#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 -1.19 -4.54 1.61 7.64 -1.26 -4.89 113.62 110.99 2dmb n SER 2 Ca 0.00 0.60 -0.43 0.00 1.01 0.00 0.00 58.87 60.05 2dmb n SER 2 Cb 0.00 -1.21 -0.05 0.00 -1.01 0.00 0.00 64.21 61.94 2dmb n SER 2 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2dmb s SER 3 N -1.46 6.40 0.24 6.43 0.15 -1.26 -4.94 113.70 119.26 2dmb s SER 3 Ca 0.66 -0.17 -0.14 0.00 0.70 0.00 0.00 55.95 56.99 2dmb s SER 3 Cb -0.35 -2.42 0.29 0.00 -1.71 0.00 0.00 66.02 61.83 2dmb s SER 3 CO 0.58 -1.06 1.50 0.61 1.20 0.00 0.00 173.24 176.07 2dmb n GLY 4 N 5.03 -1.89 3.08 9.45 0.00 -1.26 -3.98 105.19 115.61 2dmb n GLY 4 Ca 0.03 1.07 -0.32 0.00 0.00 0.00 0.00 46.02 46.80 2dmb n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dmb s SER 5 N -5.32 3.59 0.10 1.61 0.15 -1.26 -5.03 113.70 107.54 2dmb s SER 5 Ca -0.14 -0.93 -0.20 0.00 0.70 0.00 0.00 55.95 55.39 2dmb s SER 5 Cb 0.22 -1.45 -0.05 0.00 -1.71 0.00 0.00 66.02 63.03 2dmb s SER 5 CO 0.71 -0.09 1.34 -1.28 1.20 0.00 0.00 173.24 175.12 2dmb h SER 6 N 7.90 -1.36 -3.59 5.45 0.87 -2.02 -3.40 113.55 117.40 2dmb h SER 6 Ca -0.34 0.20 -0.49 0.00 -1.23 0.00 0.00 61.79 59.94 2dmb h SER 6 Cb 1.10 0.60 0.04 0.00 -0.44 0.00 0.00 62.40 63.70 2dmb h SER 6 CO 0.55 -0.15 0.13 -0.83 -0.53 0.00 0.00 176.83 175.99 2dmb s GLY 7 N -1.94 1.52 0.03 5.77 0.00 -1.26 -5.04 107.32 106.41 2dmb s GLY 7 Ca -0.08 -0.54 -0.04 0.00 0.00 0.00 0.00 44.72 44.06 2dmb s GLY 7 CO 0.39 -0.35 -0.08 -1.30 0.00 0.00 0.00 173.10 171.76 2dmb n THR 8 N -2.33 1.25 0.00 0.90 -2.24 -1.26 -5.06 114.28 105.55 2dmb n THR 8 Ca 0.01 0.33 0.00 0.00 -2.27 0.00 0.00 64.05 62.12 2dmb n THR 8 Cb 0.56 -1.75 0.00 0.00 -2.10 0.00 0.00 70.33 67.04 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 3.03 0.03 3.86 3.38 0.00 -1.26 -3.16 105.19 111.07 2dmb n GLY 9 Ca -0.04 0.73 -0.32 0.00 0.00 0.00 0.00 46.02 46.39 2dmb n GLY 9 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2dmb s ASP 10 N 0.00 6.69 -0.21 1.61 2.15 -0.55 -4.91 116.67 121.44 2dmb s ASP 10 Ca 0.00 1.04 -0.13 0.00 0.43 0.00 0.00 52.55 53.89 2dmb s ASP 10 Cb 0.00 -2.28 -0.19 0.00 -0.30 0.00 0.00 42.92 40.16 2dmb s ASP 10 CO 0.00 -0.10 0.03 0.00 -0.17 0.00 0.00 175.17 174.93 2dmb n ALA 11 N -0.15 1.01 0.23 3.66 0.00 -1.26 -4.17 120.51 119.83 2dmb n ALA 11 Ca 0.01 -0.76 0.14 0.00 0.00 0.00 0.00 53.44 52.83 2dmb n ALA 11 Cb 0.53 -0.34 0.55 0.00 0.00 0.00 0.00 19.45 20.19 2dmb n ALA 11 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2dmb h SER 12 N -0.62 0.00 0.13 0.00 0.87 -1.89 0.64 113.55 112.68 2dmb h SER 12 Ca -0.49 0.00 -0.27 0.00 -1.23 0.00 0.00 61.79 59.79 2dmb h SER 12 Cb 1.63 0.00 0.02 0.00 -0.44 0.00 0.00 62.40 63.61 2dmb h SER 12 CO -0.19 0.00 -1.11 0.11 -0.53 0.00 0.00 176.83 175.12 2dmb h LYS 13 N 0.00 0.61 -7.03 2.24 1.79 -1.96 -3.46 116.57 108.76 2dmb h LYS 13 Ca 0.09 -0.72 -0.53 0.00 -2.18 0.00 0.00 60.65 57.31 2dmb h LYS 13 Cb 1.33 0.22 0.20 0.00 -1.58 0.00 0.00 32.23 32.40 2dmb h LYS 13 CO -0.00 1.31 -0.11 0.00 -1.08 0.00 0.00 179.45 179.57 2dmb s LEU 15 N -3.88 2.48 -0.20 0.00 1.02 0.15 -4.99 118.68 113.26 2dmb s LEU 15 Ca 0.64 -0.94 -0.02 0.00 0.02 0.00 0.00 54.13 53.84 2dmb s LEU 15 Cb -0.24 -0.38 0.06 0.00 0.02 0.00 0.00 46.19 45.65 2dmb s LEU 15 CO 0.60 -0.28 0.00 0.00 0.02 0.00 0.00 176.35 176.69 2dmb s ALA 16 N -2.93 1.33 -0.12 4.21 0.00 -1.26 -1.34 121.76 121.65 2dmb s ALA 16 Ca 0.13 -0.90 0.01 0.00 0.00 0.00 0.00 51.96 51.20 2dmb s ALA 16 Cb 0.00 -1.25 0.02 0.00 0.00 0.00 0.00 23.12 21.89 2dmb s ALA 16 CO 0.01 -1.14 -0.15 0.95 0.00 0.00 0.00 175.76 175.43 2dmb s THR 17 N 1.70 1.55 0.00 0.00 -4.23 -1.09 -5.03 115.64 108.55 2dmb s THR 17 Ca -0.02 -0.66 0.00 0.00 -1.18 0.00 0.00 61.69 59.83 2dmb s THR 17 Cb -0.17 -1.43 0.00 0.00 1.34 0.00 0.00 72.50 72.24 2dmb s THR 17 CO -0.07 0.45 0.00 0.61 -0.54 0.00 0.00 174.62 175.07 2dmb n GLY 18 N 4.38 2.42 0.19 