#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2g0k s ALA 2 N 0.00 3.34 1.08 0.00 0.00 -1.26 -4.44 121.76 120.47 2g0k s ALA 2 Ca 0.00 -1.81 -0.08 0.00 0.00 0.00 0.00 51.96 50.07 2g0k s ALA 2 Cb 0.00 -2.70 0.12 0.00 0.00 0.00 0.00 23.12 20.54 2g0k s ALA 2 CO 0.00 -1.47 0.48 -0.35 0.00 0.00 0.00 175.76 174.42 2g0k n PRO 3 N 5.04 -1.55 -3.48 0.00 -0.04 -1.26 -4.78 135.00 128.93 2g0k n PRO 3 Ca -0.11 -0.76 -0.43 0.00 -0.04 0.00 0.00 63.50 62.16 2g0k n PRO 3 Cb 0.46 -0.65 -0.10 0.00 -0.04 0.00 0.00 33.50 33.17 2g0k n PRO 3 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 2g0k s THR 4 N -1.92 5.10 0.00 0.52 2.01 -1.10 -4.51 115.64 115.74 2g0k s THR 4 Ca 0.30 -0.75 0.08 0.00 0.31 0.00 0.00 61.69 61.63 2g0k s THR 4 Cb -0.02 -3.87 -0.02 0.00 0.01 0.00 0.00 72.50 68.60 2g0k s THR 4 CO 0.22 -0.32 -0.26 0.00 -0.69 0.00 0.00 174.62 173.57 2g0k s ALA 5 N 1.65 2.22 -0.40 7.40 0.00 -1.24 0.40 121.76 131.79 2g0k s ALA 5 Ca 0.04 -1.17 -0.17 0.00 0.00 0.00 0.00 51.96 50.66 2g0k s ALA 5 Cb -0.20 -0.54 0.01 0.00 0.00 0.00 0.00 23.12 22.40 2g0k s ALA 5 CO 0.09 0.53 0.42 0.95 0.00 0.00 0.00 175.76 177.75 2g0k s THR 6 N -0.69 5.10 0.06 0.00 -4.23 1.08 -4.77 115.64 112.19 2g0k s THR 6 Ca 0.11 -0.23 0.03 0.00 -1.18 0.00 0.00 61.69 60.42 2g0k s THR 6 Cb -0.10 -3.99 -0.04 0.00 1.34 0.00 0.00 72.50 69.71 2g0k s THR 6 CO 0.00 -0.34 0.02 -0.69 -0.54 0.00 0.00 174.62 173.07 2g0k s VAL 7 N 2.12 4.19 1.23 2.29 1.01 -1.24 -0.81 120.40 129.19 2g0k s VAL 7 Ca 0.12 -0.81 -0.19 0.00 0.00 0.00 0.00 61.98 61.10 2g0k s VAL 7 Cb -0.17 -2.96 0.30 0.00 0.00 0.00 0.00 36.38 33.55 2g0k s VAL 7 CO 0.13 0.20 1.08 0.28 0.00 0.00 0.00 175.10 176.80 2g0k s THR 8 N -1.26 1.56 -0.18 3.92 -1.32 -0.21 -4.86 115.64 113.29 2g0k s THR 8 Ca 0.25 0.00 -0.29 0.00 -1.21 0.00 0.00 61.69 60.43 2g0k s THR 8 Cb -0.12 -2.42 -0.02 0.00 -1.51 0.00 0.00 72.50 68.43 2g0k s THR 8 CO 0.17 0.00 1.43 -2.16 -2.21 0.00 0.00 174.62 171.85 2g0k s PRO 9 N -5.34 4.07 -0.45 7.08 0.04 -1.26 -4.72 135.00 134.41 2g0k s PRO 9 Ca 0.70 1.70 0.04 0.00 0.04 0.00 0.00 61.00 63.48 2g0k s PRO 9 Cb -0.11 -3.89 0.43 0.00 0.04 0.00 0.00 34.50 30.97 2g0k s PRO 9 CO 0.56 -0.94 1.37 -1.13 0.04 0.00 0.00 177.00 176.90 2g0k n SER 10 N 7.31 5.52 -3.98 6.66 3.41 -1.26 -4.89 113.62 126.39 2g0k n SER 10 Ca 0.16 -3.75 -0.31 0.00 -0.26 0.00 0.00 58.87 54.70 2g0k n SER 10 Cb 0.45 -0.55 -0.15 0.00 -0.26 0.00 0.00 64.21 63.70 2g0k n SER 10 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2g0k s SER 11 N -3.06 4.36 0.00 4.04 0.01 -1.10 -0.55 113.70 117.40 2g0k s SER 11 Ca 0.52 -1.65 0.00 0.00 1.31 0.00 0.00 55.95 56.13 2g0k s SER 11 Cb 0.42 -1.40 0.00 0.00 0.21 0.00 0.00 66.02 65.25 2g0k s SER 11 CO -0.10 -0.30 0.00 0.61 0.41 0.00 0.00 173.24 173.86 2g0k n GLY 12 N 4.48 1.23 3.76 3.44 0.00 -1.10 -4.65 105.19 112.35 2g0k n GLY 12 Ca -0.05 -0.38 -0.36 0.00 0.00 0.00 0.00 46.02 45.23 2g0k n GLY 12 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2g0k s LEU 13 N 0.00 4.28 0.46 0.99 1.43 -1.26 -4.68 118.68 119.90 2g0k s LEU 13 Ca 0.00 0.46 0.07 0.00 -1.03 0.00 0.00 54.13 53.63 2g0k s LEU 13 Cb 0.00 -2.26 0.00 0.00 0.03 0.00 0.00 46.19 43.97 2g0k s LEU 13 CO 0.00 0.20 0.42 -0.44 0.23 0.00 0.00 176.35 176.75 2g0k s SER 14 N 0.04 4.93 0.30 2.29 0.01 -1.26 -4.77 113.70 115.24 2g0k s SER 14 Ca 0.14 -0.89 -0.28 0.00 1.31 0.00 0.00 55.95 56.23 2g0k s SER 14 Cb -0.13 -0.24 -0.14 0.00 0.21 0.00 0.00 66.02 65.73 2g0k s SER 14 CO 0.03 -0.83 1.04 -0.90 0.41 0.00 0.00 173.24 172.99 2g0k n ASP 15 N -1.66 1.46 0.00 2.44 5.68 -1.26 -1.73 