#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dmb n SER 2 N 0.00 0.07 0.29 1.61 2.88 -1.26 -4.90 113.62 112.31 2dmb n SER 2 Ca 0.00 0.00 -0.18 0.00 -1.33 0.00 0.00 58.87 57.36 2dmb n SER 2 Cb 0.00 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.36 2dmb n SER 2 CO 0.00 0.00 0.00 -1.28 -1.23 0.00 0.00 175.04 172.53 2dmb h SER 3 N 0.00 -1.35 0.00 -3.46 0.87 -2.13 -3.48 113.55 104.00 2dmb h SER 3 Ca 0.00 0.11 0.00 0.00 -1.23 0.00 0.00 61.79 60.67 2dmb h SER 3 Cb 0.35 0.45 0.00 0.00 -0.44 0.00 0.00 62.40 62.76 2dmb h SER 3 CO 0.00 -0.66 0.00 0.61 -0.53 0.00 0.00 176.83 176.25 2dmb n GLY 4 N -1.56 4.48 3.35 5.77 0.00 -1.26 -5.16 105.19 110.81 2dmb n GLY 4 Ca -0.12 -0.48 -0.32 0.00 0.00 0.00 0.00 46.02 45.10 2dmb n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dmb s SER 5 N 1.41 3.59 0.23 1.61 0.01 -1.26 -3.64 113.70 115.65 2dmb s SER 5 Ca 0.00 -0.38 -0.07 0.00 1.31 0.00 0.00 55.95 56.82 2dmb s SER 5 Cb 0.00 -1.10 -0.02 0.00 0.21 0.00 0.00 66.02 65.10 2dmb s SER 5 CO 0.00 0.24 0.31 -0.44 0.41 0.00 0.00 173.24 173.76 2dmb s SER 6 N -0.13 0.07 0.00 2.44 0.01 -1.26 -4.96 113.70 109.87 2dmb s SER 6 Ca -0.03 -1.18 0.00 0.00 1.31 0.00 0.00 55.95 56.05 2dmb s SER 6 Cb -0.14 0.49 0.00 0.00 0.21 0.00 0.00 66.02 66.58 2dmb s SER 6 CO 0.04 -1.00 0.00 0.61 0.41 0.00 0.00 173.24 173.30 2dmb n GLY 7 N -0.34 3.10 0.13 3.44 0.00 -1.26 -4.83 105.19 105.44 2dmb n GLY 7 Ca 0.00 -0.09 -0.12 0.00 0.00 0.00 0.00 46.02 45.81 2dmb n GLY 7 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2dmb n THR 8 N -0.59 0.93 -0.16 2.61 -2.24 -1.26 -5.13 114.28 108.44 2dmb n THR 8 Ca 0.00 -0.34 0.00 0.00 -2.27 0.00 0.00 64.05 61.44 2dmb n THR 8 Cb 0.00 -1.17 0.00 0.00 -2.10 0.00 0.00 70.33 67.06 2dmb n THR 8 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2dmb n GLY 9 N 2.61 -0.64 3.26 3.38 0.00 -1.25 -3.83 105.19 108.72 2dmb n GLY 9 Ca -0.29 -0.55 -0.25 0.00 0.00 0.00 0.00 46.02 44.93 2dmb n GLY 9 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2dmb s ASP 10 N -4.00 2.48 -0.16 1.61 1.11 0.90 -5.03 116.67 113.58 2dmb s ASP 10 Ca 0.00 -0.57 -0.11 0.00 0.18 0.00 0.00 52.55 52.06 2dmb s ASP 10 Cb 0.00 -0.19 -0.07 0.00 1.07 0.00 0.00 42.92 43.74 2dmb s ASP 10 CO 0.00 0.13 -0.25 0.00 1.18 0.00 0.00 175.17 176.23 2dmb n ALA 11 N 1.63 1.68 -0.32 5.23 0.00 -1.26 -4.43 120.51 123.04 2dmb n ALA 11 Ca -0.18 -0.70 0.33 0.00 0.00 0.00 0.00 53.44 52.89 2dmb n ALA 11 Cb 0.53 0.20 0.71 0.00 0.00 0.00 0.00 19.45 20.90 2dmb n ALA 11 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 2dmb h SER 12 N -0.69 0.07 -0.31 0.00 0.02 -1.96 0.26 113.55 110.94 2dmb h SER 12 Ca -0.33 0.01 -0.03 0.00 -0.84 0.00 0.00 61.79 60.61 2dmb h SER 12 Cb 1.18 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.71 2dmb h SER 12 CO -0.20 0.01 0.06 0.11 -1.14 0.00 0.00 176.83 175.67 2dmb h LYS 13 N 0.06 0.50 -6.48 3.45 1.79 -1.96 -3.44 116.57 110.49 2dmb h LYS 13 Ca 0.57 -0.13 -0.61 0.00 -2.18 0.00 0.00 60.65 58.30 2dmb h LYS 13 Cb 2.14 -0.06 0.09 0.00 -1.58 0.00 0.00 32.23 32.82 2dmb h LYS 13 CO -0.06 0.59 0.35 0.00 -1.08 0.00 0.00 179.45 179.25 2dmb s LEU 15 N 0.30 2.35 -0.26 0.00 1.43 -0.72 -5.01 118.68 116.77 2dmb s LEU 15 Ca 0.66 -0.78 0.02 0.00 -1.03 0.00 0.00 54.13 53.00 2dmb s LEU 15 Cb -0.73 -1.17 0.06 0.00 0.03 0.00 0.00 46.19 44.38 2dmb s LEU 15 CO 0.54 0.15 -0.09 0.00 0.23 0.00 0.00 176.35 177.18 2dmb s ALA 16 N -1.25 2.60 -0.09 4.21 0.00 -1.26 -0.63 121.76 125.34 2dmb s ALA 16 Ca 0.15 -1.73 0.03 0.00 0.00 0.00 0.00 51.96 50.41 2dmb s ALA 16 Cb -0.09 -1.63 0.00 0.00 0.00 0.00 0.00 23.12 21.40 2dmb s ALA 16 CO 0.07 -1.16 -0.20 0.95 0.00 0.00 0.00 175.76 175.42 2dmb s THR 17 N 1.14 1.74 0.00 0.00 -4.23 -0.96 -5.00 115.64 108.33 2dmb s THR 17 Ca -0.07 -0.83 0.00 0.00 -1.18 0.00 0.00 61.69 59.60 2dmb s THR 17 Cb -0.20 -1.53 0.00 0.00 1.34 0.00 0.00 72.50 72.12 2dmb s THR 17 CO -0.05 0.49 0.00 0.61 -0.54 0.00 0.00 174.62 175.13 2dmb n GLY 18 N 3.63 2.93 0.24 3.99 0.00 -1.26 -1.58 105.19 113.14 2dmb n GLY 18 Ca -0.20 -0.77 0.11 0.00 0.00 0.00 0.00 46.02 45.16 2dmb n GLY 18 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dmb h PRO 19 N 0.00 0.00 0.00 1.61 0.13 -1.98 -2.91 132.00 128.85 2dmb h PRO 19 Ca 0.00 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 65.05 2dmb h PRO 19 Cb 0.00 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.12 2dmb h PRO 19 CO 0.00 0.18 -0.39 0.78 -0.23 0.00 0.00 178.00 178.34 2dmb h GLY 20 N 1.76 0.00 -1.89 1.56 0.00 -1.91 -2.65 103.07 99.95 2dmb h GLY 20 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2dmb h GLY 20 CO 0.02 0.00 0.00 0.29 0.00 0.00 0.00 176.54 176.85 2dmb n ILE 21 N -3.69 0.64 -1.81 2.60 -5.35 -1.10 -4.95 119.36 105.69 2dmb n ILE 21 Ca -0.01 -0.68 -0.41 0.00 -0.27 0.00 0.00 62.75 61.38 2dmb n ILE 21 Cb 0.48 0.43 0.00 0.00 -1.74 0.00 0.00 39.64 38.82 2dmb n ILE 21 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2dmb s ALA 22 N -1.36 3.47 0.37 -1.28 0.00 -1.00 -4.84 121.76 117.12 2dmb s ALA 22 Ca 0.36 1.53 0.22 0.00 0.00 0.00 0.00 51.96 54.07 2dmb s ALA 22 Cb 0.19 -3.60 1.34 0.00 0.00 0.00 0.00 23.12 21.05 2dmb s ALA 22 CO 0.25 -1.08 1.55 0.43 0.00 0.00 0.00 175.76 176.91 2dmb n SER 23 N 0.28 0.33 -3.84 0.00 7.64 -1.26 -4.22 113.62 112.54 2dmb n SER 23 Ca 0.02 1.59 -0.15 0.00 1.01 0.00 0.00 58.87 61.34 2dmb n SER 23 Cb 0.40 -0.78 -0.15 0.00 -1.01 0.00 0.00 64.21 62.67 2dmb n SER 23 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 2dmb s THR 24 N -5.46 0.13 0.31 0.44 -4.23 -1.26 -1.14 115.64 104.43 2dmb s THR 24 Ca -0.09 0.05 0.04 0.00 -1.18 0.00 0.00 61.69 60.51 2dmb s THR 24 Cb 0.33 -0.19 -0.06 0.00 1.34 0.00 0.00 72.50 73.92 2dmb s THR 24 CO 0.77 0.10 0.04 0.68 -0.54 0.00 0.00 174.62 175.67 2dmb s VAL 25 N 0.64 1.22 -0.13 2.29 -7.23 0.22 -4.94 120.40 112.48 2dmb s VAL 25 Ca -0.06 -2.01 -0.07 0.00 -1.81 0.00 0.00 61.98 58.02 2dmb s VAL 25 Cb -0.09 -2.73 -0.04 0.00 0.56 0.00 0.00 36.38 34.08 2dmb s VAL 25 CO -0.01 -0.05 0.14 -0.75 -0.31 0.00 0.00 175.10 174.12 2dmb s LYS 26 N -3.87 3.52 0.74 4.82 2.20 -1.26 -0.29 119.74 125.60 2dmb s LYS 26 Ca 0.35 -0.13 -0.11 0.00 -0.36 0.00 0.00 55.97 55.72 2dmb s LYS 26 Cb 0.08 -3.21 0.04 0.00 -1.51 0.00 0.00 37.83 33.22 2dmb s LYS 26 CO 0.15 0.73 1.08 0.95 -0.36 0.00 0.00 175.35 177.90 2dmb s THR 27 N -0.89 3.48 0.00 3.43 -4.23 -0.79 -3.81 115.64 112.83 2dmb s THR 27 Ca 0.15 0.48 0.00 0.00 -1.18 0.00 0.00 61.69 61.14 2dmb s THR 27 Cb -0.12 -3.29 0.00 0.00 1.34 0.00 0.00 72.50 70.43 2dmb s THR 27 CO 0.04 -0.63 0.00 0.61 -0.54 0.00 0.00 174.62 174.10 2dmb n GLY 28 N -2.30 1.36 3.86 3.99 0.00 0.08 -4.94 105.19 107.24 2dmb n GLY 28 Ca 0.07 -0.03 -0.31 0.00 0.00 0.00 0.00 46.02 45.74 2dmb n GLY 28 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2dmb s GLU 29 N 0.00 3.59 -0.30 1.61 2.02 -1.25 -4.82 118.70 119.55 2dmb s GLU 29 Ca 0.00 0.83 -0.08 0.00 0.02 0.00 0.00 54.97 55.74 2dmb s GLU 29 Cb 0.00 -2.08 0.00 0.00 0.10 0.00 0.00 34.13 32.15 2dmb s GLU 29 CO 0.00 -0.57 0.11 -2.00 0.02 0.00 0.00 175.26 172.81 2dmb s GLU 30 N -4.90 3.20 0.51 1.61 2.12 -1.26 -3.92 118.70 116.05 2dmb s GLU 30 Ca 0.56 -0.79 -0.00 0.00 0.36 0.00 0.00 54.97 55.10 2dmb s GLU 30 Cb -0.11 -3.44 0.01 0.00 0.26 0.00 0.00 34.13 30.85 2dmb s GLU 30 CO 0.49 -0.42 0.74 0.14 -0.54 0.00 0.00 175.26 175.67 2dmb s VAL 31 N 1.54 3.44 -0.29 3.70 -7.23 -0.65 -4.94 120.40 115.99 2dmb s VAL 31 Ca 0.03 -0.50 0.02 0.00 -1.81 0.00 0.00 61.98 59.73 2dmb s VAL 31 Cb -0.17 -3.29 0.18 0.00 0.56 0.00 0.00 36.38 33.66 2dmb s VAL 31 CO 0.04 -0.22 0.54 -0.83 -0.31 0.00 0.00 175.10 174.32 2dmb s GLY 32 N -4.31 -0.98 0.46 2.32 0.00 -1.26 -2.29 107.32 101.27 2dmb s GLY 32 Ca 0.52 1.13 0.08 0.00 0.00 0.00 0.00 44.72 46.45 2dmb s GLY 32 CO 0.39 3.38 0.50 -0.11 0.00 0.00 0.00 173.10 177.27 2dmb s PHE 33 N 2.76 2.36 -0.11 1.90 -0.71 -0.20 -4.48 117.98 119.49 2dmb s PHE 33 Ca 0.13 -0.56 -0.09 0.00 -1.04 0.00 0.00 56.93 55.38 2dmb s PHE 33 Cb -0.12 -2.20 0.04 0.00 -1.21 0.00 0.00 43.02 39.52 2dmb s PHE 33 CO -0.24 -0.43 0.29 0.54 -1.34 0.00 0.00 175.22 174.04 2dmb s VAL 34 N -2.52 -0.01 -0.12 -2.49 0.11 -0.62 -0.35 120.40 114.41 2dmb s VAL 34 Ca 0.50 0.05 -0.21 0.00 -2.93 0.00 0.00 61.98 59.39 2dmb s VAL 34 Cb -0.05 -0.42 -0.03 0.00 -1.53 0.00 0.00 36.38 34.34 2dmb s VAL 34 CO 0.30 0.02 0.62 -0.69 -3.33 0.00 0.00 175.10 172.02 2dmb s VAL 35 N 0.59 5.08 -0.22 2.04 1.01 0.20 -2.26 120.40 126.84 2dmb s VAL 35 Ca -0.04 1.24 -0.12 0.00 0.00 0.00 0.00 61.98 63.06 2dmb s VAL 35 Cb -0.05 -3.95 -0.05 0.00 0.00 0.00 0.00 36.38 32.33 2dmb s VAL 35 CO -0.03 0.23 0.24 -0.62 0.00 0.00 0.00 175.10 174.91 2dmb s ASP 36 N 0.86 6.25 -0.08 3.32 -1.08 0.20 -2.82 116.67 123.32 2dmb s ASP 36 Ca 0.32 0.28 0.01 0.00 -0.52 0.00 0.00 52.55 52.64 2dmb s ASP 36 Cb -0.16 -2.15 0.02 0.00 -1.46 0.00 0.00 42.92 39.17 2dmb s ASP 36 CO 0.14 0.05 -0.10 0.00 0.52 0.00 0.00 175.17 175.77 2dmb s ALA 37 N 0.96 1.25 0.00 3.66 0.00 -1.22 -1.75 121.76 124.66 2dmb s ALA 37 Ca 0.12 -0.45 0.00 0.00 0.00 0.00 0.00 51.96 51.63 2dmb s ALA 37 Cb -0.13 -0.70 0.00 0.00 0.00 0.00 0.00 23.12 22.29 2dmb s ALA 37 CO 0.04 -0.11 0.00 0.36 0.00 0.00 0.00 175.76 176.05 2dmb n LYS 38 N 4.29 0.00 -0.00 0.00 2.85 -1.26 -4.76 118.16 119.28 2dmb n LYS 38 Ca -0.19 0.00 0.05 0.00 -1.05 0.00 0.00 58.31 57.12 2dmb n LYS 38 Cb 0.51 -0.70 -0.07 0.00 -0.65 0.00 0.00 35.03 34.12 2dmb n LYS 38 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 177.40 177.60 2dmb n THR 39 N -2.50 0.00 -0.44 0.58 -2.24 -1.26 -4.60 114.28 103.82 2dmb n THR 39 Ca 0.00 -0.23 0.37 0.00 -2.27 0.00 0.00 64.05 61.93 2dmb n THR 39 Cb 0.38 0.36 0.65 0.00 -2.10 0.00 0.00 70.33 69.62 2dmb n THR 39 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2dmb h ALA 40 N 0.93 2.70 0.00 6.98 0.00 -1.87 -3.44 119.26 124.57 2dmb h ALA 40 Ca 0.00 0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.05 2dmb h ALA 40 Cb 0.42 0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.45 2dmb h ALA 40 CO 0.00 -1.38 0.00 0.41 0.00 0.00 0.00 179.25 178.28 2dmb n GLY 41 N -1.49 0.66 3.83 0.00 0.00 -1.26 -0.07 105.19 106.85 2dmb n GLY 41 Ca 0.38 -1.22 -0.36 0.00 0.00 0.00 0.00 46.02 44.82 2dmb n GLY 41 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2dmb s LYS 42 N 0.00 4.09 0.00 1.61 2.36 -1.25 -4.96 119.74 121.59 2dmb s LYS 42 Ca 0.00 0.64 0.00 0.00 -2.55 0.00 0.00 55.97 54.06 2dmb s LYS 42 Cb 0.00 -2.97 0.00 0.00 -1.05 0.00 0.00 37.83 33.81 2dmb s LYS 42 CO 0.00 0.48 0.00 0.41 1.55 0.00 0.00 175.35 177.79 2dmb n GLY 43 N 0.94 4.13 3.96 5.54 0.00 -1.26 -3.95 105.19 114.55 2dmb n GLY 43 Ca -0.05 -0.80 -0.22 0.00 0.00 0.00 0.00 46.02 44.95 2dmb n GLY 43 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dmb s LYS 44 N -2.86 3.44 -0.21 1.61 3.01 -1.26 -4.73 119.74 118.74 2dmb s LYS 44 Ca 0.00 -0.59 0.01 0.00 -1.01 0.00 0.00 55.97 54.38 2dmb s LYS 44 Cb 0.00 -2.78 0.03 0.00 -1.01 0.00 0.00 37.83 34.06 2dmb s LYS 44 CO 0.00 0.28 -0.16 0.08 0.51 0.00 0.00 175.35 176.06 2dmb s VAL 45 N -2.14 2.28 -0.11 3.17 1.01 -1.26 -0.59 120.40 122.76 2dmb s VAL 45 Ca 0.37 -1.03 -0.03 0.00 0.00 0.00 0.00 61.98 61.29 2dmb s VAL 45 Cb -0.09 -2.06 -0.03 0.00 0.00 0.00 0.00 36.38 34.20 2dmb s VAL 45 CO 0.32 0.39 -0.01 0.42 0.00 0.00 0.00 175.10 176.23 2dmb s THR 46 N 1.28 4.22 0.05 3.92 -4.23 -1.10 -4.98 115.64 114.80 2dmb s THR 46 Ca 0.02 -0.27 0.08 0.00 -1.18 0.00 0.00 61.69 60.35 2dmb s THR 46 Cb -0.15 -2.80 -0.03 0.00 1.34 0.00 0.00 72.50 70.87 2dmb s THR 46 CO -0.10 0.57 -0.24 0.00 -0.54 0.00 0.00 174.62 174.31 2dmb s THR 48 N -0.82 -0.13 -0.35 0.00 2.01 -0.98 -4.39 115.64 110.98 2dmb s THR 48 Ca 0.10 0.04 -0.27 0.00 0.31 0.00 0.00 61.69 61.87 2dmb s THR 48 Cb -0.09 -0.45 0.01 0.00 0.01 0.00 0.00 72.50 71.98 2dmb s THR 48 CO 0.02 -0.12 0.96 -0.69 -0.69 0.00 0.00 174.62 174.10 2dmb s VAL 49 N 2.18 4.58 -0.30 3.82 1.01 -0.86 -2.13 120.40 128.69 2dmb s VAL 49 Ca 0.03 1.37 -0.10 0.00 0.00 0.00 0.00 61.98 