3.99 0.00 -1.26 -2.31 105.19 112.60 2dmb n GLY 18 Ca -0.18 -0.65 0.14 0.00 0.00 0.00 0.00 46.02 45.33 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 -0.19 1.61 0.13 -1.99 -3.11 132.00 128.45 2dmb h PRO 19 Ca 0.00 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 65.00 2dmb h PRO 19 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 2dmb h PRO 19 CO 0.00 0.00 -0.38 0.78 -0.23 0.00 0.00 178.00 178.17 2dmb h GLY 20 N 2.12 0.65 0.17 1.56 0.00 -1.90 -2.96 103.07 102.71 2dmb h GLY 20 Ca 0.00 -0.77 0.00 0.00 0.00 0.00 0.00 47.33 46.56 2dmb h GLY 20 CO 0.00 0.69 0.00 0.29 0.00 0.00 0.00 176.54 177.52 2dmb n ILE 21 N -4.27 0.01 -1.64 2.60 -5.35 -1.18 -4.90 119.36 104.64 2dmb n ILE 21 Ca -0.06 -0.01 -0.37 0.00 -0.27 0.00 0.00 62.75 62.04 2dmb n ILE 21 Cb 0.52 -0.09 0.06 0.00 -1.74 0.00 0.00 39.64 38.40 2dmb n ILE 21 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2dmb n ALA 22 N -0.57 0.48 -0.29 -1.28 0.00 -1.12 -4.86 120.51 112.88 2dmb n ALA 22 Ca 0.05 -0.02 0.19 0.00 0.00 0.00 0.00 53.44 53.66 2dmb n ALA 22 Cb 0.03 -2.19 0.47 0.00 0.00 0.00 0.00 19.45 17.76 2dmb n ALA 22 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 2dmb h SER 23 N 0.41 0.50 -4.66 0.00 0.02 -1.90 -3.42 113.55 104.49 2dmb h SER 23 Ca -0.49 0.07 -0.17 0.00 -0.84 0.00 0.00 61.79 60.35 2dmb h SER 23 Cb 1.36 -0.02 -0.22 0.00 0.14 0.00 0.00 62.40 63.65 2dmb h SER 23 CO 0.51 0.17 -0.60 0.42 -1.14 0.00 0.00 176.83 176.18 2dmb s THR 24 N -5.54 0.07 0.12 -2.27 -4.23 -1.26 -2.66 115.64 99.87 2dmb s THR 24 Ca -0.09 -0.60 -0.03 0.00 -1.18 0.00 0.00 61.69 59.80 2dmb s THR 24 Cb 0.24 -0.29 -0.03 0.00 1.34 0.00 0.00 72.50 73.76 2dmb s THR 24 CO 0.79 -0.33 0.09 0.68 -0.54 0.00 0.00 174.62 175.31 2dmb s VAL 25 N -1.04 0.12 -0.12 2.29 -7.23 0.70 -4.93 120.40 110.19 2dmb s VAL 25 Ca -0.11 -1.76 -0.11 0.00 -1.81 0.00 0.00 61.98 58.19 2dmb s VAL 25 Cb -0.07 -1.89 -0.05 0.00 0.56 0.00 0.00 36.38 34.94 2dmb s VAL 25 CO 0.00 -0.53 0.23 -0.75 -0.31 0.00 0.00 175.10 173.74 2dmb s LYS 26 N -4.00 3.85 0.74 4.82 2.36 -1.26 -2.11 119.74 124.14 2dmb s LYS 26 Ca 0.19 0.01 -0.15 0.00 -2.55 0.00 0.00 55.97 53.47 2dmb s LYS 26 Cb 0.07 -3.29 0.04 0.00 -1.05 0.00 0.00 37.83 33.60 2dmb s LYS 26 CO -0.01 0.55 1.25 0.95 1.55 0.00 0.00 175.35 179.64 2dmb s THR 27 N -0.45 2.03 0.00 3.43 -4.23 -1.06 -2.68 115.64 112.68 2dmb s THR 27 Ca 0.16 0.02 0.00 0.00 -1.18 0.00 0.00 61.69 60.69 2dmb s THR 27 Cb -0.13 -2.68 0.00 0.00 1.34 0.00 0.00 72.50 71.03 2dmb s THR 27 CO 0.05 -0.01 0.00 0.61 -0.54 0.00 0.00 174.62 174.73 2dmb n GLY 28 N 0.67 1.28 3.77 3.99 0.00 -0.21 -4.96 105.19 109.74 2dmb n GLY 28 Ca 0.15 -0.01 -0.41 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 4.21 -0.44 1.61 0.41 -1.09 -4.80 118.70 118.60 2dmb s GLU 29 Ca 0.00 2.42 -0.16 0.00 -0.41 0.00 0.00 54.97 56.82 2dmb s GLU 29 Cb 0.00 -3.03 0.04 0.00 -1.78 0.00 0.00 34.13 29.36 2dmb s GLU 29 CO 0.00 -0.42 0.37 -2.00 -0.49 0.00 0.00 175.26 172.72 2dmb s GLU 30 N -1.53 3.00 0.41 1.61 2.12 -1.26 -4.25 118.70 118.79 2dmb s GLU 30 Ca 0.54 -1.10 0.03 0.00 0.36 0.00 0.00 54.97 54.79 2dmb s GLU 30 Cb -0.44 -4.04 -0.00 0.00 0.26 0.00 0.00 34.13 29.90 2dmb s GLU 30 CO 0.55 -0.90 0.60 0.14 -0.54 0.00 0.00 175.26 175.11 2dmb s VAL 31 N 1.78 3.95 -0.29 3.70 -7.23 -1.07 -4.97 120.40 116.27 2dmb s VAL 31 Ca 0.06 -0.71 -0.01 0.00 -1.81 0.00 0.00 61.98 59.51 2dmb s VAL 31 Cb -0.21 -3.42 0.18 0.00 0.56 0.00 0.00 36.38 33.50 2dmb s VAL 31 CO 0.09 -0.24 0.58 -0.83 -0.31 0.00 0.00 175.10 174.39 2dmb s GLY 32 N -4.21 -0.95 0.16 2.32 0.00 -1.26 -2.38 107.32 100.99 2dmb s GLY 32 Ca 0.48 1.76 0.07 0.00 0.00 0.00 0.00 44.72 47.02 2dmb s GLY 32 CO 0.35 3.32 0.02 -0.11 0.00 0.00 0.00 173.10 176.67 2dmb s PHE 33 N 2.83 2.91 0.00 1.90 -0.71 0.39 -4.49 117.98 120.81 2dmb s PHE 33 Ca 0.20 -0.10 0.08 0.00 -1.04 0.00 0.00 56.93 56.07 2dmb s PHE 33 Cb -0.15 -1.42 -0.02 0.00 -1.21 