116.55 121.49 2g0k n ASP 15 Ca 0.03 1.18 0.00 0.00 -0.50 0.00 0.00 54.79 55.50 2g0k n ASP 15 Cb 0.62 -1.31 0.00 0.00 -1.14 0.00 0.00 41.12 39.29 2g0k n ASP 15 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2g0k n GLY 16 N 1.17 3.15 3.80 6.12 0.00 -1.24 -5.04 105.19 113.15 2g0k n GLY 16 Ca 0.09 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.78 2g0k n GLY 16 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2g0k s THR 17 N -2.84 3.82 -0.08 2.61 2.01 -0.70 -4.92 115.64 115.53 2g0k s THR 17 Ca 0.00 0.95 0.01 0.00 0.31 0.00 0.00 61.69 62.96 2g0k s THR 17 Cb 0.00 -3.41 0.02 0.00 0.01 0.00 0.00 72.50 69.11 2g0k s THR 17 CO 0.00 -0.42 -0.09 0.54 -0.69 0.00 0.00 174.62 173.96 2g0k s VAL 18 N -2.30 0.99 0.65 3.82 0.11 -1.26 -0.97 120.40 121.44 2g0k s VAL 18 Ca 0.65 -0.35 0.03 0.00 -2.93 0.00 0.00 61.98 59.38 2g0k s VAL 18 Cb -0.16 -0.96 0.10 0.00 -1.53 0.00 0.00 36.38 33.83 2g0k s VAL 18 CO 0.31 0.34 0.89 0.68 -3.33 0.00 0.00 175.10 173.99 2g0k s VAL 19 N 1.11 2.24 0.10 2.04 -7.23 0.93 -4.93 120.40 114.66 2g0k s VAL 19 Ca -0.07 -0.73 0.09 0.00 -1.81 0.00 0.00 61.98 59.47 2g0k s VAL 19 Cb -0.14 -2.52 -0.04 0.00 0.56 0.00 0.00 36.38 34.25 2g0k s VAL 19 CO -0.01 0.00 -0.23 -0.75 -0.31 0.00 0.00 175.10 173.80 2g0k s LYS 20 N -4.93 1.26 -0.22 4.82 2.36 -1.26 -1.82 119.74 119.94 2g0k s LYS 20 Ca 0.63 -1.19 -0.03 0.00 -2.55 0.00 0.00 55.97 52.83 2g0k s LYS 20 Cb -0.06 -1.57 0.10 0.00 -1.05 0.00 0.00 37.83 35.24 2g0k s LYS 20 CO 0.42 0.37 0.23 0.14 1.55 0.00 0.00 175.35 178.06 2g0k s VAL 21 N -1.08 -0.32 -0.18 4.02 -7.23 -0.94 -1.05 120.40 113.62 2g0k s VAL 21 Ca 0.09 -0.21 0.01 0.00 -1.81 0.00 0.00 61.98 60.06 2g0k s VAL 21 Cb -0.10 -0.74 0.03 0.00 0.56 0.00 0.00 36.38 36.14 2g0k s VAL 21 CO 0.04 -0.27 -0.12 0.00 -0.31 0.00 0.00 175.10 174.44 2g0k s ALA 22 N 2.32 1.96 0.24 1.32 0.00 0.01 -2.64 121.76 124.96 2g0k s ALA 22 Ca 0.07 -1.09 -0.21 0.00 0.00 0.00 0.00 51.96 50.73 2g0k s ALA 22 Cb -0.15 -1.19 -0.09 0.00 0.00 0.00 0.00 23.12 21.69 2g0k s ALA 22 CO -0.16 -0.64 0.77 0.20 0.00 0.00 0.00 175.76 175.93 2g0k s GLY 23 N 1.43 2.67 -0.14 0.00 0.00 -1.05 0.35 107.32 110.57 2g0k s GLY 23 Ca 0.01 0.25 -0.04 0.00 0.00 0.00 0.00 44.72 44.94 2g0k s GLY 23 CO -0.09 0.63 0.10 0.00 0.00 0.00 0.00 173.10 173.74 2g0k s ALA 24 N -1.53 0.28 0.00 3.20 0.00 1.33 -3.12 121.76 121.92 2g0k s ALA 24 Ca 0.44 -0.10 0.00 0.00 0.00 0.00 0.00 51.96 52.30 2g0k s ALA 24 Cb -0.17 -0.96 0.00 0.00 0.00 0.00 0.00 23.12 21.99 2g0k s ALA 24 CO 0.22 -1.00 0.00 0.41 0.00 0.00 0.00 175.76 175.39 2g0k n GLY 25 N 5.29 1.39 0.00 0.00 0.00 -1.24 -2.71 105.19 107.92 2g0k n GLY 25 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.96 2g0k n GLY 25 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2g0k n LEU 26 N 0.00 0.00 -4.69 0.99 4.77 -1.04 -4.82 117.00 112.21 2g0k n LEU 26 Ca 0.00 0.00 -0.39 0.00 -0.03 0.00 0.00 56.01 55.59 2g0k n LEU 26 Cb 0.00 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.03 2g0k n LEU 26 CO 0.00 -0.20 0.30 -1.10 -1.33 0.00 0.00 177.39 175.06 2g0k s GLN 27 N 0.08 4.28 0.35 3.23 1.11 -1.26 -4.70 119.66 122.75 2g0k s GLN 27 Ca 0.00 0.58 -0.27 0.00 0.01 0.00 0.00 55.36 55.67 2g0k s GLN 27 Cb 0.00 -3.52 -0.09 0.00 -1.01 0.00 0.00 33.01 28.39 2g0k s GLN 27 CO 0.00 -0.07 1.22 0.00 0.01 0.00 0.00 175.29 176.45 2g0k s ALA 28 N 1.33 3.34 0.00 6.09 0.00 -1.26 -2.20 121.76 129.06 2g0k s ALA 28 Ca 0.29 1.08 0.00 0.00 0.00 0.00 0.00 51.96 53.33 2g0k s ALA 28 Cb -0.16 -3.41 0.00 0.00 0.00 0.00 0.00 23.12 19.55 2g0k s ALA 28 CO 0.11 -0.52 0.00 