63.29 2dmb s VAL 49 Cb -0.15 -4.34 -0.01 0.00 0.00 0.00 0.00 36.38 31.88 2dmb s VAL 49 CO -0.07 -0.49 0.15 -0.22 0.00 0.00 0.00 175.10 174.46 2dmb s LEU 50 N 3.48 4.04 0.33 3.92 2.96 -0.75 -0.63 118.68 132.04 2dmb s LEU 50 Ca 0.40 -0.45 -0.17 0.00 -0.22 0.00 0.00 54.13 53.69 2dmb s LEU 50 Cb -0.12 -2.01 -0.09 0.00 0.50 0.00 0.00 46.19 44.47 2dmb s LEU 50 CO 0.17 -0.17 0.78 0.42 -1.32 0.00 0.00 176.35 176.23 2dmb s THR 51 N 1.63 4.61 -1.11 3.68 -4.23 -1.02 -1.93 115.64 117.27 2dmb s THR 51 Ca 0.05 1.10 0.14 0.00 -1.18 0.00 0.00 61.69 61.80 2dmb s THR 51 Cb -0.17 -3.65 0.15 0.00 1.34 0.00 0.00 72.50 70.18 2dmb s THR 51 CO 0.06 -0.16 1.44 -0.81 -0.54 0.00 0.00 174.62 174.62 2dmb n PRO 52 N -0.27 0.05 0.18 3.99 -0.04 -1.25 -2.37 135.00 135.28 2dmb n PRO 52 Ca 0.03 0.23 0.06 0.00 -0.04 0.00 0.00 63.50 63.78 2dmb n PRO 52 Cb 0.53 -1.50 0.20 0.00 -0.04 0.00 0.00 33.50 32.69 2dmb n PRO 52 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 2dmb h ASP 53 N 0.00 0.00 0.00 3.54 5.19 -1.92 -3.47 116.42 119.75 2dmb h ASP 53 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2dmb h ASP 53 Cb 0.22 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.73 2dmb h ASP 53 CO 0.00 0.37 0.00 0.61 -3.12 0.00 0.00 179.24 177.10 2dmb n GLY 54 N 0.80 1.94 3.09 2.75 0.00 -1.00 -5.13 105.19 107.64 2dmb n GLY 54 Ca 0.01 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.81 2dmb n GLY 54 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2dmb s THR 55 N -2.00 1.10 -0.36 2.61 -4.23 -1.25 -5.04 115.64 106.47 2dmb s THR 55 Ca 0.00 -0.57 -0.20 0.00 -1.18 0.00 0.00 61.69 59.74 2dmb s THR 55 Cb 0.00 -0.94 0.00 0.00 1.34 0.00 0.00 72.50 72.90 2dmb s THR 55 CO 0.00 0.32 0.64 -1.61 -0.54 0.00 0.00 174.62 173.43 2dmb s GLU 56 N -0.12 3.65 0.09 3.99 2.02 -1.26 -2.43 118.70 124.65 2dmb s GLU 56 Ca 0.01 0.03 0.02 0.00 0.02 0.00 0.00 54.97 55.05 2dmb s GLU 56 Cb -0.08 -3.82 -0.04 0.00 0.10 0.00 0.00 34.13 30.30 2dmb s GLU 56 CO 0.00 -0.76 0.17 0.00 0.02 0.00 0.00 175.26 174.69 2dmb s ALA 57 N 2.72 3.80 0.37 5.21 0.00 0.20 -5.03 121.76 129.03 2dmb s ALA 57 Ca 0.24 -0.98 0.01 0.00 0.00 0.00 0.00 51.96 51.24 2dmb s ALA 57 Cb -0.14 -1.63 -0.02 0.00 0.00 0.00 0.00 23.12 21.33 2dmb s ALA 57 CO 0.15 0.71 0.56 -1.83 0.00 0.00 0.00 175.76 175.35 2dmb s GLU 58 N -2.67 3.33 0.12 0.00 -1.05 -1.26 -2.03 118.70 115.14 2dmb s GLU 58 Ca 0.32 -0.47 0.07 0.00 -0.15 0.00 0.00 54.97 54.74 2dmb s GLU 58 Cb -0.12 -2.67 -0.04 0.00 -0.44 0.00 0.00 34.13 30.87 2dmb s GLU 58 CO 0.25 0.04 -0.16 0.00 0.95 0.00 0.00 175.26 176.35 2dmb s ALA 59 N -2.35 1.61 -0.45 -0.84 0.00 -1.26 -4.76 121.76 113.71 2dmb s ALA 59 Ca 0.42 -1.29 -0.23 0.00 0.00 0.00 0.00 51.96 50.86 2dmb s ALA 59 Cb -0.10 -0.13 0.03 0.00 0.00 0.00 0.00 23.12 22.92 2dmb s ALA 59 CO 0.36 0.18 0.78 -0.51 0.00 0.00 0.00 175.76 176.56 2dmb s ASP 60 N -2.32 6.41 0.11 0.00 1.11 -1.23 -4.97 116.67 115.78 2dmb s ASP 60 Ca 0.08 -0.11 -0.08 0.00 0.18 0.00 0.00 52.55 52.63 2dmb s ASP 60 Cb -0.07 -2.38 -0.06 0.00 1.07 0.00 0.00 42.92 41.48 2dmb s ASP 60 CO 0.04 -0.91 0.40 -0.69 1.18 0.00 0.00 175.17 175.19 2dmb s VAL 61 N 3.27 5.12 -0.23 -1.27 1.01 -1.26 -2.86 120.40 124.17 2dmb s VAL 61 Ca 0.30 0.29 -0.03 0.00 0.00 0.00 0.00 61.98 62.54 2dmb s VAL 61 Cb -0.12 -3.63 0.08 0.00 0.00 0.00 0.00 36.38 32.70 2dmb s VAL 61 CO 0.22 0.17 0.07 -0.63 0.00 0.00 0.00 175.10 174.94 2dmb s ILE 62 N -1.52 0.43 0.36 2.22 1.09 0.92 -4.96 121.20 119.74 2dmb s ILE 62 Ca 0.37 -0.73 -0.24 0.00 -1.10 0.00 0.00 60.65 58.94 2dmb s ILE 62 Cb -0.13 -1.11 -0.10 0.00 -1.06 0.00 0.00 42.46 40.06 2dmb s ILE 62 CO 0.21 -0.41 0.96 -1.83 -0.10 0.00 0.00 174.94 173.77 2dmb s GLU 63 N 1.88 4.42 0.08 2.79 -1.05 -1.26 -0.59 118.70 124.96 2dmb s GLU 63 Ca 0.03 1.31 0.05 0.00 -0.15 0.00 0.00 54.97 56.21 2dmb s GLU 63 Cb -0.17 -2.59 -0.03 0.00 -0.44 0.00 0.00 34.13 30.90 2dmb s GLU 63 CO -0.17 0.12 -0.13 -0.80 0.95 0.00 0.00 175.26 175.23 2dmb s ASN 64 N -1.76 1.67 0.61 0.83 0.01 