0.00 0.00 43.02 40.22 2dmb s PHE 33 CO -0.21 0.51 -0.24 0.54 -1.34 0.00 0.00 175.22 174.49 2dmb s VAL 34 N -1.66 1.90 -0.36 -2.49 0.11 -0.98 -0.17 120.40 116.75 2dmb s VAL 34 Ca 0.28 -1.12 -0.18 0.00 -2.93 0.00 0.00 61.98 58.02 2dmb s VAL 34 Cb -0.10 -1.60 0.00 0.00 -1.53 0.00 0.00 36.38 33.16 2dmb s VAL 34 CO 0.19 0.45 0.53 -0.69 -3.33 0.00 0.00 175.10 172.25 2dmb s VAL 35 N -0.64 4.99 -0.16 2.04 1.01 -0.43 -2.66 120.40 124.55 2dmb s VAL 35 Ca 0.09 0.30 -0.09 0.00 0.00 0.00 0.00 61.98 62.28 2dmb s VAL 35 Cb -0.09 -4.00 -0.05 0.00 0.00 0.00 0.00 36.38 32.24 2dmb s VAL 35 CO 0.00 -0.27 0.16 -0.62 0.00 0.00 0.00 175.10 174.37 2dmb s ASP 36 N 1.79 6.32 -0.11 3.32 2.15 -0.45 -3.17 116.67 126.53 2dmb s ASP 36 Ca 0.19 0.38 0.03 0.00 0.43 0.00 0.00 52.55 53.57 2dmb s ASP 36 Cb -0.15 -2.10 0.01 0.00 -0.30 0.00 0.00 42.92 40.38 2dmb s ASP 36 CO 0.14 0.26 -0.20 0.00 -0.17 0.00 0.00 175.17 175.20 2dmb s ALA 37 N -0.20 1.98 -0.14 3.66 0.00 -1.26 0.32 121.76 126.12 2dmb s ALA 37 Ca 0.12 -0.89 -0.12 0.00 0.00 0.00 0.00 51.96 51.07 2dmb s ALA 37 Cb -0.12 -0.85 -0.04 0.00 0.00 0.00 0.00 23.12 22.11 2dmb s ALA 37 CO 0.01 0.08 -0.23 1.63 0.00 0.00 0.00 175.76 177.25 2dmb n LYS 38 N 3.90 0.43 -0.00 0.00 5.02 -1.26 -4.75 118.16 121.50 2dmb n LYS 38 Ca -0.20 0.34 0.01 0.00 -2.02 0.00 0.00 58.31 56.44 2dmb n LYS 38 Cb 0.52 -1.46 0.01 0.00 -0.02 0.00 0.00 35.03 34.08 2dmb n LYS 38 CO 0.00 0.00 0.00 -2.37 -0.52 0.00 0.00 177.40 174.51 2dmb n THR 39 N -4.29 0.22 -0.31 -0.18 5.66 -1.26 -4.74 114.28 109.38 2dmb n THR 39 Ca -0.09 -0.61 0.12 0.00 -3.05 0.00 0.00 64.05 60.42 2dmb n THR 39 Cb 0.34 0.91 0.27 0.00 -1.55 0.00 0.00 70.33 70.30 2dmb n THR 39 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2dmb h ALA 40 N 0.20 1.15 0.00 1.79 0.00 -1.84 -3.44 119.26 117.11 2dmb h ALA 40 Ca 0.00 0.28 0.00 0.00 0.00 0.00 0.00 54.91 55.19 2dmb h ALA 40 Cb 0.15 0.46 0.00 0.00 0.00 0.00 0.00 17.79 18.40 2dmb h ALA 40 CO 0.00 -0.52 0.00 0.41 0.00 0.00 0.00 179.25 179.14 2dmb n GLY 41 N -1.44 0.97 3.91 0.00 0.00 -1.26 -1.48 105.19 105.90 2dmb n GLY 41 Ca 0.21 -1.34 -0.30 0.00 0.00 0.00 0.00 46.02 44.59 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 3.39 0.00 1.61 2.47 -1.19 -5.02 119.74 121.00 2dmb s LYS 42 Ca 0.00 -0.51 0.00 0.00 -1.56 0.00 0.00 55.97 53.90 2dmb s LYS 42 Cb 0.00 -2.99 0.00 0.00 -1.46 0.00 0.00 37.83 33.38 2dmb s LYS 42 CO 0.00 0.58 0.00 0.41 0.16 0.00 0.00 175.35 176.50 2dmb n GLY 43 N 0.08 3.30 3.73 5.54 0.00 -1.26 -4.29 105.19 112.29 2dmb n GLY 43 Ca -0.06 -0.94 -0.35 0.00 0.00 0.00 0.00 46.02 44.67 2dmb n GLY 43 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2dmb s LYS 44 N -2.10 3.62 -0.53 1.61 0.00 -1.26 -4.50 119.74 116.59 2dmb s LYS 44 Ca 0.00 -0.28 -0.15 0.00 0.00 0.00 0.00 55.97 55.54 2dmb s LYS 44 Cb 0.00 -3.14 0.12 0.00 0.00 0.00 0.00 37.83 34.81 2dmb s LYS 44 CO 0.00 0.53 0.47 0.08 0.00 0.00 0.00 175.35 176.43 2dmb s VAL 45 N -0.34 5.14 -0.04 1.79 1.01 -1.25 -1.72 120.40 124.98 2dmb s VAL 45 Ca 0.09 -1.46 0.01 0.00 0.00 0.00 0.00 61.98 60.62 2dmb s VAL 45 Cb -0.12 -4.27 -0.03 0.00 0.00 0.00 0.00 36.38 31.96 2dmb s VAL 45 CO 0.02 -0.82 -0.03 0.42 0.00 0.00 0.00 175.10 174.68 2dmb s THR 46 N 1.59 3.98 0.09 3.92 -4.23 -1.03 -4.98 115.64 114.98 2dmb s THR 46 Ca 0.03 -0.49 0.09 0.00 -1.18 0.00 0.00 61.69 60.14 2dmb s THR 46 Cb -0.29 -2.69 -0.03 0.00 1.34 0.00 0.00 72.50 70.82 2dmb s THR 46 CO 0.03 0.51 -0.24 0.00 -0.54 0.00 0.00 174.62 174.39 2dmb s THR 48 N -1.01 -0.24 -0.28 0.00 2.01 -1.12 -4.72 115.64 110.27 2dmb s THR 48 Ca 0.10 -0.37 -0.29 0.00 0.31 0.00 0.00 61.69 61.44 2dmb s THR 48 Cb -0.10 -0.81 0.01 0.00 0.01 0.00 0.00 72.50 71.61 2dmb s THR 48 CO 0.04 -0.41 1.10 -0.69 -0.69 0.00 0.00 174.62 173.97 2dmb s VAL 49 N 2.25 4.51 -0.35 3.82 1.01 -1.26 -2.16 120.40 128.22 2dmb s VAL 49 Ca 0.07 1.78 -0.11 0.00 0.00 0.00 0.00 61.98 63.72 2dmb s VAL 49 Cb -0.15 -4.33 0.00 0.00 0.00 0.00 0.00 36.38 31.90 2dmb s VAL 49 CO -0.23 -0.36 0.20 -0.22 0.00 0.00 0.00 175.10 174.50 2dmb s LEU 50 N 3.56 4.48 0.55 3.92 2.96 -0.05 -0.35 118.68 133.75 2dmb s LEU 50 Ca 0.47 -0.68 -0.19 0.00 -0.22 0.00 0.00 54.13 53.51 2dmb s LEU 50 Cb -0.14 -2.05 -0.05 0.00 0.50 0.00 0.00 46.19 44.44 2dmb s LEU 50 CO 0.13 -0.29 1.12 0.42 -1.32 0.00 0.00 176.35 176.41 2dmb s THR 51 N 1.63 3.26 -2.00 3.68 -4.23 0.25 -1.54 115.64 116.68 2dmb s THR 51 Ca 0.04 0.75 0.11 0.00 -1.18 0.00 0.00 61.69 61.42 2dmb s THR 51 Cb -0.18 -3.29 0.32 0.00 1.34 0.00 0.00 72.50 70.69 2dmb s THR 51 CO 0.08 -0.20 1.11 -0.81 -0.54 0.00 0.00 174.62 174.26 2dmb n PRO 52 N -1.40 0.49 0.09 3.99 -0.04 -1.26 -2.21 135.00 134.65 2dmb n PRO 52 Ca 0.11 0.00 0.08 0.00 -0.04 0.00 0.00 63.50 63.65 2dmb n PRO 52 Cb 0.51 -1.36 -0.02 0.00 -0.04 0.00 0.00 33.50 32.59 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 3.32 -1.93 -3.48 116.42 117.87 2dmb h ASP 53 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2dmb h ASP 53 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 2dmb h ASP 53 CO 0.00 0.18 0.00 0.61 -1.72 0.00 0.00 179.24 178.31 2dmb n GLY 54 N 1.24 1.52 3.30 2.75 0.00 -0.94 -5.13 105.19 107.94 2dmb n GLY 54 Ca -0.03 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.83 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 0.92 0.30 2.61 -4.23 -1.25 -4.99 115.64 107.00 2dmb s THR 55 Ca 0.00 -2.02 0.08 0.00 -1.18 0.00 0.00 61.69 58.57 2dmb s THR 55 Cb 0.00 -2.28 -0.04 0.00 1.34 0.00 0.00 72.50 71.53 2dmb s THR 55 CO 0.00 -0.37 0.14 -1.83 -0.54 0.00 0.00 174.62 172.02 2dmb s GLU 56 N -3.88 2.54 0.31 3.99 4.04 -1.26 0.85 118.70 125.29 2dmb s GLU 56 Ca 0.27 -1.35 0.01 0.00 0.04 0.00 0.00 54.97 53.94 2dmb s GLU 56 Cb 0.06 -2.31 -0.00 0.00 0.02 0.00 0.00 34.13 31.89 2dmb s GLU 56 CO 0.07 0.25 0.04 0.00 -1.84 0.00 0.00 175.26 173.79 2dmb n ALA 57 N -1.12 0.33 -2.78 -0.84 0.00 0.53 -4.88 120.51 111.75 2dmb n ALA 57 Ca -0.05 -1.48 -0.35 0.00 0.00 0.00 0.00 53.44 51.56 2dmb n ALA 57 Cb 0.60 0.89 -0.08 0.00 0.00 0.00 0.00 19.45 20.85 2dmb n ALA 57 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 2dmb s GLU 58 N -3.15 3.91 -0.07 0.00 1.03 -1.26 -4.22 118.70 114.94 2dmb s GLU 58 Ca 0.06 -0.23 0.04 0.00 0.03 0.00 0.00 54.97 54.87 2dmb s GLU 58 Cb 0.00 -3.30 -0.02 0.00 -0.80 0.00 0.00 34.13 30.02 2dmb s GLU 58 CO 0.04 0.43 -0.18 0.00 -1.33 0.00 0.00 175.26 174.23 2dmb s ALA 59 N -0.05 2.48 -0.20 -0.84 0.00 -1.26 -4.97 121.76 116.92 2dmb s ALA 59 Ca 0.09 -0.99 -0.29 0.00 0.00 0.00 0.00 51.96 50.77 2dmb s ALA 59 Cb -0.12 -0.91 -0.01 0.00 0.00 0.00 0.00 23.12 22.08 2dmb s ALA 59 CO 0.00 0.45 1.31 -0.51 0.00 0.00 0.00 175.76 177.01 2dmb s ASP 60 N -0.33 6.83 -0.09 0.00 1.01 -1.20 -4.93 116.67 117.97 2dmb s ASP 60 Ca 0.02 1.60 0.03 0.00 0.71 0.00 0.00 52.55 54.91 2dmb s ASP 60 Cb -0.13 -2.54 -0.01 0.00 1.01 0.00 0.00 42.92 41.25 2dmb s ASP 60 CO 0.02 -0.88 -0.19 -0.69 0.21 0.00 0.00 175.17 173.65 2dmb s VAL 61 N 3.84 2.55 -0.02 -1.27 1.01 -1.26 -2.69 120.40 122.56 2dmb s VAL 61 Ca 0.57 -0.87 0.01 0.00 0.00 0.00 0.00 61.98 61.69 2dmb s VAL 61 Cb -0.21 -2.00 0.01 0.00 0.00 0.00 0.00 36.38 34.18 2dmb s VAL 61 CO 0.18 0.56 -0.04 -0.63 0.00 0.00 0.00 175.10 175.17 2dmb s ILE 62 N -0.01 0.44 0.26 2.22 1.09 -0.61 -4.98 121.20 119.61 2dmb s ILE 62 Ca -0.06 -0.14 -0.08 0.00 -1.10 0.00 0.00 60.65 59.27 2dmb s ILE 62 Cb -0.15 -0.44 -0.06 0.00 -1.06 0.00 0.00 42.46 40.75 2dmb s ILE 62 CO 0.05 0.17 0.56 -1.83 -0.10 0.00 0.00 174.94 173.79 2dmb s GLU 63 N 0.49 3.73 0.14 2.79 -1.05 -1.26 -0.77 118.70 122.77 2dmb s GLU 63 Ca -0.06 0.18 0.06 0.00 -0.15 0.00 0.00 54.97 55.00 2dmb s GLU 63 Cb -0.09 -2.63 -0.04 0.00 -0.44 0.00 0.00 34.13 30.93 2dmb s GLU 63 CO -0.00 0.25 -0.14 -0.80 0.95 0.00 0.00 175.26 175.52 2dmb s ASN 64 N -2.73 2.15 0.45 0.83 0.01 0.01 -4.95 114.94 110.71 2dmb s ASN 