0.41 0.00 0.00 0.00 175.76 175.77 2g0k n GLY 29 N 0.82 0.30 3.85 0.00 0.00 0.33 -4.94 105.19 105.54 2g0k n GLY 29 Ca 0.01 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.67 2g0k n GLY 29 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2g0k s THR 30 N -1.71 4.99 0.13 2.61 -1.32 -0.93 -4.84 115.64 114.57 2g0k s THR 30 Ca 0.00 0.73 -0.06 0.00 -1.21 0.00 0.00 61.69 61.15 2g0k s THR 30 Cb 0.00 -3.71 -0.06 0.00 -1.51 0.00 0.00 72.50 67.23 2g0k s THR 30 CO 0.00 0.39 0.38 0.00 -2.21 0.00 0.00 174.62 173.18 2g0k s ALA 31 N -1.29 3.77 0.03 11.08 0.00 -1.26 -0.95 121.76 133.14 2g0k s ALA 31 Ca 0.31 -0.52 0.01 0.00 0.00 0.00 0.00 51.96 51.76 2g0k s ALA 31 Cb -0.15 -2.16 -0.02 0.00 0.00 0.00 0.00 23.12 20.79 2g0k s ALA 31 CO 0.17 0.65 -0.05 0.71 0.00 0.00 0.00 175.76 177.23 2g0k s TYR 32 N -1.60 0.45 -0.27 0.00 2.02 -0.82 -3.85 117.35 113.27 2g0k s TYR 32 Ca 0.39 -0.45 -0.04 0.00 -0.37 0.00 0.00 57.07 56.61 2g0k s TYR 32 Cb -0.12 -0.28 0.02 0.00 -0.40 0.00 0.00 41.96 41.17 2g0k s TYR 32 CO 0.23 -0.11 0.00 -0.51 -1.57 0.00 0.00 175.55 173.59 2g0k s ASP 33 N -1.31 4.69 0.07 2.29 1.11 0.21 -2.93 116.67 120.79 2g0k s ASP 33 Ca -0.11 -0.84 -0.07 0.00 0.18 0.00 0.00 52.55 51.71 2g0k s ASP 33 Cb -0.09 -1.76 -0.05 0.00 1.07 0.00 0.00 42.92 42.10 2g0k s ASP 33 CO -0.00 -0.17 0.33 -0.69 1.18 0.00 0.00 175.17 175.82 2g0k s VAL 34 N 1.39 5.21 0.05 -1.27 1.01 -0.96 0.71 120.40 126.54 2g0k s VAL 34 Ca 0.01 0.18 -0.28 0.00 0.00 0.00 0.00 61.98 61.89 2g0k s VAL 34 Cb -0.17 -3.61 0.09 0.00 0.00 0.00 0.00 36.38 32.70 2g0k s VAL 34 CO -0.01 0.25 1.09 -0.83 0.00 0.00 0.00 175.10 175.59 2g0k s GLY 35 N -1.95 -0.33 -0.26 4.51 0.00 3.98 -0.45 107.32 112.83 2g0k s GLY 35 Ca 0.33 0.56 -0.01 0.00 0.00 0.00 0.00 44.72 45.60 2g0k s GLY 35 CO 0.20 0.13 -0.06 1.62 0.00 0.00 0.00 173.10 174.99 2g0k s GLN 36 N -2.89 2.66 0.09 2.90 0.74 -1.25 0.11 119.66 122.02 2g0k s GLN 36 Ca 0.12 -1.10 0.07 0.00 0.05 0.00 0.00 55.36 54.51 2g0k s GLN 36 Cb 0.01 -3.00 -0.04 0.00 1.10 0.00 0.00 33.01 31.08 2g0k s GLN 36 CO -0.02 -0.47 -0.13 0.00 -0.55 0.00 0.00 175.29 174.12 2g0k s ALA 38 N -1.14 1.67 -0.02 0.00 0.00 0.80 -2.13 121.76 120.93 2g0k s ALA 38 Ca 0.19 -0.76 -0.30 0.00 0.00 0.00 0.00 51.96 51.09 2g0k s ALA 38 Cb -0.11 -0.55 -0.06 0.00 0.00 0.00 0.00 23.12 22.39 2g0k s ALA 38 CO 0.11 0.30 1.71 -0.46 0.00 0.00 0.00 175.76 177.42 2g0k s TRP 39 N 0.03 1.91 -0.26 0.00 -0.00 -1.26 -0.54 118.94 118.82 2g0k s TRP 39 Ca -0.05 0.09 -0.06 0.00 -0.00 0.00 0.00 56.10 56.09 2g0k s TRP 39 Cb -0.12 -3.98 -0.14 0.00 -0.00 0.00 0.00 33.47 29.23 2g0k s TRP 39 CO 0.03 -4.15 -0.28 1.33 -0.00 0.00 0.00 176.95 173.88 2g0k n VAL 40 N 5.41 1.43 -4.37 5.86 0.24 0.88 -4.89 118.33 122.89 2g0k n VAL 40 Ca 0.18 -0.46 -0.19 0.00 -2.04 0.00 0.00 64.34 61.83 2g0k n VAL 40 Cb 0.42 -1.61 -0.10 0.00 -1.47 0.00 0.00 33.84 31.08 2g0k n VAL 40 CO 0.00 0.00 0.00 -1.81 -2.14 0.00 0.00 176.83 172.88 2g0k s ASP 41 N -6.88 1.67 -0.24 -1.34 1.01 0.30 -5.00 116.67 106.20 2g0k s ASP 41 Ca -0.35 -1.47 -0.31 0.00 0.71 0.00 0.00 52.55 51.13 2g0k s ASP 41 Cb 0.11 0.24 -0.08 0.00 1.01 0.00 0.00 42.92 44.20 2g0k s ASP 41 CO 0.52 -0.79 2.17 1.07 0.21 0.00 0.00 175.17 178.35 2g0k n THR 42 N -0.59 0.33 -0.94 -1.27 5.66 -1.26 0.47 114.28 116.68 2g0k n THR 42 Ca -0.01 -0.35 0.00 0.00 -3.05 0.00 0.00 64.05 60.64 2g0k n THR 42 Cb 0.66 -2.18 0.00 0.00 -1.55 0.00 0.00 70.33 67.25 2g0k n THR 42 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2g0k n GLY 43 N 5.85 0.34 3.06 1.09 0.00 -1.26 -4.96 105.19 109.31 2g0k n GLY 43 Ca 