 2dmc n HIS 93 N 4.82 -2.59 -4.35 2.20 8.25 -1.26 -0.09 115.22 122.20 2dmc n HIS 93 Ca -0.04 0.33 -0.28 0.00 -0.26 0.00 0.00 57.72 57.47 2dmc n HIS 93 Cb 0.43 -1.37 -0.06 0.00 1.12 0.00 0.00 29.99 30.11 2dmc n HIS 93 CO 0.00 0.00 0.00 0.14 0.64 0.00 0.00 176.34 177.12 2dmc s VAL 94 N -1.65 1.72 0.45 1.59 -7.23 -0.77 -4.59 120.40 109.92 2dmc s VAL 94 Ca 0.45 -1.79 -0.24 0.00 -1.81 0.00 0.00 61.98 58.60 2dmc s VAL 94 Cb -0.38 -2.51 -0.07 0.00 0.56 0.00 0.00 36.38 33.97 2dmc s VAL 94 CO 0.56 0.00 1.26 0.00 -0.31 0.00 0.00 175.10 176.61 2dmc s ALA 95 N -2.75 3.07 -0.91 1.32 0.00 -1.26 -2.85 121.76 118.38 2dmc s ALA 95 Ca 0.26 1.14 0.00 0.00 0.00 0.00 0.00 51.96 53.37 2dmc s ALA 95 Cb 0.02 -3.46 0.00 0.00 0.00 0.00 0.00 23.12 19.68 2dmc s ALA 95 CO 0.15 -0.86 0.00 0.09 0.00 0.00 0.00 175.76 175.14 2dmc n ASN 96 N -0.30 -3.58 -4.06 0.00 3.02 -1.26 -4.80 115.26 104.28 2dmc n ASN 96 Ca 0.06 0.06 -0.17 0.00 -0.03 0.00 0.00 54.58 54.50 2dmc n ASN 96 Cb 0.45 -2.60 -0.13 0.00 -0.61 0.00 0.00 39.78 36.90 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 -2.65 1.10 0.68 6.41 0.15 -1.13 -3.62 113.70 114.64 2dmc s SER 97 Ca 0.00 -0.36 -0.14 0.00 0.70 0.00 0.00 55.95 56.15 2dmc s SER 97 Cb 0.00 -0.06 0.01 0.00 -1.71 0.00 0.00 66.02 64.27 2dmc s SER 97 CO 0.00 -0.02 1.11 -2.16 1.20 0.00 0.00 173.24 173.36 2dmc s PRO 98 N -0.92 2.68 0.09 5.44 0.04 -1.26 -4.84 135.00 136.23 2dmc s PRO 98 Ca -0.02 1.34 -0.25 0.00 0.04 0.00 0.00 61.00 62.12 2dmc s PRO 98 Cb -0.07 -1.94 -0.06 0.00 0.04 0.00 0.00 34.50 32.47 2dmc s PRO 98 CO 0.00 -1.34 0.75 0.08 0.04 0.00 0.00 177.00 176.54 2dmc s VAL 99 N -2.46 4.60 -0.27 -0.36 1.01 0.10 -4.77 120.40 118.25 2dmc s VAL 99 Ca 0.66 1.62 -0.12 0.00 0.00 0.00 0.00 61.98 64.15 2dmc s VAL 99 Cb -0.20 -4.11 -0.05 0.00 0.00 0.00 0.00 36.38 32.03 2dmc s VAL 99 CO 0.45 0.44 0.21 -0.94 0.00 0.00 0.00 175.10 175.25 2dmc s SER 100 N -0.53 6.09 0.02 3.32 1.04 -1.26 -0.63 113.70 121.75 2dmc s SER 100 Ca 0.37 0.08 0.06 0.00 0.48 0.00 0.00 55.95 56.94 2dmc s SER 100 Cb -0.21 -2.13 -0.02 0.00 0.10 0.00 0.00 66.02 63.75 2dmc s SER 100 CO 0.24 -0.04 -0.19 -0.63 0.98 0.00 0.00 173.24 173.60 2dmc s ILE 101 N 1.60 1.52 -0.25 -1.02 1.01 -0.70 -5.01 121.20 118.34 2dmc s ILE 101 Ca 0.09 -1.02 -0.08 0.00 0.00 0.00 0.00 60.65 59.63 2dmc s ILE 101 Cb -0.15 -1.31 -0.04 0.00 0.01 0.00 0.00 42.46 40.97 2dmc s ILE 101 CO 0.09 0.26 0.11 -0.32 0.00 0.00 0.00 174.94 175.08 2dmc s MET 102 N -0.89 3.78 -0.10 2.79 -2.45 -1.26 -1.37 119.30 119.81 2dmc s MET 102 Ca 0.07 -0.41 0.01 0.00 -1.25 0.00 0.00 55.69 54.11 2dmc s MET 102 Cb -0.08 -3.41 -0.02 0.00 1.25 0.00 0.00 34.83 32.57 2dmc s MET 102 CO 0.01 -0.13 -0.13 0.08 1.05 0.00 0.00 175.02 175.90 2dmc s VAL 103 N 1.51 3.13 -0.02 10.11 1.01 -0.10 -4.40 120.40 131.64 2dmc s VAL 103 Ca 0.06 -0.66 -0.17 0.00 0.00 0.00 0.00 61.98 61.21 2dmc s VAL 103 Cb -0.15 -2.28 0.03 0.00 0.00 0.00 0.00 36.38 33.98 2dmc s VAL 103 CO 0.06 0.55 0.36 0.68 0.00 0.00 0.00 175.10 176.75 2dmc s VAL 104 N -0.13 0.05 0.21 2.92 -7.23 -1.26 0.70 120.40 115.67 2dmc s VAL 104 