64 Ca 0.46 -0.86 0.30 0.00 -0.71 0.00 0.00 52.86 52.06 2dmb s ASN 64 Cb -0.11 -0.08 1.59 0.00 0.41 0.00 0.00 41.25 43.06 2dmb s ASN 64 CO 0.25 -0.14 1.92 1.05 -1.51 0.00 0.00 177.10 178.67 2dmb h GLU 65 N 3.32 0.00 -1.05 -0.60 9.09 -1.99 -1.79 114.58 121.56 2dmb h GLU 65 Ca -0.40 0.00 -0.28 0.00 0.05 0.00 0.00 59.36 58.74 2dmb h GLU 65 Cb 1.20 0.00 -0.16 0.00 -1.65 0.00 0.00 28.75 28.14 2dmb h GLU 65 CO 0.53 0.00 0.35 -0.25 0.05 0.00 0.00 179.01 179.69 2dmb n ASP 66 N -2.58 3.71 -2.25 3.06 8.00 -1.26 -4.83 116.55 120.40 2dmb n ASP 66 Ca -0.02 -2.86 -0.11 0.00 0.71 0.00 0.00 54.79 52.52 2dmb n ASP 66 Cb 0.08 -0.71 -0.01 0.00 -0.02 0.00 0.00 41.12 40.45 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 -0.29 -0.23 3.73 0.44 0.00 -0.68 -4.80 105.19 103.36 2dmb n GLY 67 Ca 0.31 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.10 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 -2.41 3.00 -0.05 2.61 -4.23 -1.23 -4.54 115.64 108.79 2dmb s THR 68 Ca 0.00 -1.71 -0.02 0.00 -1.18 0.00 0.00 61.69 58.78 2dmb s THR 68 Cb 0.00 -2.97 0.03 0.00 1.34 0.00 0.00 72.50 70.90 2dmb s THR 68 CO 0.00 -0.19 0.04 -0.31 -0.54 0.00 0.00 174.62 173.62 2dmb s TYR 69 N -2.43 0.27 -0.09 3.99 1.51 -1.19 -0.81 117.35 118.61 2dmb s TYR 69 Ca 0.37 0.10 -0.18 0.00 -1.01 0.00 0.00 57.07 56.36 2dmb s TYR 69 Cb -0.02 -0.58 -0.05 0.00 -0.11 0.00 0.00 41.96 41.20 2dmb s TYR 69 CO 0.22 -0.23 0.47 0.34 -1.11 0.00 0.00 175.55 175.24 2dmb s ASP 70 N 2.03 6.72 0.02 2.29 -1.08 0.05 -1.32 116.67 125.40 2dmb s ASP 70 Ca 0.04 0.86 0.05 0.00 -0.52 0.00 0.00 52.55 52.98 2dmb s ASP 70 Cb -0.12 -2.28 -0.02 0.00 -1.46 0.00 0.00 42.92 39.04 2dmb s ASP 70 CO -0.04 0.07 -0.15 -0.63 0.52 0.00 0.00 175.17 174.94 2dmb s ILE 71 N 0.26 1.22 0.04 4.11 1.01 0.76 -1.57 121.20 127.03 2dmb s ILE 71 Ca 0.26 -0.92 0.01 0.00 0.00 0.00 0.00 60.65 59.99 2dmb s ILE 71 Cb -0.16 -1.07 -0.02 0.00 0.01 0.00 0.00 42.46 41.22 2dmb s ILE 71 CO 0.11 0.14 -0.05 -0.36 0.00 0.00 0.00 174.94 174.78 2dmb s PHE 72 N -0.69 0.48 0.20 3.97 0.40 -1.09 -0.46 117.98 120.78 2dmb s PHE 72 Ca 0.04 -0.58 -0.22 0.00 -0.60 0.00 0.00 56.93 55.57 2dmb s PHE 72 Cb -0.07 -0.31 0.05 0.00 0.51 0.00 0.00 43.02 43.20 2dmb s PHE 72 CO 0.01 -0.16 0.62 1.52 0.70 0.00 0.00 175.22 177.91 2dmb s TYR 73 N -1.73 -0.39 0.06 0.36 -0.85 -1.00 -3.22 117.35 110.57 2dmb s TYR 73 Ca -0.10 0.10 0.05 0.00 -0.52 0.00 0.00 57.07 56.59 2dmb s TYR 73 Cb -0.08 0.58 -0.03 0.00 0.38 0.00 0.00 41.96 42.81 2dmb s TYR 73 CO -0.01 -0.96 -0.13 0.99 -1.52 0.00 0.00 175.55 173.92 2dmb s THR 74 N -3.81 1.01 -0.57 -3.49 2.01 -1.26 -2.58 115.64 106.94 2dmb s THR 74 Ca 0.05 -1.18 0.03 0.00 0.31 0.00 0.00 61.69 60.90 2dmb s THR 74 Cb -0.02 -0.97 0.14 0.00 0.01 0.00 0.00 72.50 71.66 2dmb s THR 74 CO -0.06 -0.19 0.33 0.00 -0.69 0.00 0.00 174.62 174.01 2dmb s ALA 75 N -1.17 3.45 0.08 7.40 0.00 -1.26 -4.97 121.76 125.29 2dmb s ALA 75 Ca -0.02 -3.38 -0.35 0.00 0.00 0.00 0.00 51.96 48.20 2dmb s ALA 75 Cb -0.09 -2.25 -0.18 0.00 0.00 0.00 0.00 23.12 20.60 2dmb s ALA 75 CO 0.02 -2.05 1.58 0.00 0.00 0.00 0.00 175.76 175.31 2dmb h ALA 76 N 6.38 -1.12 -2.80 0.00 0.00 -1.93 -0.53 119.26 119.25 2dmb h ALA 76 Ca -0.03 -0.21 -0.61 0.00 0.00 0.00 0.00 54.91 54.06 2dmb h ALA 76 Cb 0.88 0.62 -0.04 0.00 0.00 0.00 0.00 17.79 19.24 2dmb h ALA 76 CO 0.70 -1.16 -0.42 0.15 0.00 0.00 0.00 179.25 178.53 2dmb s LYS 77 N -5.94 3.53 0.83 0.00 3.01 -1.26 -4.34 119.74 115.57 2dmb s LYS 77 Ca -0.18 -0.24 -0.11 0.00 -1.01 0.00 0.00 55.97 54.43 2dmb s LYS 77 Cb 0.04 -2.99 0.09 0.00 -1.01 0.00 0.00 37.83 33.96 2dmb s LYS 77 CO 0.61 0.58 1.09 -1.25 0.51 0.00 0.00 175.35 176.89 2dmb s PRO 78 N -2.35 1.80 0.00 -1.68 0.04 -1.26 -4.94 135.00 126.61 2dmb s PRO 78 Ca 0.35 1.01 0.00 0.00 0.04 0.00 0.00 61.00 62.39 2dmb s PRO 78 Cb -0.13 -1.86 0.00 0.00 0.04 0.00 0.00 34.50 32.56 2dmb s PRO 78 CO 0.24 -1.92 0.00 0.41 0.04 0.00 