0.33 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 46.03 2g0k n GLY 43 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2g0k s VAL 44 N -1.81 2.08 -0.00 1.61 1.01 0.18 -5.09 120.40 118.37 2g0k s VAL 44 Ca 0.00 -1.51 0.07 0.00 0.00 0.00 0.00 61.98 60.53 2g0k s VAL 44 Cb 0.00 -2.18 -0.02 0.00 0.00 0.00 0.00 36.38 34.19 2g0k s VAL 44 CO 0.00 0.02 -0.22 -1.48 0.00 0.00 0.00 175.10 173.43 2g0k s LEU 45 N 1.16 2.07 0.02 3.92 2.34 -1.26 0.11 118.68 127.03 2g0k s LEU 45 Ca -0.07 -0.42 -0.05 0.00 0.06 0.00 0.00 54.13 53.65 2g0k s LEU 45 Cb -0.19 -1.10 -0.05 0.00 -0.56 0.00 0.00 46.19 44.29 2g0k s LEU 45 CO -0.06 0.25 0.25 0.00 -1.06 0.00 0.00 176.35 175.73 2g0k s ALA 46 N -0.57 3.89 0.15 1.48 0.00 0.30 -3.49 121.76 123.52 2g0k s ALA 46 Ca 0.08 -0.66 0.05 0.00 0.00 0.00 0.00 51.96 51.44 2g0k s ALA 46 Cb -0.08 -1.99 -0.04 0.00 0.00 0.00 0.00 23.12 21.00 2g0k s ALA 46 CO -0.00 0.70 0.10 0.00 0.00 0.00 0.00 175.76 176.56 2g0k s ASN 48 N -2.94 4.91 0.00 0.00 2.47 -0.93 0.24 114.94 118.69 2g0k s ASN 48 Ca 0.30 -1.28 0.20 0.00 0.42 0.00 0.00 52.86 52.50 2g0k s ASN 48 Cb -0.10 -1.72 1.17 0.00 -1.45 0.00 0.00 41.25 39.15 2g0k s ASN 48 CO 0.22 -0.27 1.57 -0.81 -3.72 0.00 0.00 177.10 174.10 2g0k n PRO 49 N 4.63 0.60 0.08 0.43 -0.04 -1.26 -2.09 135.00 137.34 2g0k n PRO 49 Ca -0.13 0.01 0.12 0.00 -0.04 0.00 0.00 63.50 63.46 2g0k n PRO 49 Cb 0.43 -1.50 0.12 0.00 -0.04 0.00 0.00 33.50 32.51 2g0k n PRO 49 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2g0k h ALA 50 N 3.22 0.57 0.00 0.55 0.00 -1.94 -3.33 119.26 118.32 2g0k h ALA 50 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 2g0k h ALA 50 Cb 0.01 0.00 -0.14 0.00 0.00 0.00 0.00 17.79 17.67 2g0k h ALA 50 CO 0.00 0.00 -0.64 -0.40 0.00 0.00 0.00 179.25 178.21 2g0k n ASP 51 N -2.31 1.41 -4.58 0.00 5.68 -0.89 -5.03 116.55 110.83 2g0k n ASP 51 Ca 0.02 -3.05 -0.39 0.00 -0.50 0.00 0.00 54.79 50.88 2g0k n ASP 51 Cb 0.47 -0.42 -0.10 0.00 -1.14 0.00 0.00 41.12 39.93 2g0k n ASP 51 CO 0.00 0.00 0.00 0.72 -1.33 0.00 0.00 177.20 176.59 2g0k s PHE 52 N -1.87 3.23 0.16 2.11 -0.12 -1.19 -3.81 117.98 116.48 2g0k s PHE 52 Ca 0.34 0.15 0.01 0.00 -0.05 0.00 0.00 56.93 57.38 2g0k s PHE 52 Cb 0.35 -2.48 0.01 0.00 -0.63 0.00 0.00 43.02 40.27 2g0k s PHE 52 CO -0.09 -0.23 0.10 0.45 -0.05 0.00 0.00 175.22 175.40 2g0k n SER 53 N 5.18 1.65 -3.86 1.98 2.88 0.41 -4.96 113.62 116.90 2g0k n SER 53 Ca -0.12 -1.57 -0.09 0.00 -1.33 0.00 0.00 58.87 55.76 2g0k n SER 53 Cb 0.51 0.01 -0.08 0.00 -0.75 0.00 0.00 64.21 63.90 2g0k n SER 53 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2g0k s SER 54 N -1.92 0.09 -0.00 -3.46 1.04 -1.26 -2.28 113.70 105.91 2g0k s SER 54 Ca 0.08 -0.53 -0.28 0.00 0.48 0.00 0.00 55.95 55.69 2g0k s SER 54 Cb -0.01 0.31 0.10 0.00 0.10 0.00 0.00 66.02 66.53 2g0k s SER 54 CO 0.05 -0.65 0.87 0.54 0.98 0.00 0.00 173.24 175.03 2g0k s VAL 55 N -3.28 0.00 -0.03 5.02 0.11 -1.15 -4.95 120.40 116.12 2g0k s VAL 55 Ca 0.00 0.00 0.05 0.00 -2.93 0.00 0.00 61.98 59.10 2g0k s VAL 55 Cb 0.02 -1.00 -0.01 0.00 -1.53 0.00 0.00 36.38 33.87 2g0k s VAL 55 CO -0.08 0.00 -0.16 -0.89 -3.33 0.00 0.00 175.10 170.64 2g0k s THR 56 N -3.07 1.32 0.08 5.04 2.01 -1.26 -1.94 115.64 117.81 2g0k s THR 56 Ca 0.04 -0.68 -0.30 0.00 0.31 0.00 0.00 61.69 61.06 2g0k s THR 56 Cb -0.01 -1.12 -0.06 0.00 0.01 0.00 0.00 72.50 71.33 2g0k s THR 56 CO -0.09 0.38 1.13 0.00 -0.69 0.00 0.00 174.62 175.35 2g0k s ALA 57 N -0.14 3.33 1.05 7.40 0.00 -0.12 -4.62 121.76 128.66 2g0k s ALA 57 Ca 0.01 0.77 -0.07 0.00 0.00 0.00 0.00 51.96 52.67 2g0k