0.92 -4.96 114.94 112.26 2dmb s ASN 64 Ca 0.55 -0.67 0.33 0.00 -0.71 0.00 0.00 52.86 52.35 2dmb s ASN 64 Cb -0.17 -0.04 1.91 0.00 0.41 0.00 0.00 41.25 43.36 2dmb s ASN 64 CO 0.22 -0.11 2.24 -0.33 -1.51 0.00 0.00 177.10 177.60 2dmb h GLU 65 N 4.09 0.00 -1.50 -0.60 5.08 -1.98 -2.05 114.58 117.62 2dmb h GLU 65 Ca -0.40 0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 57.84 2dmb h GLU 65 Cb 1.19 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 30.38 2dmb h GLU 65 CO 0.43 0.00 0.16 -0.25 -1.00 0.00 0.00 179.01 178.35 2dmb n ASP 66 N -3.65 4.81 -3.26 1.42 8.00 -1.26 -4.79 116.55 117.82 2dmb n ASP 66 Ca -0.02 -2.55 -0.19 0.00 0.71 0.00 0.00 54.79 52.74 2dmb n ASP 66 Cb 0.14 -0.90 -0.02 0.00 -0.02 0.00 0.00 41.12 40.32 2dmb n ASP 66 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2dmb n GLY 67 N 0.70 -0.47 3.32 0.44 0.00 -0.77 -4.73 105.19 103.67 2dmb n GLY 67 Ca 0.12 0.05 -0.29 0.00 0.00 0.00 0.00 46.02 45.90 2dmb n GLY 67 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2dmb s THR 68 N -2.68 2.02 -0.15 2.61 -4.23 -1.22 -3.41 115.64 108.58 2dmb s THR 68 Ca 0.33 -1.28 0.00 0.00 -1.18 0.00 0.00 61.69 59.57 2dmb s THR 68 Cb -0.19 -1.72 0.03 0.00 1.34 0.00 0.00 72.50 71.96 2dmb s THR 68 CO 0.41 0.39 -0.12 -0.31 -0.54 0.00 0.00 174.62 174.45 2dmb s TYR 69 N -0.74 2.10 -0.18 3.99 1.51 -1.13 -0.05 117.35 122.84 2dmb s TYR 69 Ca 0.11 -1.22 -0.08 0.00 -1.01 0.00 0.00 57.07 54.87 2dmb s TYR 69 Cb -0.10 -1.55 -0.04 0.00 -0.11 0.00 0.00 41.96 40.16 2dmb s TYR 69 CO 0.01 -0.66 0.08 0.16 -1.11 0.00 0.00 175.55 174.03 2dmb s ASP 70 N 1.51 5.81 0.11 2.29 -4.77 0.24 -0.62 116.67 121.24 2dmb s ASP 70 Ca 0.04 0.14 0.07 0.00 -3.30 0.00 0.00 52.55 49.49 2dmb s ASP 70 Cb -0.13 -1.99 -0.04 0.00 -1.09 0.00 0.00 42.92 39.67 2dmb s ASP 70 CO -0.10 0.19 -0.17 -0.63 0.70 0.00 0.00 175.17 175.16 2dmb s ILE 71 N 0.29 1.47 0.03 2.11 1.01 0.53 -0.06 121.20 126.58 2dmb s ILE 71 Ca 0.05 -1.63 0.02 0.00 0.00 0.00 0.00 60.65 59.10 2dmb s ILE 71 Cb -0.12 -1.50 -0.02 0.00 0.01 0.00 0.00 42.46 40.83 2dmb s ILE 71 CO -0.00 -0.27 -0.07 -0.36 0.00 0.00 0.00 174.94 174.23 2dmb s PHE 72 N -1.70 0.65 0.13 3.97 0.40 -1.14 -1.03 117.98 119.26 2dmb s PHE 72 Ca 0.07 -0.37 -0.22 0.00 -0.60 0.00 0.00 56.93 55.82 2dmb s PHE 72 Cb -0.07 -0.39 0.06 0.00 0.51 0.00 0.00 43.02 43.12 2dmb s PHE 72 CO 0.04 -0.05 0.56 1.52 0.70 0.00 0.00 175.22 177.99 2dmb s TYR 73 N -0.96 -0.47 0.16 0.36 -0.85 -0.97 -3.57 117.35 111.04 2dmb s TYR 73 Ca -0.06 0.31 0.09 0.00 -0.52 0.00 0.00 57.07 56.90 2dmb s TYR 73 Cb -0.07 0.47 -0.04 0.00 0.38 0.00 0.00 41.96 42.70 2dmb s TYR 73 CO 0.00 -0.79 -0.20 0.99 -1.52 0.00 0.00 175.55 174.03 2dmb s THR 74 N -3.48 1.96 -0.50 -3.49 2.01 -1.26 -1.63 115.64 109.25 2dmb s THR 74 Ca 0.00 -1.90 -0.07 0.00 0.31 0.00 0.00 61.69 60.03 2dmb s THR 74 Cb -0.00 -1.89 0.13 0.00 0.01 0.00 0.00 72.50 70.75 2dmb s THR 74 CO -0.10 -0.22 0.35 0.00 -0.69 0.00 0.00 174.62 173.95 2dmb s ALA 75 N -1.81 3.40 0.12 7.40 0.00 -1.25 -4.96 121.76 124.65 2dmb s ALA 75 Ca 0.16 -2.68 -0.25 0.00 0.00 0.00 0.00 51.96 49.19 2dmb s ALA 75 Cb -0.07 -2.74 -0.07 0.00 0.00 0.00 0.00 23.12 20.25 2dmb s ALA 75 CO 0.07 -1.93 1.66 0.00 0.00 0.00 0.00 175.76 175.56 2dmb h ALA 76 N 8.12 -0.26 -3.21 0.00 0.00 -1.95 0.26 119.26 122.23 2dmb h ALA 76 Ca -0.15 -0.00 -0.47 0.00 0.00 0.00 0.00 54.91 54.29 2dmb h ALA 76 Cb 1.05 0.33 -0.20 0.00 0.00 0.00 0.00 17.79 18.97 2dmb h ALA 76 CO 0.80 -0.69 -0.78 0.15 0.00 0.00 0.00 179.25 178.72 2dmb s LYS 77 N -6.11 1.05 0.78 0.00 1.02 -1.26 -4.57 119.74 110.65 2dmb s LYS 77 Ca -0.15 -1.19 -0.11 0.00 0.02 0.00 0.00 55.97 54.55 2dmb s LYS 77 Cb 0.09 -1.09 0.06 0.00 -0.52 0.00 0.00 37.83 36.37 2dmb s LYS 77 CO 0.66 0.23 1.09 -1.25 -0.92 0.00 0.00 175.35 175.16 2dmb s PRO 78 N -2.29 2.20 0.00 -1.68 0.04 -1.26 -4.94 135.00 127.06 2dmb s PRO 78 Ca 0.07 1.15 0.00 0.00 0.04 0.00 0.00 61.00 62.26 2dmb s PRO 78 Cb -0.07 -1.89 0.00 0.00 0.04 0.00 0.00 34.50 32.57 2dmb