0.00 177.00 175.77 2dmb n GLY 79 N -1.18 0.47 3.06 0.56 0.00 -0.00 -4.93 105.19 103.16 2dmb n GLY 79 Ca 0.08 -1.60 -0.34 0.00 0.00 0.00 0.00 46.02 44.16 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 -3.05 3.05 0.36 2.61 2.01 -1.26 -1.19 115.64 118.17 2dmb s THR 80 Ca 0.00 -2.62 -0.24 0.00 0.31 0.00 0.00 61.69 59.14 2dmb s THR 80 Cb 0.00 -3.09 -0.10 0.00 0.01 0.00 0.00 72.50 69.32 2dmb s THR 80 CO 0.00 -0.74 0.94 -0.31 -0.69 0.00 0.00 174.62 173.82 2dmb s TYR 81 N 0.47 3.54 -0.22 4.92 1.51 0.09 -4.22 117.35 123.44 2dmb s TYR 81 Ca 0.13 1.71 0.01 0.00 -1.01 0.00 0.00 57.07 57.91 2dmb s TYR 81 Cb -0.22 -2.89 0.05 0.00 -0.11 0.00 0.00 41.96 38.79 2dmb s TYR 81 CO -0.04 0.09 -0.08 0.08 -1.11 0.00 0.00 175.55 174.48 2dmb s VAL 82 N -1.84 1.69 -0.26 0.71 1.01 -0.59 -1.53 120.40 119.60 2dmb s VAL 82 Ca 0.55 -1.21 -0.11 0.00 0.00 0.00 0.00 61.98 61.21 2dmb s VAL 82 Cb -0.15 -1.85 -0.05 0.00 0.00 0.00 0.00 36.38 34.33 2dmb s VAL 82 CO 0.19 0.02 0.19 -0.63 0.00 0.00 0.00 175.10 174.87 2dmb s ILE 83 N 1.34 5.33 -0.36 2.22 1.01 -1.07 -0.87 121.20 128.79 2dmb s ILE 83 Ca -0.05 0.19 -0.17 0.00 0.00 0.00 0.00 60.65 60.63 2dmb s ILE 83 Cb -0.18 -3.53 -0.00 0.00 0.01 0.00 0.00 42.46 38.76 2dmb s ILE 83 CO -0.07 0.29 0.43 -0.31 0.00 0.00 0.00 174.94 175.28 2dmb s TYR 84 N 1.48 3.19 -0.16 3.97 2.02 -0.92 -1.65 117.35 125.28 2dmb s TYR 84 Ca 0.08 -0.04 -0.05 0.00 -0.37 0.00 0.00 57.07 56.69 2dmb s TYR 84 Cb -0.15 -2.80 -0.04 0.00 -0.40 0.00 0.00 41.96 38.57 2dmb s TYR 84 CO 0.08 -0.53 0.03 0.08 -1.57 0.00 0.00 175.55 173.64 2dmb s VAL 85 N 2.17 4.49 0.02 0.71 1.01 -1.26 -2.81 120.40 124.73 2dmb s VAL 85 Ca 0.14 -0.15 0.02 0.00 0.00 0.00 0.00 61.98 61.99 2dmb s VAL 85 Cb -0.16 -2.99 -0.02 0.00 0.00 0.00 0.00 36.38 33.21 2dmb s VAL 85 CO 0.13 0.50 -0.07 -0.60 0.00 0.00 0.00 175.10 175.06 2dmb s ARG 86 N 0.11 0.51 -0.18 2.72 3.52 -1.10 -3.38 118.95 121.15 2dmb s ARG 86 Ca 0.03 -0.53 -0.02 0.00 -0.13 0.00 0.00 55.73 55.09 2dmb s ARG 86 Cb -0.13 -0.38 0.05 0.00 -1.56 0.00 0.00 34.95 32.94 2dmb s ARG 86 CO 0.01 0.09 -0.01 0.12 -0.81 0.00 0.00 175.30 174.70 2dmb s PHE 87 N -0.84 1.36 -0.08 5.12 2.19 -1.09 -2.46 117.98 122.17 2dmb s PHE 87 Ca -0.04 -0.96 0.00 0.00 0.33 0.00 0.00 56.93 56.26 2dmb s PHE 87 Cb -0.07 -1.15 0.00 0.00 -1.31 0.00 0.00 43.02 40.49 2dmb s PHE 87 CO 0.00 -0.60 0.00 0.41 1.83 0.00 0.00 175.22 176.86 2dmb n GLY 88 N 4.96 0.25 0.20 13.12 0.00 -0.70 -2.24 105.19 120.79 2dmb n GLY 88 Ca -0.10 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 45.90 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 -0.51 1.45 2.62 -0.02 0.00 -1.26 -4.80 105.19 102.67 2dmb n GLY 89 Ca -0.01 -0.10 -0.27 0.00 0.00 0.00 0.00 46.02 45.64 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 0.04 0.07 1.61 1.01 -0.95 -5.11 120.40 115.06 2dmb s VAL 90 Ca 0.00 -0.38 -0.32 0.00 0.00 0.00 0.00 61.98 61.29 2dmb s VAL 90 Cb 0.00 -0.76 -0.11 0.00 0.00 0.00 0.00 36.38 35.52 2dmb s VAL 90 CO 0.00 -0.37 1.87 -0.67 0.00 0.00 0.00 175.10 175.93 2dmb n ASP 91 N 5.22 3.92 -4.64 3.32 2.03 -1.26 -2.67 116.55 122.48 2dmb n ASP 91 Ca -0.07 0.97 -0.33 0.00 0.52 0.00 0.00 54.79 55.88 2dmb n ASP 91 Cb 0.47 -1.50 0.14 0.00 -0.72 0.00 0.00 41.12 39.51 2dmb n ASP 91 CO 0.00 0.00 0.00 2.30 -1.92 0.00 0.00 177.20 177.58 2dmb n ILE 92 N 4.92 0.99 0.98 5.18 -5.35 -1.22 -4.85 119.36 120.02 2dmb n ILE 92 Ca 0.19 -0.13 0.05 0.00 -0.27 0.00 0.00 62.75 62.59 2dmb n ILE 92 Cb 0.36 -1.03 0.32 0.00 -1.74 0.00 0.00 39.64 37.55 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 -3.33 0.49 0.00 6.28 -0.04 -1.26 -1.80 135.00 135.33 2dmb n PRO 93 Ca 0.12 0.00 0.07 0.00 -0.04 0.00 0.00 63.50 63.65 2dmb n PRO 93 Cb 0.51 -1.34 -0.08 0.00 -0.04 0.00 0.00 33.50 32.55 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 0.79 -4.85 3.54 3.02 -1.26 -4.98 115.26 110.68 2dmb n ASN 94 Ca 0.08 -0.89 -0.33 0.00 -0.03 0.00 