#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 0.10 1.17 0.00 0.00 -1.26 -4.61 121.76 117.16 2g0k s ALA 2 Ca 0.00 0.30 -0.17 0.00 0.00 0.00 0.00 51.96 52.09 2g0k s ALA 2 Cb 0.00 -0.53 0.25 0.00 0.00 0.00 0.00 23.12 22.84 2g0k s ALA 2 CO 0.00 -0.37 1.02 -0.35 0.00 0.00 0.00 175.76 176.06 2g0k n PRO 3 N 4.91 -2.46 -3.51 0.00 -0.04 -1.26 -4.02 135.00 128.61 2g0k n PRO 3 Ca -0.12 -1.61 -0.42 0.00 -0.04 0.00 0.00 63.50 61.31 2g0k n PRO 3 Cb 0.50 -1.38 -0.10 0.00 -0.04 0.00 0.00 33.50 32.47 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 -2.95 4.96 0.01 0.52 2.01 0.51 -2.07 115.64 118.63 2g0k s THR 4 Ca 0.64 -0.79 0.07 0.00 0.31 0.00 0.00 61.69 61.91 2g0k s THR 4 Cb -0.05 -3.79 -0.02 0.00 0.01 0.00 0.00 72.50 68.65 2g0k s THR 4 CO 0.48 -0.31 -0.21 0.00 -0.69 0.00 0.00 174.62 173.88 2g0k s ALA 5 N 1.62 1.80 -0.28 7.40 0.00 -1.22 0.49 121.76 131.57 2g0k s ALA 5 Ca 0.04 -0.99 -0.09 0.00 0.00 0.00 0.00 51.96 50.92 2g0k s ALA 5 Cb -0.20 -0.42 -0.02 0.00 0.00 0.00 0.00 23.12 22.49 2g0k s ALA 5 CO 0.08 0.43 0.12 0.95 0.00 0.00 0.00 175.76 177.34 2g0k s THR 6 N -0.62 4.54 0.14 0.00 -4.23 0.36 -4.79 115.64 111.04 2g0k s THR 6 Ca 0.08 -0.27 0.09 0.00 -1.18 0.00 0.00 61.69 60.41 2g0k s THR 6 Cb -0.08 -3.22 -0.04 0.00 1.34 0.00 0.00 72.50 70.49 2g0k s THR 6 CO 0.00 0.19 -0.16 0.68 -0.54 0.00 0.00 174.62 174.80 2g0k s VAL 7 N 1.62 2.92 0.78 2.29 -7.23 -1.23 -1.41 120.40 118.15 2g0k s VAL 7 Ca 0.05 -1.59 -0.11 0.00 -1.81 0.00 0.00 61.98 58.52 2g0k s VAL 7 Cb -0.16 -2.38 0.06 0.00 0.56 0.00 0.00 36.38 34.45 2g0k s VAL 7 CO 0.06 0.02 1.09 0.28 -0.31 0.00 0.00 175.10 176.23 2g0k s THR 8 N -1.37 3.27 -0.13 5.32 -1.32 -0.67 -4.84 115.64 115.90 2g0k s THR 8 Ca 0.20 0.41 -0.29 0.00 -1.21 0.00 0.00 61.69 60.80 2g0k s THR 8 Cb -0.10 -3.13 -0.03 0.00 -1.51 0.00 0.00 72.50 67.73 2g0k s THR 8 CO 0.12 -0.54 1.40 -2.16 -2.21 0.00 0.00 174.62 171.23 2g0k s PRO 9 N -5.11 4.22 -0.09 7.08 0.04 -1.26 -4.56 135.00 135.33 2g0k s PRO 9 Ca 0.60 1.84 0.13 0.00 0.04 0.00 0.00 61.00 63.61 2g0k s PRO 9 Cb -0.15 -3.84 0.19 0.00 0.04 0.00 0.00 34.50 30.75 2g0k s PRO 9 CO 0.55 -0.75 1.10 0.43 0.04 0.00 0.00 177.00 178.36 2g0k n SER 10 N 6.77 2.23 -4.53 6.66 7.64 -1.26 -4.92 113.62 126.19 2g0k n SER 10 Ca 0.15 -2.73 -0.41 0.00 1.01 0.00 0.00 58.87 56.90 2g0k n SER 10 Cb 0.44 -0.29 -0.10 0.00 -1.01 0.00 0.00 64.21 63.25 2g0k n SER 10 