s PRO 78 CO 0.04 -1.68 0.00 0.41 0.04 0.00 0.00 177.00 175.81 2dmb n GLY 79 N -1.20 0.09 3.08 0.56 0.00 -0.88 -4.95 105.19 101.90 2dmb n GLY 79 Ca 0.09 -1.03 -0.33 0.00 0.00 0.00 0.00 46.02 44.75 2dmb n GLY 79 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2dmb s THR 80 N -4.00 2.68 -0.09 2.61 2.01 -1.26 -2.34 115.64 115.25 2dmb s THR 80 Ca 0.00 -1.97 -0.16 0.00 0.31 0.00 0.00 61.69 59.87 2dmb s THR 80 Cb 0.00 -2.79 -0.05 0.00 0.01 0.00 0.00 72.50 69.67 2dmb s THR 80 CO 0.00 -0.44 0.40 -0.31 -0.69 0.00 0.00 174.62 173.58 2dmb s TYR 81 N 1.07 3.57 -0.28 4.92 1.51 -0.45 -3.85 117.35 123.84 2dmb s TYR 81 Ca 0.04 0.84 -0.03 0.00 -1.01 0.00 0.00 57.07 56.91 2dmb s TYR 81 Cb -0.20 -2.41 0.03 0.00 -0.11 0.00 0.00 41.96 39.27 2dmb s TYR 81 CO -0.05 0.35 -0.00 0.08 -1.11 0.00 0.00 175.55 174.81 2dmb s VAL 82 N 0.02 3.17 -0.25 0.71 1.01 -0.81 -2.19 120.40 122.06 2dmb s VAL 82 Ca 0.23 -1.10 -0.14 0.00 0.00 0.00 0.00 61.98 60.96 2dmb s VAL 82 Cb -0.15 -2.70 -0.04 0.00 0.00 0.00 0.00 36.38 33.49 2dmb s VAL 82 CO 0.10 0.04 0.34 -0.63 0.00 0.00 0.00 175.10 174.95 2dmb s ILE 83 N 1.34 5.21 -0.39 2.22 1.01 -1.20 -1.81 121.20 127.59 2dmb s ILE 83 Ca -0.01 0.53 -0.14 0.00 0.00 0.00 0.00 60.65 61.02 2dmb s ILE 83 Cb -0.18 -3.67 0.01 0.00 0.01 0.00 0.00 42.46 38.63 2dmb s ILE 83 CO -0.02 0.21 0.29 -0.31 0.00 0.00 0.00 174.94 175.12 2dmb s TYR 84 N 1.71 3.23 -0.01 3.97 2.02 -0.91 -1.32 117.35 126.06 2dmb s TYR 84 Ca 0.15 -0.43 0.08 0.00 -0.37 0.00 0.00 57.07 56.49 2dmb s TYR 84 Cb -0.15 -2.57 -0.02 0.00 -0.40 0.00 0.00 41.96 38.81 2dmb s TYR 84 CO 0.09 -0.51 -0.24 0.08 -1.57 0.00 0.00 175.55 173.39 2dmb s VAL 85 N 1.73 2.25 0.04 0.71 1.01 -1.26 -2.33 120.40 122.55 2dmb s VAL 85 Ca 0.06 -1.11 -0.11 0.00 0.00 0.00 0.00 61.98 60.82 2dmb s VAL 85 Cb -0.18 -1.82 0.01 0.00 0.00 0.00 0.00 36.38 34.39 2dmb s VAL 85 CO 0.10 0.53 0.24 0.00 0.00 0.00 0.00 175.10 175.98 2dmb s ARG 86 N -0.79 0.75 -0.27 2.72 1.70 -1.16 -3.22 118.95 118.68 2dmb s ARG 86 Ca 0.11 -0.58 -0.01 0.00 -0.47 0.00 0.00 55.73 54.78 2dmb s ARG 86 Cb -0.10 0.32 0.04 0.00 -0.57 0.00 0.00 34.95 34.64 2dmb s ARG 86 CO 0.00 -0.23 -0.05 0.12 -1.08 0.00 0.00 175.30 174.06 2dmb s PHE 87 N -2.58 3.17 -0.46 5.89 5.36 -0.04 -2.69 117.98 126.63 2dmb s PHE 87 Ca -0.05 -1.82 0.00 0.00 -0.96 0.00 0.00 56.93 54.10 2dmb s PHE 87 Cb -0.01 -2.05 0.00 0.00 -0.34 0.00 0.00 43.02 40.62 2dmb s PHE 87 CO -0.04 -0.79 0.00 0.41 -1.46 0.00 0.00 175.22 173.34 2dmb n GLY 88 N 4.61 0.48 0.00 13.12 0.00 0.24 -1.66 105.19 121.98 2dmb n GLY 88 Ca -0.15 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.83 2dmb n GLY 88 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dmb n GLY 89 N 0.11 1.33 3.12 -0.02 0.00 -1.26 -4.94 105.19 103.53 2dmb n GLY 89 Ca -0.04 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.65 2dmb n GLY 89 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2dmb s VAL 90 N -2.00 2.45 -0.71 1.61 1.01 -0.66 -5.05 120.40 117.04 2dmb s VAL 90 Ca 0.00 -1.36 -0.26 0.00 0.00 0.00 0.00 61.98 60.36 2dmb s VAL 90 Cb 0.00 -2.33 -0.08 0.00 0.00 0.00 0.00 36.38 33.97 2dmb s VAL 90 CO 0.00 0.09 2.19 -0.62 0.00 0.00 0.00 175.10 176.76 2dmb s ASP 91 N 1.20 4.60 0.67 3.32 2.15 -1.26 -0.86 116.67 126.49 2dmb s ASP 91 Ca -0.04 0.17 -0.14 0.00 0.43 0.00 0.00 52.55 52.96 2dmb s ASP 91 Cb -0.18 -2.54 -0.12 0.00 -0.30 0.00 0.00 42.92 39.78 2dmb s ASP 91 CO -0.05 -3.07 -0.45 2.30 -0.17 0.00 0.00 175.17 173.73 2dmb n ILE 92 N 8.06 0.00 0.97 4.11 -5.35 -1.20 -4.72 119.36 121.24 2dmb n ILE 92 Ca 0.38 -0.42 0.05 0.00 -0.27 0.00 0.00 62.75 62.49 2dmb n ILE 92 Cb 0.49 0.00 0.32 0.00 -1.74 0.00 0.00 39.64 38.70 2dmb n ILE 92 CO 0.00 0.00 0.00 -0.81 -1.76 0.00 0.00 176.55 173.98 2dmb n PRO 93 N 1.75 0.49 -0.00 6.28 -0.04 -1.26 -1.80 135.00 140.41 2dmb n PRO 93 Ca 0.02 0.00 0.07 0.00 -0.04 0.00 0.00 63.50 63.54 2dmb n PRO 93 Cb 0.44 -1.34 -0.08 0.00 -0.04 0.00 0.00 33.50 32.47 2dmb n PRO 93 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2dmb