Ca -0.01 -0.40 -0.27 0.00 -1.81 0.00 0.00 61.98 59.49 2dmc s VAL 104 Cb -0.14 -0.67 -0.09 0.00 0.56 0.00 0.00 36.38 36.05 2dmc s VAL 104 CO 0.03 -0.22 0.85 -1.10 -0.31 0.00 0.00 175.10 174.35 2dmc s GLN 105 N -1.31 4.66 -0.79 4.82 -0.21 -1.26 -4.16 119.66 121.41 2dmc s GLN 105 Ca -0.13 1.28 -0.20 0.00 0.02 0.00 0.00 55.36 56.34 2dmc s GLN 105 Cb -0.04 -3.21 0.11 0.00 1.00 0.00 0.00 33.01 30.87 2dmc s GLN 105 CO 0.05 0.52 0.98 -1.54 -2.12 0.00 0.00 175.29 173.18 2dmc s SER 106 N -1.23 6.43 -0.55 5.90 1.04 -1.26 -4.88 113.70 119.15 2dmc s SER 106 Ca 0.39 -1.68 0.03 0.00 0.48 0.00 0.00 55.95 55.17 2dmc s SER 106 Cb -0.23 -2.38 0.41 0.00 0.10 0.00 0.00 66.02 63.92 2dmc s SER 106 CO 0.28 -1.15 1.49 -0.62 0.98 0.00 0.00 173.24 174.22 2dmc n GLU 107 N 6.68 3.19 -4.09 4.02 1.02 -1.26 -4.97 120.64 125.23 2dmc n GLU 107 Ca 0.10 -4.03 -0.25 0.00 -0.02 0.00 0.00 57.16 52.96 2dmc n GLU 107 Cb 0.47 -2.27 -0.17 0.00 -0.02 0.00 0.00 31.44 29.45 2dmc n GLU 107 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 2dmc s ILE 108 N -5.16 0.89 0.12 -3.67 1.01 -1.26 -4.68 121.20 108.45 2dmc s ILE 108 Ca 0.52 -0.25 0.02 0.00 0.00 0.00 0.00 60.65 60.93 2dmc s ILE 108 Cb 0.43 -0.90 -0.01 0.00 0.01 0.00 0.00 42.46 41.98 2dmc s ILE 108 CO -0.19 0.33 0.12 0.61 0.00 0.00 0.00 174.94 175.81 2dmc n GLY 109 N 4.57 3.43 2.98 6.18 0.00 -1.26 -4.84 105.19 116.26 2dmc n GLY 109 Ca -0.16 -1.67 -0.25 0.00 0.00 0.00 0.00 46.02 43.93 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 -1.81 1.88 -0.48 1.61 2.15 -1.26 -4.79 116.67 113.97 2dmc s ASP 110 Ca 0.13 -0.30 -0.23 0.00 0.43 0.00 0.00 52.55 52.59 2dmc s ASP 110 Cb 0.00 -0.83 0.03 0.00 -0.30 0.00 0.00 42.92 41.83 2dmc s ASP 110 CO 0.09 -0.02 0.79 -0.55 -0.17 0.00 0.00 175.17 175.32 2dmc s SER 111 N 0.99 6.36 0.06 -0.34 0.15 -1.26 -4.78 113.70 114.89 2dmc s SER 111 Ca -0.08 -0.29 0.07 0.00 0.70 0.00 0.00 55.95 56.35 2dmc s SER 111 Cb -0.15 -2.38 -0.03 0.00 -1.71 0.00 0.00 66.02 61.76 2dmc s SER 111 CO -0.00 -0.97 -0.20 -0.83 1.20 0.00 0.00 173.24 172.43 2dmc s GLY 112 N 2.36 1.13 0.26 9.45 0.00 -1.26 -5.12 107.32 114.14 2dmc s GLY 112 Ca 0.27 -1.10 -0.29 0.00 0.00 0.00 0.00 44.72 43.60 2dmc s GLY 112 CO 0.20 -1.05 1.26 2.56 0.00 0.00 0.00 173.10 176.07 2dmc s PRO 113 N -1.37 4.44 -0.30 2.90 0.04 -1.26 -4.92 135.00 134.52 2dmc s PRO 113 Ca 0.07 2.05 -0.11 0.00 0.04 0.00 0.00 61.00 63.05 2dmc s PRO 113 Cb -0.09 -3.15 0.18 0.00 0.04 0.00 0.00 34.50 31.48 2dmc s PRO 113 CO 0.02 -0.12 1.00 -1.54 0.04 0.00 0.00 177.00 176.40 2dmc s SER 114 N -0.22 -0.55 0.00 6.66 1.04 -1.26 -5.17 113.70 114.21 2dmc s SER 114 Ca 0.51 0.27 0.08 0.00 0.48 0.00 0.00 55.95 57.30 2dmc s SER 114 Cb -0.36 1.43 -0.02 0.00 0.10 0.00 0.00 66.02 67.16 2dmc s SER 114 CO 0.44 -0.10 -0.25 -0.55 0.98 0.00 0.00 173.24 173.76 2dmc s SER 115 N 2.94 3.22 0.00 7.02 0.15 -1.26 -5.17 113.70 120.61 2dmc s SER 115 Ca 0.06 -0.49 0.00 0.00 0.70 0.00 0.00 55.95 56.23 2dmc s SER 115 Cb -0.09 -0.38 0.00 0.00 -1.71 0.00 0.00 66.02 63.84 2dmc s SER 115 CO -0.14 0.30 0.00 0.61 1.20 0.00 0.00 173.24 175.20