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2g0k s SER 11 N -2.25 6.11 0.00 6.43 1.04 -1.06 -3.98 113.70 119.98 2g0k s SER 11 Ca 0.21 -0.37 0.00 0.00 0.48 0.00 0.00 55.95 56.28 2g0k s SER 11 Cb 0.19 -2.16 0.00 0.00 0.10 0.00 0.00 66.02 64.15 2g0k s SER 11 CO 0.02 -0.28 0.00 0.61 0.98 0.00 0.00 173.24 174.57 2g0k n GLY 12 N 5.05 0.60 3.50 7.32 0.00 -1.17 -4.51 105.19 115.98 2g0k n GLY 12 Ca -0.11 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.59 2g0k n GLY 12 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2g0k s LEU 13 N 0.00 2.79 0.00 0.99 0.05 -1.26 -4.54 118.68 116.71 2g0k s LEU 13 Ca 0.00 -0.26 0.00 0.00 0.05 0.00 0.00 54.13 53.92 2g0k s LEU 13 Cb 0.00 -1.60 0.00 0.00 -2.05 0.00 0.00 46.19 42.54 2g0k s LEU 13 CO 0.00 0.30 0.00 -1.54 -0.55 0.00 0.00 176.35 174.56 2g0k n SER 14 N 1.91 0.75 -4.22 1.48 3.41 -1.26 -4.81 113.62 110.89 2g0k n SER 14 Ca -0.16 -0.78 -0.38 0.00 -0.26 0.00 0.00 58.87 57.29 2g0k n SER 14 Cb 0.52 0.00 0.03 0.00 -0.26 0.00 0.00 64.21 64.50 2g0k n SER 14 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 2g0k n ASP 15 N -1.74 -3.89 0.00 4.04 2.03 -1.24 -2.25 116.55 113.50 2g0k n ASP 15 Ca 0.00 0.50 0.00 0.00 0.52 0.00 0.00 54.79 55.81 2g0k n ASP 15 Cb 0.00 -0.89 0.00 0.00 -0.72 0.00 0.00 41.12 39.51 2g0k n ASP 15 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2g0k n GLY 16 N 2.63 3.21 3.76 0.27 0.00 -1.25 -4.96 105.19 108.85 2g0k n GLY 16 Ca 0.05 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.68 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 -2.39 4.13 -0.27 2.61 2.01 -0.96 -5.02 115.64 115.76 2g0k s THR 17 Ca 0.00 1.98 0.03 0.00 0.31 0.00 0.00 61.69 64.01 2g0k s THR 17 Cb 0.00 -4.22 0.06 0.00 0.01 0.00 0.00 72.50 68.35 2g0k s THR 17 CO 0.00 0.39 -0.10 0.54 -0.69 0.00 0.00 174.62 174.76 2g0k s VAL 18 N -1.32 2.26 0.57 3.82 0.11 -1.26 -2.47 120.40 122.11 2g0k s VAL 18 Ca 0.44 -1.63 -0.08 0.00 -2.93 0.00 0.00 61.98 57.78 2g0k s VAL 18 Cb -0.23 -2.33 -0.03 0.00 -1.53 0.00 0.00 36.38 32.26 2g0k s VAL 18 CO 0.29 -0.05 0.92 0.54 -3.33 0.00 0.00 175.10 173.48 2g0k s VAL 19 N 1.11 4.53 0.14 2.04 0.11 0.20 -4.89 120.40 123.63 2g0k s VAL 19 Ca -0.08 0.46 0.10 0.00 -2.93 0.00 0.00 61.98 59.53 2g0k s VAL 19 Cb -0.20 -3.77 -0.04 0.00 -1.53 0.00 0.00 36.38 30.83 2g0k s VAL 19 CO -0.05 -0.89 -0.23 -0.75 -3.33 0.00 0.00 175.10 169.85 2g0k s LYS 20 N -5.00 