n ASN 94 N -0.84 0.80 -4.85 3.54 3.02 -1.26 -4.98 115.26 110.69 2dmb n ASN 94 Ca 0.08 -0.71 -0.36 0.00 -0.03 0.00 0.00 54.58 53.56 2dmb n ASN 94 Cb 0.04 1.09 -0.06 0.00 -0.61 0.00 0.00 39.78 40.24 2dmb n ASN 94 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 2dmb s SER 95 N -2.50 6.75 1.07 6.41 0.15 -0.75 -3.72 113.70 121.11 2dmb s SER 95 Ca 0.04 0.92 -0.15 0.00 0.70 0.00 0.00 55.95 57.46 2dmb s SER 95 Cb 0.10 -2.23 0.22 0.00 -1.71 0.00 0.00 66.02 62.41 2dmb s SER 95 CO 0.57 0.22 1.10 -2.16 1.20 0.00 0.00 173.24 174.17 2dmb s PRO 96 N -1.59 -0.16 -0.40 5.44 0.04 -1.26 -4.88 135.00 132.19 2dmb s PRO 96 Ca 0.30 0.31 -0.04 0.00 0.04 0.00 0.00 61.00 61.61 2dmb s PRO 96 Cb -0.15 -1.69 0.09 0.00 0.04 0.00 0.00 34.50 32.79 2dmb s PRO 96 CO 0.16 -3.08 0.19 -0.06 0.04 0.00 0.00 177.00 174.25 2dmb s PHE 97 N -2.98 3.47 0.02 0.56 0.40 -0.43 -4.95 117.98 114.07 2dmb s PHE 97 Ca 0.67 -2.09 -0.30 0.00 -0.60 0.00 0.00 56.93 54.60 2dmb s PHE 97 Cb -0.16 -2.99 -0.09 0.00 0.51 0.00 0.00 43.02 40.29 2dmb s PHE 97 CO 0.57 -0.92 1.98 2.41 0.70 0.00 0.00 175.22 179.96 2dmb n THR 98 N 4.69 0.74 -3.73 0.64 -1.04 -1.26 -3.23 114.28 111.10 2dmb n THR 98 Ca -0.06 -0.15 -0.28 0.00 -2.04 0.00 0.00 64.05 61.53 2dmb n THR 98 Cb 0.42 -2.29 -0.16 0.00 -1.82 0.00 0.00 70.33 66.48 2dmb n THR 98 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 2dmb s VAL 99 N 4.57 0.49 -0.35 12.58 1.01 -0.93 -4.57 120.40 133.20 2dmb s VAL 99 Ca 0.90 -0.56 -0.19 0.00 0.00 0.00 0.00 61.98 62.13 2dmb s VAL 99 Cb -0.46 -1.02 -0.00 0.00 0.00 0.00 0.00 36.38 34.90 2dmb s VAL 99 CO 0.43 -0.23 0.56 -0.32 0.00 0.00 0.00 175.10 175.54 2dmb s MET 100 N 1.87 3.66 -0.36 2.72 1.75 -0.29 -1.33 119.30 127.32 2dmb s MET 100 Ca -0.01 -0.05 -0.17 0.00 -1.25 0.00 0.00 55.69 54.21 2dmb s MET 100 Cb -0.17 -3.80 -0.00 0.00 2.84 0.00 0.00 34.83 33.70 2dmb s MET 100 CO -0.09 -0.67 0.45 0.00 -0.65 0.00 0.00 175.02 174.07 2dmb s ALA 101 N 2.51 3.47 0.05 4.11 0.00 -0.99 -0.61 121.76 130.30 2dmb s ALA 101 Ca 0.21 -1.17 -0.09 0.00 0.00 0.00 0.00 51.96 50.91 2dmb s ALA 101 Cb -0.15 -2.96 -0.05 0.00 0.00 0.00 0.00 23.12 19.95 2dmb s ALA 101 CO 0.14 -1.25 0.35 0.95 0.00 0.00 0.00 175.76 175.95 2dmb s THR 102 N 2.23 5.17 0.36 0.00 -4.23 0.60 -2.06 115.64 117.70 2dmb s THR 102 Ca 0.15 0.37 0.10 0.00 -1.18 0.00 0.00 61.69 61.13 2dmb s THR 102 Cb -0.16 -3.62 0.11 0.00 1.34 0.00 0.00 72.50 70.17 2dmb s THR 102 CO 0.13 0.33 1.84 -0.78 -0.54 0.00 0.00 174.62 175.61 2dmb h ASP 103 N 3.87 0.16 -3.47 3.99 1.82 -1.94 -2.10 116.42 118.74 2dmb h ASP 103 Ca -0.50 -0.05 0.09 0.00 -0.39 0.00 0.00 57.03 56.18 2dmb h ASP 103 Cb 1.20 -0.04 -0.02 0.00 0.68 0.00 0.00 39.33 41.14 2dmb h ASP 103 CO 0.66 0.43 -0.11 0.61 -1.61 0.00 0.00 179.24 179.22 2dmb n GLY 104 N -0.61 -1.99 3.79 -0.78 0.00 -1.26 -4.65 105.19 99.69 2dmb n GLY 104 Ca -0.01 -1.36 -0.33 0.00 0.00 0.00 0.00 46.02 44.32 2dmb n GLY 104 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2dmb s GLU 105 N -0.90 3.02 -0.05 1.61 -1.05 -1.26 -5.07 118.70 115.00 2dmb s GLU 105 Ca 0.00 1.25 -0.11 0.00 -0.15 0.00 0.00 54.97 55.96 2dmb s GLU 105 Cb 0.00 -1.99 0.02 0.00 -0.44 0.00 0.00 34.13 31.72 2dmb s GLU 105 CO 0.00 -1.06 0.27 0.54 0.95 0.00 0.00 175.26 175.96 2dmb s VAL 106 N -2.50 0.04 -0.25 1.83 0.11 -1.26 -5.14 120.40 113.22 2dmb s VAL 106 Ca 0.64 -0.29 -0.02 0.00 -2.93 0.00 0.00 61.98 59.37 2dmb s VAL 106 Cb -0.18 -0.48 0.14 0.00 -1.53 0.00 0.00 36.38 34.34 2dmb s VAL 106 CO 0.42 -0.16 0.41 0.28 -3.33 0.00 0.00 175.10 172.72 2dmb s THR 107 N -0.65 -0.67 0.98 5.04 -1.32 -1.26 -5.15 115.64 112.61 2dmb s THR 107 Ca -0.07 -0.06 -0.15 0.00 -1.21 0.00 0.00 61.69 60.19 2dmb s THR 107 Cb -0.04 -0.84 -0.04 0.00 -1.51 0.00 0.00 72.50 70.07 2dmb s THR 107 CO 0.02 -0.11 -0.12 0.00 -2.21 0.00 0.00 174.62 172.20 2dmb n ALA 108 N 5.37 -3.85 -2.38 11.08 0.00 -1.26 -4.96 120.51 124.51 2dmb n ALA 108 Ca -0.03 -0.68 -0.29 0.00 0.00 0.00 0.00 53.44 52.43 