0.00 54.58 53.41 2dmb n ASN 94 Cb 0.04 0.97 -0.06 0.00 -0.61 0.00 0.00 39.78 40.12 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 -2.45 6.76 1.16 6.41 0.15 -0.75 -4.22 113.70 120.76 2dmb s SER 95 Ca 0.06 1.21 -0.13 0.00 0.70 0.00 0.00 55.95 57.79 2dmb s SER 95 Cb 0.12 -2.34 0.19 0.00 -1.71 0.00 0.00 66.02 62.28 2dmb s SER 95 CO 0.63 -0.16 0.68 -0.81 1.20 0.00 0.00 173.24 174.78 2dmb n PRO 96 N -0.22 -2.35 -3.89 5.44 -0.04 -1.26 -4.95 135.00 127.73 2dmb n PRO 96 Ca 0.02 -1.08 -0.34 0.00 -0.04 0.00 0.00 63.50 62.06 2dmb n PRO 96 Cb 0.53 -1.02 -0.13 0.00 -0.04 0.00 0.00 33.50 32.84 2dmb n PRO 96 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 2dmb s PHE 97 N -2.22 3.59 -0.31 0.54 0.40 -0.66 -4.97 117.98 114.35 2dmb s PHE 97 Ca 0.44 -2.53 -0.29 0.00 -0.60 0.00 0.00 56.93 53.95 2dmb s PHE 97 Cb -0.04 -2.91 -0.01 0.00 0.51 0.00 0.00 43.02 40.56 2dmb s PHE 97 CO 0.34 -0.94 1.59 0.99 0.70 0.00 0.00 175.22 177.90 2dmb s THR 98 N 1.08 3.72 -0.24 0.64 2.01 -1.26 -2.61 115.64 118.97 2dmb s THR 98 Ca 0.06 0.77 0.02 0.00 0.31 0.00 0.00 61.69 62.85 2dmb s THR 98 Cb -0.21 -3.86 0.06 0.00 0.01 0.00 0.00 72.50 68.50 2dmb s THR 98 CO -0.05 -0.47 -0.09 -0.69 -0.69 0.00 0.00 174.62 172.63 2dmb s VAL 99 N 5.71 1.89 -0.26 3.82 1.01 -0.58 -4.65 120.40 127.35 2dmb s VAL 99 Ca 0.70 -1.43 -0.19 0.00 0.00 0.00 0.00 61.98 61.07 2dmb s VAL 99 Cb -0.20 -2.05 -0.02 0.00 0.00 0.00 0.00 36.38 34.10 2dmb s VAL 99 CO 0.31 -0.03 0.57 -0.32 0.00 0.00 0.00 175.10 175.63 2dmb s MET 100 N 1.23 4.08 -0.25 2.72 1.75 -1.09 -0.73 119.30 127.01 2dmb s MET 100 Ca -0.07 0.41 -0.05 0.00 -1.25 0.00 0.00 55.69 54.73 2dmb s MET 100 Cb -0.19 -3.65 -0.00 0.00 2.84 0.00 0.00 34.83 33.82 2dmb s MET 100 CO -0.06 -0.39 0.01 0.00 -0.65 0.00 0.00 175.02 173.93 2dmb s ALA 101 N 2.40 2.92 0.14 4.11 0.00 -0.33 -0.21 121.76 130.79 2dmb s ALA 101 Ca 0.23 -1.28 0.06 0.00 0.00 0.00 0.00 51.96 50.97 2dmb s ALA 101 Cb -0.16 -1.88 -0.04 0.00 0.00 0.00 0.00 23.12 21.04 2dmb s ALA 101 CO 0.09 -0.63 -0.13 -0.08 0.00 0.00 0.00 175.76 175.01 2dmb s THR 102 N 1.48 1.33 -0.12 0.00 -1.32 -0.90 -0.82 115.64 115.30 2dmb s THR 102 Ca 0.04 -1.91 0.18 0.00 -1.21 0.00 0.00 61.69 58.80 2dmb s THR 102 Cb -0.15 -1.71 -0.27 0.00 -1.51 0.00 0.00 72.50 68.86 2dmb s THR 102 CO -0.01 -0.56 0.22 -0.67 -2.21 0.00 0.00 174.62 171.40 2dmb n ASP 103 N 0.15 0.30 0.00 8.08 2.03 -1.26 -2.56 116.55 123.29 2dmb n ASP 103 Ca -0.13 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.18 2dmb n ASP 103 Cb 0.59 1.36 0.00 0.00 -0.72 0.00 0.00 41.12 42.35 2dmb n ASP 103 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2dmb n GLY 104 N 1.63 2.38 2.67 0.27 0.00 -1.26 -4.60 105.19 106.29 2dmb n GLY 104 Ca -0.20 -0.03 -0.32 0.00 0.00 0.00 0.00 46.02 45.46 2dmb n GLY 104 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2dmb n GLU 105 N 14.00 0.00 -4.36 1.61 1.02 -1.26 -4.97 120.64 126.68 2dmb n GLU 105 Ca 0.00 0.00 -0.25 0.00 -0.02 0.00 0.00 57.16 56.89 2dmb n GLU 105 Cb 0.00 -0.85 -0.17 0.00 -0.02 0.00 0.00 31.44 30.40 2dmb n GLU 105 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 2dmb s VAL 106 N -1.70 1.09 -0.03 2.62 -7.23 -1.26 -5.12 120.40 108.77 2dmb s VAL 106 Ca 0.43 -0.41 -0.30 0.00 -1.81 0.00 0.00 61.98 59.88 2dmb s VAL 106 Cb -0.32 -1.03 -0.03 0.00 0.56 0.00 0.00 36.38 35.57 2dmb s VAL 106 CO 0.62 0.36 0.98 -0.89 -0.31 0.00 0.00 175.10 175.85 2dmb s THR 107 N 0.98 4.85 0.14 5.32 2.01 -1.26 -4.96 115.64 122.72 2dmb s THR 107 Ca -0.09 2.04 -0.31 0.00 0.31 0.00 0.00 61.69 63.65 2dmb s THR 107 Cb -0.15 -4.31 -0.07 0.00 0.01 0.00 0.00 72.50 67.99 2dmb s THR 107 CO -0.00 0.12 1.56 0.00 -0.69 0.00 0.00 174.62 175.61 2dmb h ALA 108 N 6.88 -0.65 -2.33 7.40 0.00 -2.06 -3.43 119.26 125.08 2dmb h ALA 108 Ca -0.38 0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.48 2dmb h ALA 108 Cb 1.20 1.05 -0.23 0.00 0.00 0.00 0.00 17.79 19.82 