1.55 -0.20 1.54 2.36 -1.26 -0.14 119.74 118.59 2g0k s LYS 20 Ca 0.52 -1.33 -0.04 0.00 -2.55 0.00 0.00 55.97 52.58 2g0k s LYS 20 Cb -0.11 -1.96 0.09 0.00 -1.05 0.00 0.00 37.83 34.80 2g0k s LYS 20 CO 0.49 0.45 0.18 0.08 1.55 0.00 0.00 175.35 178.11 2g0k s VAL 21 N -1.20 -0.25 -0.19 4.02 1.01 -0.92 -1.68 120.40 121.20 2g0k s VAL 21 Ca 0.17 -0.16 0.01 0.00 0.00 0.00 0.00 61.98 61.99 2g0k s VAL 21 Cb -0.10 -0.67 0.03 0.00 0.00 0.00 0.00 36.38 35.65 2g0k s VAL 21 CO 0.08 -0.25 -0.15 0.00 0.00 0.00 0.00 175.10 174.78 2g0k s ALA 22 N 2.27 2.18 0.26 5.51 0.00 -0.50 -2.07 121.76 129.41 2g0k s ALA 22 Ca 0.06 -1.24 -0.22 0.00 0.00 0.00 0.00 51.96 50.56 2g0k s ALA 22 Cb -0.16 -1.25 -0.09 0.00 0.00 0.00 0.00 23.12 21.63 2g0k s ALA 22 CO -0.13 -0.62 0.80 0.20 0.00 0.00 0.00 175.76 176.02 2g0k s GLY 23 N 1.33 2.66 -0.19 0.00 0.00 -1.06 0.14 107.32 110.20 2g0k s GLY 23 Ca 0.01 0.29 -0.04 0.00 0.00 0.00 0.00 44.72 44.98 2g0k s GLY 23 CO -0.10 0.67 0.17 0.00 0.00 0.00 0.00 173.10 173.84 2g0k s ALA 24 N -1.58 0.02 0.00 3.20 0.00 1.84 -2.97 121.76 122.27 2g0k s ALA 24 Ca 0.46 -0.01 0.00 0.00 0.00 0.00 0.00 51.96 52.41 2g0k s ALA 24 Cb -0.17 -1.22 0.00 0.00 0.00 0.00 0.00 23.12 21.73 2g0k s ALA 24 CO 0.22 -1.22 0.00 0.41 0.00 0.00 0.00 175.76 175.17 2g0k n GLY 25 N 5.30 1.02 3.97 0.00 0.00 -1.12 -0.36 105.19 114.00 2g0k n GLY 25 Ca -0.06 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.72 2g0k n GLY 25 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2g0k s LEU 26 N 0.00 2.98 0.02 0.99 1.02 -1.05 -4.75 118.68 117.89 2g0k s LEU 26 Ca 0.00 -0.11 -0.32 0.00 0.02 0.00 0.00 54.13 53.72 2g0k s LEU 26 Cb 0.00 -2.35 -0.10 0.00 0.02 0.00 0.00 46.19 43.76 2g0k s LEU 26 CO 0.00 -1.78 1.91 0.00 0.02 0.00 0.00 176.35 176.51 2g0k n GLN 27 N -2.85 2.64 -2.34 1.70 6.02 -1.26 -4.57 117.38 116.72 2g0k n GLN 27 Ca 0.13 0.97 -0.42 0.00 -0.01 0.00 0.00 57.00 57.66 2g0k n GLN 27 Cb 0.60 -2.87 -0.03 0.00 1.02 0.00 0.00 30.24 28.96 2g0k n GLN 27 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2g0k s ALA 28 N 3.91 3.47 0.00 -1.58 0.00 -1.26 -2.23 121.76 124.06 2g0k s ALA 28 Ca 0.88 0.90 0.00 0.00 0.00 0.00 0.00 51.96 53.75 2g0k s ALA 28 Cb -0.52 -3.49 0.00 0.00 0.00 0.00 0.00 23.12 19.11 2g0k s ALA 28 CO 0.44 -0.55 0.00 0.41 0.00 0.00 0.00 175.76 176.06 2g0k n GLY 29 N 3.34 0.54 3.86 0.00 0.00 -0.16 -4.94 105.19 107.83 2g0k n GLY 29 