s ALA 57 Cb -0.09 -3.40 0.10 0.00 0.00 0.00 0.00 23.12 19.73 2g0k s ALA 57 CO 0.01 -0.33 0.42 -0.40 0.00 0.00 0.00 175.76 175.45 2g0k n ASP 58 N 3.54 -0.84 0.33 0.00 5.68 -0.70 -0.52 116.55 124.04 2g0k n ASP 58 Ca 0.07 -0.90 0.22 0.00 -0.50 0.00 0.00 54.79 53.68 2g0k n ASP 58 Cb 0.47 -0.35 1.14 0.00 -1.14 0.00 0.00 41.12 41.24 2g0k n ASP 58 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2g0k h ALA 59 N -2.13 1.04 -0.22 2.12 0.00 -1.93 0.22 119.26 118.35 2g0k h ALA 59 Ca -0.15 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.76 2g0k h ALA 59 Cb 0.43 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.22 2g0k h ALA 59 CO 0.10 0.00 0.00 0.09 0.00 0.00 0.00 179.25 179.44 2g0k n ASN 60 N -3.14 1.21 -2.12 0.00 3.02 -1.26 -4.80 115.26 108.16 2g0k n ASN 60 Ca -0.03 -2.00 -0.18 0.00 -0.03 0.00 0.00 54.58 52.35 2g0k n ASN 60 Cb 0.10 -0.15 -0.03 0.00 -0.61 0.00 0.00 39.78 39.09 2g0k n ASN 60 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2g0k n GLY 61 N 0.85 0.20 3.22 7.41 0.00 0.75 -4.75 105.19 112.87 2g0k n GLY 61 Ca 0.07 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.79 2g0k n GLY 61 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2g0k s SER 62 N -2.19 2.89 0.22 1.61 0.15 -1.26 -2.51 113.70 112.62 2g0k s SER 62 Ca 0.00 -0.49 0.11 0.00 0.70 0.00 0.00 55.95 56.26 2g0k s SER 62 Cb 0.00 -0.97 -0.05 0.00 -1.71 0.00 0.00 66.02 63.29 2g0k s SER 62 CO 0.00 0.20 -0.21 0.00 1.20 0.00 0.00 173.24 174.43 2g0k s ALA 63 N 0.05 2.47 -0.02 5.45 0.00 -1.18 -1.72 121.76 126.81 2g0k s ALA 63 Ca -0.09 -1.69 0.00 0.00 0.00 0.00 0.00 51.96 50.18 2g0k s ALA 63 Cb -0.15 -0.26 0.02 0.00 0.00 0.00 0.00 23.12 22.73 2g0k s ALA 63 CO 0.05 0.32 0.01 -1.54 0.00 0.00 0.00 175.76 174.59 2g0k s SER 64 N -3.00 0.19 0.25 0.00 1.04 -1.26 -2.53 113.70 108.39 2g0k s SER 64 Ca 0.23 -0.00 -0.22 0.00 0.48 0.00 0.00 55.95 56.44 2g0k s SER 64 Cb -0.06 -0.09 0.03 0.00 0.10 0.00 0.00 66.02 66.00 2g0k s SER 64 CO 0.11 -0.07 0.79 -0.89 0.98 0.00 0.00 173.24 174.16 2g0k s THR 65 N 0.65 0.00 -0.03 2.02 2.01 -1.08 -4.89 115.64 114.32 2g0k s THR 65 Ca -0.06 -0.90 0.07 0.00 0.31 0.00 0.00 61.69 61.11 2g0k s THR 65 Cb -0.09 -2.03 -0.02 0.00 0.01 0.00 0.00 72.50 70.38 2g0k s THR 65 CO -0.02 0.00 -0.24 -0.44 -0.69 0.00 0.00 174.62 173.23 2g0k s SER 66 N -2.94 2.90 -0.21 3.53 0.01 -1.26 -2.22 113.70 113.51 2g0k s SER 66 Ca 0.12 -0.46 -0.01 0.00 1.31 0.00 0.00 55.95 56.90 2g0k s SER 66 Cb -0.05 -0.49 0.01 0.00 0.21 0.00 0.00 66.02 65.71 2g0k s SER 66 CO 0.06 0.28 -0.11 -0.22 0.41 0.00 0.00 173.24 173.66 2g0k s LEU 67 N -0.42 2.68 0.22 2.44 1.98 -0.76 -4.85 118.68 119.96 2g0k s LEU 67 Ca 0.05 -0.61 -0.30 0.00 -2.89 0.00 0.00 54.13 50.38 2g0k s LEU 67 Cb -0.11 -1.62 -0.09 0.00 0.66 0.00 0.00 46.19 45.03 2g0k s LEU 67 CO 0.01 -0.04 1.24 0.28 -1.89 0.00 0.00 176.35 175.95 2g0k s THR 68 N 1.37 3.33 -0.18 3.68 -1.32 -1.26 -0.05 115.64 121.21 2g0k s THR 68 Ca 0.04 1.15 -0.17 0.00 -1.21 0.00 0.00 61.69 61.50 2g0k s THR 68 Cb -0.14 -3.74 -0.04 0.00 -1.51 0.00 0.00 72.50 67.07 2g0k s THR 68 CO -0.07 0.20 0.47 -0.69 -2.21 0.00 0.00 174.62 172.31 2g0k s VAL 69 N -0.23 5.16 -0.02 5.08 1.01 -0.15 -4.86 120.40 126.38 2g0k s VAL 69 Ca 0.53 0.87 0.07 0.00 0.00 0.00 0.00 61.98 63.44 2g0k s VAL 69 Cb -0.35 -3.80 -0.02 0.00 0.00 0.00 0.00 36.38 32.21 2g0k s VAL 69 CO 0.39 0.24 -0.22 -0.13 0.00 0.00 0.00 175.10 175.39 2g0k s ARG 70 N 1.29 2.22 0.22 2.72 3.00 -1.26 -3.71 118.95 123.43 2g0k s ARG 70 Ca 0.23 -0.87 0.25 0.00 0.00 0.00 0.00 55.73 55.34 2g0k s ARG 70 Cb -0.15 -2.16 0.58 