2dmb n ALA 108 Cb 0.50 -1.51 -0.03 0.00 0.00 0.00 0.00 19.45 18.41 2dmb n ALA 108 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 2dmb s VAL 109 N -2.23 4.92 0.09 0.00 -7.23 -1.26 -5.01 120.40 109.69 2dmb s VAL 109 Ca 0.50 0.31 -0.33 0.00 -1.81 0.00 0.00 61.98 60.65 2dmb s VAL 109 Cb -0.19 -3.72 -0.12 0.00 0.56 0.00 0.00 36.38 32.91 2dmb s VAL 109 CO 0.73 -0.38 1.75 -1.84 -0.31 0.00 0.00 175.10 175.06 2dmb n GLU 110 N -1.01 2.44 -3.60 4.82 0.28 -1.26 -4.94 120.64 117.37 2dmb n GLU 110 Ca 0.00 0.89 -0.03 0.00 -0.16 0.00 0.00 57.16 57.86 2dmb n GLU 110 Cb 0.54 -2.72 -0.02 0.00 1.43 0.00 0.00 31.44 30.67 2dmb n GLU 110 CO 0.00 0.00 0.00 -1.83 -0.16 0.00 0.00 177.13 175.14 2dmb s GLU 111 N 2.31 0.45 -0.03 3.44 -1.05 -1.26 -5.17 118.70 117.39 2dmb s GLU 111 Ca 0.83 -0.20 0.07 0.00 -0.15 0.00 0.00 54.97 55.52 2dmb s GLU 111 Cb -0.60 0.18 -0.02 0.00 -0.44 0.00 0.00 34.13 33.26 2dmb s GLU 111 CO 0.40 -0.20 -0.23 0.00 0.95 0.00 0.00 175.26 176.18 2dmb s ALA 112 N -2.56 2.29 -0.01 -0.84 0.00 -1.26 -5.10 121.76 114.28 2dmb s ALA 112 Ca 0.10 -1.08 -0.30 0.00 0.00 0.00 0.00 51.96 50.68 2dmb s ALA 112 Cb 0.01 -0.66 -0.06 0.00 0.00 0.00 0.00 23.12 22.41 2dmb s ALA 112 CO -0.04 0.53 1.46 -1.25 0.00 0.00 0.00 175.76 176.45 2dmb s PRO 113 N -0.62 4.25 0.00 0.00 0.04 -1.26 -4.91 135.00 132.50 2dmb s PRO 113 Ca 0.10 2.02 -0.39 0.00 0.04 0.00 0.00 61.00 62.77 2dmb s PRO 113 Cb -0.10 -3.64 -0.19 0.00 0.04 0.00 0.00 34.50 30.60 2dmb s PRO 113 CO -0.00 -0.64 1.03 0.28 0.04 0.00 0.00 177.00 177.71 2dmb n VAL 114 N 4.83 0.00 -3.76 -0.36 0.31 -1.26 -4.91 118.33 113.18 2dmb n VAL 114 Ca 0.14 -0.00 -0.37 0.00 -0.01 0.00 0.00 64.34 64.10 2dmb n VAL 114 Cb 0.43 0.00 -0.12 0.00 -0.91 0.00 0.00 33.84 33.24 2dmb n VAL 114 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 2dmb s ASN 115 N -0.00 5.27 -0.30 4.52 4.22 -1.26 -5.03 114.94 122.36 2dmb s ASN 115 Ca 0.88 -1.64 -0.14 0.00 -2.14 0.00 0.00 52.86 49.81 2dmb s ASN 115 Cb -1.22 -1.84 0.16 0.00 1.28 0.00 0.00 41.25 39.63 2dmb s ASN 115 CO 0.55 -0.46 0.97 0.00 -2.04 0.00 0.00 177.10 176.12 2dmb s ALA 116 N 1.26 -2.70 -0.13 3.54 0.00 -1.26 -5.15 121.76 117.32 2dmb s ALA 116 Ca 0.03 2.04 -0.23 0.00 0.00 0.00 0.00 51.96 53.80 2dmb s ALA 116 Cb -0.22 -2.06 -0.03 0.00 0.00 0.00 0.00 23.12 20.81 2dmb s ALA 116 CO -0.01 -0.98 0.70 0.00 0.00 0.00 0.00 175.76 175.47 2dmb n PRO 118 N 4.51 -1.34 -3.77 0.00 -0.04 -1.26 -5.10 135.00 128.01 2dmb n PRO 118 Ca -0.00 -0.25 -0.13 0.00 -0.04 0.00 0.00 63.50 63.08 2dmb n PRO 118 Cb 0.50 -0.24 -0.10 0.00 -0.04 0.00 0.00 33.50 33.62 2dmb n PRO 118 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2dmb s SER 119 N -1.94 -0.29 0.01 3.54 1.04 -1.26 -5.17 113.70 109.63 2dmb s SER 119 Ca 0.10 0.51 0.00 0.00 0.48 0.00 0.00 55.95 57.04 2dmb s SER 119 Cb -0.01 0.57 -0.01 0.00 0.10 0.00 0.00 66.02 66.67 2dmb s SER 119 CO 0.08 -0.18 -0.02 -0.83 0.98 0.00 0.00 173.24 173.27 2dmb s GLY 120 N -0.15 0.16 0.78 7.32 0.00 -1.26 -5.16 107.32 109.01 2dmb s GLY 120 Ca -0.03 -0.36 -0.13 0.00 0.00 0.00 0.00 44.72 44.20 2dmb s GLY 120 CO 0.01 -0.40 0.69 -1.55 0.00 0.00 0.00 173.10 171.85 2dmb n PRO 121 N 2.19 -2.37 -3.65 2.90 -0.04 -1.26 -5.10 135.00 127.68 2dmb n PRO 121 Ca -0.19 -1.10 -0.01 0.00 -0.04 0.00 0.00 63.50 62.16 2dmb n PRO 121 Cb 0.57 -1.03 -0.06 0.00 -0.04 0.00 0.00 33.50 32.93 2dmb n PRO 121 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2dmb s SER 122 N -3.36 -0.23 0.07 3.54 0.15 -1.26 -5.07 113.70 107.55 2dmb s SER 122 Ca 0.45 0.38 -0.36 0.00 0.70 0.00 0.00 55.95 57.12 2dmb s SER 122 Cb -0.04 0.89 -0.19 0.00 -1.71 0.00 0.00 66.02 64.96 2dmb s SER 122 CO 0.34 -0.06 1.59 -1.28 1.20 0.00 0.00 173.24 175.03 2dmb h SER 123 N 4.93 -1.07 0.00 5.45 0.87 -2.11 -3.58 113.55 118.04 2dmb h SER 123 Ca -0.27 0.05 0.00 0.00 -1.23 0.00 0.00 61.79 60.34 2dmb h SER 123 Cb 1.18 0.30 0.00 0.00 -0.44 0.00 0.00 62.40 63.44 2dmb h SER 123 CO 0.20 -0.69 0.00 0.61 -0.53 0.00 0.00 176.83 176.42