Ca 0.10 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.76 2g0k n GLY 29 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2g0k s THR 30 N -2.25 5.11 0.32 2.61 2.01 -0.95 -4.83 115.64 117.67 2g0k s THR 30 Ca 0.00 0.52 -0.12 0.00 0.31 0.00 0.00 61.69 62.40 2g0k s THR 30 Cb 0.00 -3.64 -0.08 0.00 0.01 0.00 0.00 72.50 68.79 2g0k s THR 30 CO 0.00 0.39 0.69 0.00 -0.69 0.00 0.00 174.62 175.01 2g0k s ALA 31 N -1.29 3.40 -0.00 7.40 0.00 -1.26 -2.14 121.76 127.87 2g0k s ALA 31 Ca 0.29 -0.12 0.00 0.00 0.00 0.00 0.00 51.96 52.14 2g0k s ALA 31 Cb -0.14 -2.65 0.00 0.00 0.00 0.00 0.00 23.12 20.32 2g0k s ALA 31 CO 0.16 0.28 -0.01 0.71 0.00 0.00 0.00 175.76 176.90 2g0k s TYR 32 N -2.05 0.13 -0.33 0.00 2.02 -0.98 -3.95 117.35 112.20 2g0k s TYR 32 Ca 0.51 -0.02 -0.09 0.00 -0.37 0.00 0.00 57.07 57.10 2g0k s TYR 32 Cb -0.10 -0.10 0.01 0.00 -0.40 0.00 0.00 41.96 41.37 2g0k s TYR 32 CO 0.22 -0.01 0.15 -0.51 -1.57 0.00 0.00 175.55 173.83 2g0k s ASP 33 N 0.04 5.50 0.02 2.29 1.01 5.82 -3.18 116.67 128.16 2g0k s ASP 33 Ca -0.00 -0.72 -0.01 0.00 0.71 0.00 0.00 52.55 52.53 2g0k s ASP 33 Cb -0.01 -1.98 -0.04 0.00 1.01 0.00 0.00 42.92 41.90 2g0k s ASP 33 CO -0.00 -0.25 0.15 -0.69 0.21 0.00 0.00 175.17 174.58 2g0k s VAL 34 N 1.56 5.10 -0.05 -1.27 1.01 -0.39 1.43 120.40 127.79 2g0k s VAL 34 Ca 0.03 -0.38 -0.31 0.00 0.00 0.00 0.00 61.98 61.32 2g0k s VAL 34 Cb -0.18 -3.41 0.12 0.00 0.00 0.00 0.00 36.38 32.91 2g0k s VAL 34 CO 0.05 0.25 1.19 -0.83 0.00 0.00 0.00 175.10 175.77 2g0k s GLY 35 N -2.11 -0.36 -0.21 4.51 0.00 3.56 -0.55 107.32 112.16 2g0k s GLY 35 Ca 0.28 0.93 -0.05 0.00 0.00 0.00 0.00 44.72 45.88 2g0k s GLY 35 CO 0.20 0.25 0.01 1.62 0.00 0.00 0.00 173.10 175.18 2g0k s GLN 36 N -2.58 3.61 0.03 2.90 0.74 -1.26 -0.58 119.66 122.52 2g0k s GLN 36 Ca 0.12 -0.52 0.08 0.00 0.05 0.00 0.00 55.36 55.09 2g0k s GLN 36 Cb 0.02 -3.12 -0.03 0.00 1.10 0.00 0.00 33.01 30.98 2g0k s GLN 36 CO -0.04 -0.03 -0.21 0.00 -0.55 0.00 0.00 175.29 174.46 2g0k s ALA 38 N -0.84 1.73 0.11 0.00 0.00 0.37 -2.67 121.76 120.47 2g0k s ALA 38 Ca 0.13 -0.85 -0.31 0.00 0.00 0.00 0.00 51.96 50.93 2g0k s ALA 38 Cb -0.10 -0.50 -0.09 0.00 0.00 0.00 0.00 23.12 22.43 2g0k s ALA 38 CO 0.03 0.37 1.56 -0.46 0.00 0.00 0.00 175.76 177.26 2g0k s TRP 39 N -0.25 2.85 -0.12 0.00 -0.00 -1.25 -0.14 118.94 120.02 2g0k s TRP 39 Ca 0.02 0.58 -0.10 0.00 -0.00 0.00 0.00 56.10 