0.00 0.00 0.00 0.00 34.95 33.22 2g0k s ARG 70 CO 0.09 0.58 1.60 0.07 0.00 0.00 0.00 175.30 177.63 2g0k h ARG 71 N 5.33 0.00 -1.77 3.54 0.11 -1.92 -3.42 114.38 116.26 2g0k h ARG 71 Ca -0.45 0.00 0.07 0.00 0.10 0.00 0.00 59.98 59.70 2g0k h ARG 71 Cb 1.13 0.00 -0.21 0.00 1.11 0.00 0.00 29.97 32.01 2g0k h ARG 71 CO 0.48 0.00 0.49 -1.12 0.10 0.00 0.00 179.97 179.92 2g0k s SER 72 N -4.74 -0.41 -0.19 0.08 0.01 -1.26 -0.04 113.70 107.16 2g0k s SER 72 Ca 0.08 0.36 -0.35 0.00 1.31 0.00 0.00 55.95 57.35 2g0k s SER 72 Cb 0.11 0.35 0.14 0.00 0.21 0.00 0.00 66.02 66.84 2g0k s SER 72 CO 0.65 -0.43 1.27 0.72 0.41 0.00 0.00 173.24 175.86 2g0k s PHE 73 N -1.54 -0.08 -0.24 2.43 -0.12 -0.93 -4.95 117.98 112.54 2g0k s PHE 73 Ca -0.02 0.04 -0.28 0.00 -0.05 0.00 0.00 56.93 56.62 2g0k s PHE 73 Cb -0.01 0.52 -0.04 0.00 -0.63 0.00 0.00 43.02 42.86 2g0k s PHE 73 CO 0.00 -0.16 2.08 -1.83 -0.05 0.00 0.00 175.22 175.26 2g0k s GLU 74 N -2.31 3.24 -0.78 1.99 -1.05 -1.26 -0.23 118.70 118.30 2g0k s GLU 74 Ca 0.11 1.88 -0.25 0.00 -0.15 0.00 0.00 54.97 56.55 2g0k s GLU 74 Cb 0.00 -4.31 -0.03 0.00 -0.44 0.00 0.00 34.13 29.35 2g0k s GLU 74 CO -0.04 -1.97 1.90 0.20 0.95 0.00 0.00 175.26 176.30 2g0k s GLY 75 N 7.43 0.20 -0.75 -3.83 0.00 0.23 -4.13 107.32 106.49 2g0k s GLY 75 Ca 0.94 -1.16 -0.25 0.00 0.00 0.00 0.00 44.72 44.24 2g0k s GLY 75 CO 0.35 3.44 1.19 -1.36 0.00 0.00 0.00 173.10 176.72 2g0k s PHE 76 N 9.58 2.46 0.40 1.90 0.08 0.68 -0.84 117.98 132.23 2g0k s PHE 76 Ca 0.68 -0.32 -0.26 0.00 0.12 0.00 0.00 56.93 57.15 2g0k s PHE 76 Cb -0.09 -4.52 -0.10 0.00 -0.57 0.00 0.00 43.02 37.74 2g0k s PHE 76 CO 0.08 -1.91 1.21 -0.11 -0.10 0.00 0.00 175.22 174.39 2g0k n LEU 77 N 8.71 3.58 -0.30 -0.37 7.94 -0.09 0.29 117.00 136.76 2g0k n LEU 77 Ca 0.04 1.11 0.13 0.00 -1.11 0.00 0.00 56.01 56.19 2g0k n LEU 77 Cb 0.48 -1.46 0.31 0.00 0.53 0.00 0.00 43.42 43.28 2g0k n LEU 77 CO 0.68 -0.82 1.03 -0.26 -1.11 0.00 0.00 177.39 176.91 2g0k h PHE 78 N 2.04 0.61 0.00 1.96 -1.00 -1.88 1.76 116.94 120.43 2g0k h PHE 78 Ca -0.46 0.04 0.00 0.00 2.81 0.00 0.00 57.97 60.36 2g0k h PHE 78 Cb 1.30 -0.13 0.00 0.00 3.61 0.00 0.00 35.95 40.73 2g0k h PHE 78 CO 0.47 -0.07 0.09 -0.44 -1.61 0.00 0.00 178.31 176.76 2g0k h ASP 79 N 0.37 0.00 0.00 2.17 3.32 -1.91 -3.44 116.42 116.93 2g0k h ASP 79 Ca 0.56 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.61 2g0k h ASP 79 Cb 1.07 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.62 2g0k h ASP 79 CO -0.54 0.00 0.00 0.61 -1.72 0.00 0.00 179.24 177.59 2g0k n GLY 80 N -1.23 1.34 3.63 2.75 0.00 0.60 -5.08 105.19 107.19 2g0k n GLY 80 Ca -0.02 -0.29 -0.35 0.00 0.00 0.00 0.00 46.02 45.37 2g0k n GLY 80 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2g0k s THR 81 N -2.00 4.42 -0.86 2.61 2.01 -1.17 -4.87 115.64 115.77 2g0k s THR 81 Ca 0.00 -0.18 -0.25 0.00 0.31 0.00 0.00 61.69 61.57 2g0k s THR 81 Cb 0.00 -2.93 -0.04 0.00 0.01 0.00 0.00 72.50 69.55 2g0k s THR 81 CO 0.00 0.53 1.90 0.00 -0.69 0.00 0.00 174.62 176.36 2g0k s ARG 82 N -0.16 2.63 0.08 4.92 3.03 -1.26 -0.91 118.95 127.28 2g0k s ARG 82 Ca 0.05 -0.20 -0.22 0.00 2.03 0.00 0.00 55.73 57.39 2g0k s ARG 82 Cb -0.12 -4.97 -0.13 0.00 -1.03 0.00 0.00 34.95 28.70 2g0k s ARG 82 CO 0.02 -3.20 1.63 2.35 -1.13 0.00 0.00 175.30 174.97 2g0k h TRP 83 N 11.75 0.15 0.00 5.89 7.01 -1.37 -3.49 115.95 135.89 2g0k h TRP 83 Ca 0.04 -0.01 0.00 0.00 2.11 0.00 0.00 58.89 61.04 2g0k h TRP 83 Cb 1.03 -0.04 0.00 0.00 -2.10 0.00 0.00 29.16 28.05 2g0k h TRP 83 CO 1.19 0.23 0.00 0.41 -2.79 0.00 0.00 178.44 177.48 2g0k n GLY 84 N -0.75 3.52 3.57 2.65 0.00 -1.23 -4.94 105.19 108.02 2g0k n GLY 84 Ca -0.06 -1.64 -0.39 0.00 0.00 0.00 0.00 46.02 43.93 2g0k n GLY 84 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2g0k s THR 85 N -2.00 3.24 0.48 2.61 2.01 -1.26 0.78 115.64 121.50 2g0k s THR 85 Ca 0.00 0.19 -0.19 0.00 0.31 0.00 0.00 61.69 62.00 2g0k s THR 85 Cb 0.00 -3.49 -0.09 0.00 0.01 0.00 0.00 72.50 68.93 2g0k s THR 85 CO 0.00 -0.42 0.99 0.68 -0.69 0.00 0.00 174.62 175.17 2g0k s VAL 86 N 9.37 4.28 -0.58 3.82 -7.23 0.68 -4.78 120.40 125.97 2g0k s VAL 86 Ca 0.83 1.28 -0.05 0.00 -1.81 0.00 0.00 61.98 62.23 2g0k s VAL 86 Cb -0.19 -3.59 0.15 0.00 0.56 0.00 0.00 36.38 33.31 2g0k s VAL 86 CO 0.27 -0.44 0.41 -1.81 -0.31 0.00 0.00 175.10 173.22 2g0k s ASP 87 N -2.48 5.47 0.59 4.85 1.11 -1.26 -2.19 116.67 122.75 2g0k s ASP 87 Ca 0.62 -2.53 0.29 0.00 0.18 0.00 0.00 52.55 51.11 2g0k s ASP 87 Cb -0.11 -1.91 1.44 0.00 1.07 0.00 0.00 42.92 43.41 2g0k s ASP 87 CO 0.22 -0.48 1.85 0.00 1.18 0.00 0.00 175.17 177.95 2g0k n THR 89 N -3.73 0.00 -0.01 0.00 -2.24 -1.20 -3.32 114.28 103.78 2g0k n THR 89 Ca 0.11 -0.03 -0.01 0.00 -2.27 0.00 0.00 64.05 61.85 2g0k n THR 89 Cb 0.77 -0.36 -0.02 0.00 -2.10 0.00 0.00 70.33 68.61 2g0k n THR 89 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 2g0k n THR 90 N -0.84 0.14 -4.55 4.28 -1.04 0.69 -5.02 114.28 107.94 2g0k n THR 90 Ca 0.22 -0.10 -0.27 0.00 -2.04 0.00 0.00 64.05 61.85 2g0k n THR 90 Cb 0.13 -0.60 -0.07 0.00 -1.82 0.00 0.00 70.33 67.96 2g0k n THR 90 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2g0k n ALA 91 N -1.98 0.58 -2.65 2.41 0.00 -0.30 -5.05 120.51 113.51 2g0k n ALA 91 Ca -0.04 -2.18 -0.38 0.00 0.00 0.00 0.00 53.44 50.85 2g0k n ALA 91 Cb 0.47 1.44 -0.08 0.00 0.00 0.00 0.00 19.45 21.27 2g0k n ALA 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2g0k s ALA 92 N -3.13 3.57 0.17 0.00 0.00 -1.26 -4.59 121.76 116.52 2g0k s ALA 92 Ca 0.19 -0.71 0.05 0.00 0.00 0.00 0.00 51.96 51.49 2g0k s ALA 92 Cb 0.01 -2.57 -0.04 0.00 0.00 0.00 0.00 23.12 20.53 2g0k s ALA 92 CO 0.14 -0.37 0.17 0.00 0.00 0.00 0.00 175.76 175.70 2g0k s GLN 94 N -3.24 0.41 0.18 0.00 -2.07 -0.91 0.32 119.66 114.36 2g0k s GLN 94 Ca 0.32 -0.25 0.04 0.00 -1.82 0.00 0.00 55.36 53.65 2g0k s GLN 94 Cb -0.10 0.17 -0.04 0.00 -1.09 0.00 0.00 33.01 31.96 2g0k s GLN 94 CO 0.25 -0.09 0.25 0.08 -1.32 0.00 0.00 175.29 174.45 2g0k s VAL 95 N -1.03 5.01 -0.19 3.63 1.01 -0.95 -1.21 120.40 126.68 2g0k s VAL 95 Ca -0.11 -0.90 -0.35 0.00 0.00 0.00 0.00 61.98 60.61 2g0k s VAL 95 Cb -0.06 -3.61 0.14 0.00 0.00 0.00 0.00 36.38 32.85 2g0k s VAL 95 CO 0.01 -0.16 1.20 -0.83 0.00 0.00 0.00 175.10 175.33 2g0k s GLY 96 N -3.37 -0.30 0.14 4.51 0.00 0.30 -4.08 107.32 104.51 2g0k s GLY 96 Ca 0.33 1.59 0.06 0.00 0.00 0.00 0.00 44.72 46.70 2g0k s GLY 96 CO 0.27 0.53 -0.15 0.48 0.00 0.00 0.00 173.10 174.23 2g0k s LEU 97 N -2.19 2.43 -0.02 0.66 2.34 1.50 0.77 118.68 124.16 2g0k s LEU 97 Ca 0.09 -0.84 -0.05 0.00 0.06 0.00 0.00 54.13 53.39 2g0k s LEU 97 Cb -0.01 -0.61 0.01 0.00 -0.56 0.00 0.00 46.19 45.02 2g0k s LEU 97 CO -0.05 -0.13 0.11 -0.44 -1.06 0.00 0.00 176.35 174.78 2g0k s SER 98 N -2.58 -0.04 0.08 1.48 0.01 3.47 -3.57 113.70 112.56 2g0k s SER 98 Ca 0.11 0.02 0.00 0.00 1.31 0.00 0.00 55.95 57.40 2g0k s SER 98 Cb -0.04 0.22 0.00 0.00 0.21 0.00 0.00 66.02 66.41 2g0k s SER 98 CO 0.04 -0.17 0.00 -0.90 0.41 0.00 0.00 173.24 172.61 2g0k n ASP 99 N 2.36 0.00 0.01 2.44 5.75 -0.12 0.63 116.55 127.63 2g0k n ASP 99 Ca -0.17 -0.18 -0.11 0.00 -0.01 0.00 0.00 54.79 54.32 2g0k n ASP 99 Cb 0.58 