2dmb h ALA 108 CO 0.78 -0.98 -0.05 0.54 0.00 0.00 0.00 179.25 179.53 2dmb s VAL 109 N -5.72 -0.00 -0.24 0.00 0.11 -1.26 -5.06 120.40 108.23 2dmb s VAL 109 Ca -0.14 0.01 -0.02 0.00 -2.93 0.00 0.00 61.98 58.89 2dmb s VAL 109 Cb 0.10 -0.81 -0.14 0.00 -1.53 0.00 0.00 36.38 33.99 2dmb s VAL 109 CO 0.63 0.00 -0.24 -1.84 -3.33 0.00 0.00 175.10 170.32 2dmb n GLU 110 N 3.06 0.58 -3.44 1.54 0.28 -1.26 -4.91 120.64 116.49 2dmb n GLU 110 Ca -0.15 0.16 -0.39 0.00 -0.16 0.00 0.00 57.16 56.62 2dmb n GLU 110 Cb 0.56 -1.45 -0.10 0.00 1.43 0.00 0.00 31.44 31.88 2dmb n GLU 110 CO 0.00 0.00 0.00 -2.00 -0.16 0.00 0.00 177.13 174.97 2dmb s GLU 111 N -2.47 3.91 -0.43 3.44 2.12 -1.26 -5.05 118.70 118.95 2dmb s GLU 111 Ca -0.33 -0.14 -0.17 0.00 0.36 0.00 0.00 54.97 54.69 2dmb s GLU 111 Cb 0.10 -3.69 0.03 0.00 0.26 0.00 0.00 34.13 30.83 2dmb s GLU 111 CO 0.52 -0.31 0.44 0.00 -0.54 0.00 0.00 175.26 175.38 2dmb s ALA 112 N 1.99 3.44 0.99 6.30 0.00 -1.26 -5.07 121.76 128.15 2dmb s ALA 112 Ca 0.12 -1.61 -0.12 0.00 0.00 0.00 0.00 51.96 50.35 2dmb s ALA 112 Cb -0.16 -3.07 0.18 0.00 0.00 0.00 0.00 23.12 20.07 2dmb s ALA 112 CO 0.11 -1.64 1.09 -1.25 0.00 0.00 0.00 175.76 174.07 2dmb s PRO 113 N 2.11 0.50 -0.14 0.00 0.04 -1.26 -5.06 135.00 131.18 2dmb s PRO 113 Ca 0.11 0.55 0.01 0.00 0.04 0.00 0.00 61.00 61.72 2dmb s PRO 113 Cb -0.18 -1.74 0.02 0.00 0.04 0.00 0.00 34.50 32.64 2dmb s PRO 113 CO 0.13 -2.69 -0.16 0.54 0.04 0.00 0.00 177.00 174.85 2dmb s VAL 114 N -2.96 1.67 -0.89 -0.36 0.11 -1.26 -5.04 120.40 111.68 2dmb s VAL 114 Ca 0.65 -0.72 -0.19 0.00 -2.93 0.00 0.00 61.98 58.79 2dmb s VAL 114 Cb -0.19 -1.53 -0.24 0.00 -1.53 0.00 0.00 36.38 32.89 2dmb s VAL 114 CO 0.58 0.48 2.18 -3.20 -3.33 0.00 0.00 175.10 171.80 2dmb n ASN 115 N 4.46 -0.44 -4.31 3.54 5.15 -1.26 -4.82 115.26 117.59 2dmb n ASN 115 Ca -0.18 -0.13 -0.45 0.00 -0.60 0.00 0.00 54.58 53.22 2dmb n ASN 115 Cb 0.51 -0.66 -0.06 0.00 -0.53 0.00 0.00 39.78 39.03 2dmb n ASN 115 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2dmb s ALA 116 N 4.43 3.58 0.27 5.20 0.00 -1.26 -5.05 121.76 128.94 2dmb s ALA 116 Ca 1.19 -2.46 -0.20 0.00 0.00 0.00 0.00 51.96 50.50 2dmb s ALA 116 Cb -0.96 -3.14 -0.14 0.00 0.00 0.00 0.00 23.12 18.89 2dmb s ALA 116 CO 0.47 -1.94 0.21 0.00 0.00 0.00 0.00 175.76 174.49 2dmb n PRO 118 N 1.01 0.05 -1.52 0.00 -0.04 -1.26 -4.86 135.00 128.39 2dmb n PRO 118 Ca 0.11 0.23 -0.59 0.00 -0.04 0.00 0.00 63.50 63.21 2dmb n PRO 118 Cb 0.29 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 32.16 2dmb n PRO 118 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2dmb n SER 119 N -1.45 0.40 0.00 3.54 2.88 -1.26 -4.52 113.62 113.21 2dmb n SER 119 Ca 0.04 1.12 0.00 0.00 -1.33 0.00 0.00 58.87 58.70 2dmb n SER 119 Cb 0.15 -0.87 0.00 0.00 -0.75 0.00 0.00 64.21 62.75 2dmb n SER 119 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dmb n GLY 120 N 2.27 0.81 3.77 0.46 0.00 -1.26 -4.65 105.19 106.58 2dmb n GLY 120 Ca 0.23 -0.79 -0.39 0.00 0.00 0.00 0.00 46.02 45.06 2dmb n GLY 120 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dmb s PRO 121 N 0.00 4.16 0.48 1.61 0.04 -1.26 -5.05 135.00 134.98 2dmb s PRO 121 Ca 0.00 1.94 0.08 0.00 0.04 0.00 0.00 61.00 63.06 2dmb s PRO 121 Cb 0.00 -2.81 0.03 0.00 0.04 0.00 0.00 34.50 31.76 2dmb s PRO 121 CO 0.00 -0.26 0.61 -1.54 0.04 0.00 0.00 177.00 175.86 2dmb s SER 122 N -0.95 5.35 0.05 6.66 1.04 -1.26 -5.07 113.70 119.52 2dmb s SER 122 Ca 0.54 -0.64 -0.25 0.00 0.48 0.00 0.00 55.95 56.08 2dmb s SER 122 Cb -0.33 -0.28 0.06 0.00 0.10 0.00 0.00 66.02 65.58 2dmb s SER 122 CO 0.42 -0.96 0.60 -0.55 0.98 0.00 0.00 173.24 173.73 2dmb s SER 123 N -4.43 -0.55 0.00 7.02 0.15 -1.26 -5.23 113.70 109.40 2dmb s SER 123 Ca 0.55 0.30 0.00 0.00 0.70 0.00 0.00 55.95 57.50 2dmb s SER 123 Cb -0.07 0.54 0.00 0.00 -1.71 0.00 0.00 66.02 64.78 2dmb s SER 123 CO 0.34 -0.76 0.00 0.61 1.20 0.00 0.00 173.24 174.63