56.60 2g0k s TRP 39 Cb -0.10 -3.89 -0.06 0.00 -0.00 0.00 0.00 33.47 29.43 2g0k s TRP 39 CO 0.01 -3.36 -0.22 0.28 -0.00 0.00 0.00 176.95 173.66 2g0k n VAL 40 N 4.28 1.19 -4.39 5.86 0.31 0.13 -4.82 118.33 120.90 2g0k n VAL 40 Ca 0.14 0.00 -0.19 0.00 -0.01 0.00 0.00 64.34 64.28 2g0k n VAL 40 Cb 0.40 -1.91 -0.10 0.00 -0.91 0.00 0.00 33.84 31.32 2g0k n VAL 40 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2g0k s ASP 41 N -6.25 2.09 -0.32 4.52 -1.08 0.37 -4.98 116.67 111.01 2g0k s ASP 41 Ca -0.21 -1.29 -0.36 0.00 -0.52 0.00 0.00 52.55 50.17 2g0k s ASP 41 Cb 0.06 -0.03 -0.12 0.00 -1.46 0.00 0.00 42.92 41.37 2g0k s ASP 41 CO 0.29 -0.55 2.11 1.07 0.52 0.00 0.00 175.17 178.61 2g0k n THR 42 N -0.55 0.23 -0.96 1.71 5.66 -1.26 0.21 114.28 119.32 2g0k n THR 42 Ca -0.03 -0.22 0.00 0.00 -3.05 0.00 0.00 64.05 60.75 2g0k n THR 42 Cb 0.65 -1.60 0.00 0.00 -1.55 0.00 0.00 70.33 67.84 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 6.09 0.35 3.02 1.09 0.00 -1.26 -4.97 105.19 109.52 2g0k n GLY 43 Ca 0.38 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 46.09 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 1.83 -0.08 1.61 1.01 0.55 -5.09 120.40 118.43 2g0k s VAL 44 Ca 0.00 -1.24 0.04 0.00 0.00 0.00 0.00 61.98 60.78 2g0k s VAL 44 Cb 0.00 -1.92 -0.00 0.00 0.00 0.00 0.00 36.38 34.45 2g0k s VAL 44 CO 0.00 0.10 -0.22 -1.48 0.00 0.00 0.00 175.10 173.50 2g0k s LEU 45 N 1.29 2.00 0.33 3.92 2.34 -1.26 0.14 118.68 127.44 2g0k s LEU 45 Ca -0.04 -0.49 -0.08 0.00 0.06 0.00 0.00 54.13 53.58 2g0k s LEU 45 Cb -0.18 -1.26 -0.06 0.00 -0.56 0.00 0.00 46.19 44.13 2g0k s LEU 45 CO -0.07 0.16 0.65 0.00 -1.06 0.00 0.00 176.35 176.03 2g0k s ALA 46 N 0.22 3.49 0.21 1.48 0.00 0.80 -3.42 121.76 124.55 2g0k s ALA 46 Ca -0.13 -0.34 0.08 0.00 0.00 0.00 0.00 51.96 51.57 2g0k s ALA 46 Cb -0.16 -2.50 -0.04 0.00 0.00 0.00 0.00 23.12 20.42 2g0k s ALA 46 CO 0.06 0.19 0.02 0.00 0.00 0.00 0.00 175.76 176.03 2g0k s ASN 48 N -3.27 4.97 0.00 0.00 2.47 -0.93 0.54 114.94 118.72 2g0k s ASN 48 Ca 0.29 -1.57 0.20 0.00 0.42 0.00 0.00 52.86 52.20 2g0k s ASN 48 Cb -0.08 -1.73 1.18 0.00 -1.45 0.00 0.00 41.25 39.16 2g0k s ASN 48 CO 0.20 -0.35 1.57 -0.81 -3.72 0.00 0.00 177.10 173.99 2g0k n PRO 49 N 4.57 0.61 0.02 0.43 -0.04 -1.26 -2.07 135.00 137.27 2g0k n PRO 49 Ca -0.08 0.00 0.12 0.00 -0.04 0.00 0.00 63.50 63.50 2g0k n PRO 49 Cb 0.43 -1.50 0.24 0.00 -0.04 0.00 0.00 33.50 32.62 2g0k n PRO 49 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2g0k n ALA 50 N -1.00 3.29 -1.92 0.55 0.00 -1.26 -3.88 120.51 116.28 2g0k n ALA 50 Ca 0.15 -0.31 0.05 0.00 0.00 0.00 0.00 53.44 53.33 2g0k n ALA 50 Cb 0.07 -1.15 0.10 0.00 0.00 0.00 0.00 19.45 18.47 2g0k n ALA 50 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2g0k n ASP 51 N -1.70 1.29 -4.56 0.00 5.68 -0.88 -5.02 116.55 111.37 2g0k n ASP 51 Ca 0.05 -2.82 -0.43 0.00 -0.50 0.00 0.00 54.79 51.09 2g0k n ASP 51 Cb 0.37 -0.38 -0.03 0.00 -1.14 0.00 0.00 41.12 39.93 2g0k n ASP 51 CO 0.00 0.00 0.00 -0.36 -1.33 0.00 0.00 177.20 175.51 2g0k s PHE 52 N -1.53 2.74 0.45 2.11 0.08 -1.22 -4.05 117.98 116.56 2g0k s PHE 52 Ca 0.30 0.26 0.08 0.00 0.12 0.00 0.00 56.93 57.69 2g0k s PHE 52 Cb 0.31 -4.26 0.02 0.00 -0.57 0.00 0.00 43.02 38.52 2g0k s PHE 52 CO -0.08 -1.41 0.58 0.45 -0.10 0.00 0.00 175.22 174.66 2g0k s SER 53 N 2.79 5.46 0.04 1.36 0.15 0.28 -4.98 113.70 118.79 2g0k s SER 53 Ca 0.37 -0.56 -0.10 0.00 0.70 0.00 0.00 55.95 56.37 2g0k s SER 53 Cb -0.10 -0.45 0.01 0.00 -1.71 0.00 0.00 66.02 63.77 2g0k s SER 53 CO 0.23 -0.86 0.20 -0.94 1.20 0.00 0.00 173.24 173.07 2g0k s SER 54 N -4.38 0.01 0.03 5.45 1.04 -1.26 -2.16 113.70 112.43 2g0k s SER 54 Ca 0.55 -0.33 -0.28 0.00 0.48 0.00 0.00 55.95 56.37 2g0k s SER 54 Cb -0.08 0.29 0.10 0.00 0.10 0.00 0.00 66.02 66.42 2g0k s SER 54 CO 0.33 -0.54 0.89 0.54 0.98 0.00 0.00 173.24 175.43 2g0k s VAL 55 N -2.43 0.00 -0.04 5.02 0.11 -1.19 -4.98 120.40 116.89 2g0k s VAL 55 Ca -0.06 -0.10 0.04 0.00 -2.93 0.00 0.00 61.98 58.93 2g0k s VAL 55 Cb -0.02 -1.15 -0.00 0.00 -1.53 0.00 0.00 36.38 33.68 2g0k s VAL 55 CO -0.03 0.00 -0.15 -0.89 -3.33 0.00 0.00 175.10 170.70 2g0k s THR 56 N -3.17 1.22 0.15 5.04 2.01 -1.26 -2.32 115.64 117.31 2g0k s THR 56 Ca 0.06 -0.60 -0.30 0.00 0.31 0.00 0.00 61.69 61.15 2g0k s THR 56 Cb -0.01 -1.05 -0.07 0.00 0.01 0.00 0.00 72.50 71.38 2g0k s THR 56 CO -0.08 0.36 1.07 0.00 -0.69 0.00 0.00 174.62 175.28 2g0k s ALA 57 N 0.06 3.34 1.05 7.40 0.00 -0.91 -4.68 121.76 128.02 2g0k s ALA 57 Ca -0.03 0.75 -0.10 0.00 0.00 0.00 0.00 51.96 52.59 2g0k s ALA 57 Cb -0.10 -3.34 0.14 0.00 0.00 0.00 0.00 23.12 19.82 2g0k s ALA 57 CO 0.01 -0.17 0.68 -0.40 0.00 0.00 0.00 175.76 175.88 2g0k n ASP 58 N 2.56 -0.59 0.32 0.00 5.68 -0.88 -0.99 116.55 122.65 2g0k n ASP 58 Ca 0.03 -1.11 0.22 