0.00 -0.06 0.00 -1.03 0.00 0.00 41.12 40.61 2g0k n ASP 99 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2g0k h ALA 100 N -1.31 0.09 0.00 2.12 0.00 -1.90 -2.07 119.26 116.19 2g0k h ALA 100 Ca 0.00 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.83 2g0k h ALA 100 Cb 0.00 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 2g0k h ALA 100 CO 0.00 -0.40 -0.27 0.00 0.00 0.00 0.00 179.25 178.58 2g0k h ALA 101 N 0.99 1.04 0.00 0.00 0.00 -1.96 -3.46 119.26 115.86 2g0k h ALA 101 Ca 0.02 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.69 2g0k h ALA 101 Cb 0.03 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.77 2g0k h ALA 101 CO -0.00 0.33 0.00 0.41 0.00 0.00 0.00 179.25 179.99 2g0k n GLY 102 N 0.10 0.88 3.72 0.00 0.00 -0.78 -5.13 105.19 103.98 2g0k n GLY 102 Ca -0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 2g0k n GLY 102 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2g0k s ASN 103 N -1.74 3.95 0.00 1.61 4.22 -1.26 -4.69 114.94 117.02 2g0k s ASN 103 Ca 0.00 -1.62 0.00 0.00 -2.14 0.00 0.00 52.86 49.10 2g0k s ASN 103 Cb 0.00 0.39 0.00 0.00 1.28 0.00 0.00 41.25 42.92 2g0k s ASN 103 CO 0.00 -0.81 0.00 0.61 -2.04 0.00 0.00 177.10 174.86 2g0k n GLY 104 N -1.18 0.95 3.73 0.45 0.00 -1.26 -0.94 105.19 106.94 2g0k n GLY 104 Ca -0.16 -1.97 -0.41 0.00 0.00 0.00 0.00 46.02 43.48 2g0k n GLY 104 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2g0k s PRO 105 N -1.50 4.46 0.08 1.61 0.04 -1.26 -4.61 135.00 133.81 2g0k s PRO 105 Ca 0.00 1.89 -0.01 0.00 0.04 0.00 0.00 61.00 62.92 2g0k s PRO 105 Cb 0.00 -3.25 -0.04 0.00 0.04 0.00 0.00 34.50 31.25 2g0k s PRO 105 CO 0.00 -0.16 -0.01 -1.83 0.04 0.00 0.00 177.00 175.05 2g0k s GLU 106 N 0.07 0.71 0.00 4.56 -1.05 -1.26 -4.02 118.70 117.71 2g0k s GLU 106 Ca 0.55 -1.29 0.00 0.00 -0.15 0.00 0.00 54.97 54.08 2g0k s GLU 106 Cb -0.33 0.20 0.00 0.00 -0.44 0.00 0.00 34.13 33.56 2g0k s GLU 106 CO 0.35 -0.15 0.00 0.41 0.95 0.00 0.00 175.26 176.82 2g0k n GLY 107 N 0.04 0.74 2.88 -3.83 0.00 -1.26 -4.05 105.19 99.72 2g0k n GLY 107 Ca -0.11 -0.14 -0.30 0.00 0.00 0.00 0.00 46.02 45.46 2g0k n GLY 107 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2g0k s VAL 108 N -0.54 1.51 0.07 1.61 1.01 -1.26 -4.96 120.40 117.85 2g0k s VAL 108 Ca 0.00 -1.72 -0.06 0.00 0.00 0.00 0.00 61.98 60.20 2g0k s VAL 108 Cb 0.00 -2.06 -0.05 0.00 0.00 0.00 0.00 36.38 34.26 2g0k s VAL 108 CO 0.00 -0.55 0.34 0.00 0.00 0.00 0.00 175.10 174.89 2g0k s ALA 109 N 1.31 3.81 0.27 5.51 0.00 -1.26 -2.23 121.76 129.17 2g0k s ALA 109 Ca 0.07 -0.53 0.10 0.00 0.00 0.00 0.00 51.96 51.61 2g0k s ALA 109 Cb -0.18 -2.13 -0.05 0.00 0.00 0.00 0.00 23.12 20.77 2g0k s ALA 109 CO -0.15 0.64 -0.08 0.42 0.00 0.00 0.00 175.76 176.59 2g0k s ILE 110 N -1.46 3.06 -0.17 0.00 1.01 0.97 -4.88 121.20 119.73 2g0k s ILE 110 Ca 0.34 -2.09 -0.08 0.00 0.00 0.00 0.00 60.65 58.82 2g0k s ILE 110 Cb -0.13 -2.62 0.07 0.00 0.01 0.00 0.00 42.46 39.79 2g0k s ILE 110 CO 0.20 -0.37 0.39 -0.55 0.00 0.00 0.00 174.94 174.61 2g0k s SER 111 N -3.57 -0.37 -0.23 3.58 0.15 0.29 -3.79 113.70 109.76 2g0k s SER 111 Ca 0.30 0.87 -0.10 0.00 0.70 0.00 0.00 55.95 57.73 2g0k s SER 111 Cb -0.06 0.89 -0.05 0.00 -1.71 0.00 0.00 66.02 65.09 2g0k s SER 111 CO 0.18 -0.20 0.13 -0.36 1.20 0.00 0.00 173.24 174.19 2g0k s PHE 112 N 1.78 3.27 0.00 3.44 0.40 -1.26 -2.70 117.98 122.91 2g0k s PHE 112 Ca -0.07 0.11 0.00 0.00 -0.60 0.00 0.00 56.93 56.37 2g0k s PHE 112 Cb -0.10 -2.24 0.00 0.00 0.51 0.00 0.00 43.02 41.20 2g0k s PHE 112 CO -0.12 0.01 0.00 0.09 0.70 0.00 0.00 175.22 175.90