0.00 -0.50 0.00 0.00 54.79 53.43 2g0k n ASP 58 Cb 0.47 -0.55 1.12 0.00 -1.14 0.00 0.00 41.12 41.02 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 -2.09 1.00 -0.09 2.12 0.00 -1.92 0.19 119.26 118.48 2g0k h ALA 59 Ca -0.23 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.68 2g0k h ALA 59 Cb 0.66 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.45 2g0k h ALA 59 CO 0.16 0.00 0.00 -1.71 0.00 0.00 0.00 179.25 177.70 2g0k n ASN 60 N -3.04 0.60 -2.68 0.00 5.15 -1.26 -4.86 115.26 109.17 2g0k n ASN 60 Ca -0.02 -1.73 -0.20 0.00 -0.60 0.00 0.00 54.58 52.02 2g0k n ASN 60 Cb 0.10 -0.06 0.01 0.00 -0.53 0.00 0.00 39.78 39.30 2g0k n ASN 60 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2g0k n GLY 61 N 0.81 -0.51 3.02 8.20 0.00 0.66 -4.74 105.19 112.64 2g0k n GLY 61 Ca 0.10 0.05 -0.22 0.00 0.00 0.00 0.00 46.02 45.95 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 -2.31 1.42 0.28 1.61 0.15 -1.26 -2.53 113.70 111.06 2g0k s SER 62 Ca 0.13 -0.22 0.06 0.00 0.70 0.00 0.00 55.95 56.62 2g0k s SER 62 Cb -0.06 -0.44 -0.06 0.00 -1.71 0.00 0.00 66.02 63.75 2g0k s SER 62 CO 0.16 0.07 -0.04 0.00 1.20 0.00 0.00 173.24 174.63 2g0k s ALA 63 N 0.28 2.31 -0.08 5.45 0.00 -1.16 -2.07 121.76 126.50 2g0k s ALA 63 Ca -0.05 -1.91 -0.04 0.00 0.00 0.00 0.00 51.96 49.95 2g0k s ALA 63 Cb -0.10 0.27 0.04 0.00 0.00 0.00 0.00 23.12 23.32 2g0k s ALA 63 CO 0.01 -0.11 0.19 -1.12 0.00 0.00 0.00 175.76 174.73 2g0k s SER 64 N -3.44 -0.18 0.24 0.00 0.01 -1.26 -2.55 113.70 106.51 2g0k s SER 64 Ca 0.30 0.40 -0.12 0.00 1.31 0.00 0.00 55.95 57.85 2g0k s SER 64 Cb 0.05 0.29 -0.01 0.00 0.21 0.00 0.00 66.02 66.56 2g0k s SER 64 CO 0.12 -0.15 0.44 0.28 0.41 0.00 0.00 173.24 174.34 2g0k s THR 65 N 1.19 0.00 -0.14 1.44 -1.32 -0.88 -4.93 115.64 111.00 2g0k s THR 65 Ca -0.09 -1.46 -0.00 0.00 -1.21 0.00 0.00 61.69 58.93 2g0k s THR 65 Cb -0.11 -2.21 0.03 0.00 -1.51 0.00 0.00 72.50 68.70 2g0k s THR 65 CO -0.07 -0.01 -0.07 -0.44 -2.21 0.00 0.00 174.62 171.82 2g0k s SER 66 N -3.03 2.56 0.25 8.08 0.01 -1.26 -2.16 113.70 118.16 2g0k s SER 66 Ca 0.24 -0.51 0.02 0.00 1.31 0.00 0.00 55.95 57.01 2g0k s SER 66 Cb 0.00 -0.91 -0.03 0.00 0.21 0.00 0.00 66.02 65.29 2g0k s SER 66 CO 0.09 -0.15 0.42 -0.22 0.41 0.00 0.00 173.24 173.79 2g0k s LEU 67 N 1.65 4.20 -0.05 2.44 0.20 0.80 -4.94 118.68 122.99 2g0k s LEU 67 Ca 0.03 0.29 0.06 0.00 0.69 0.00 0.00 54.13 55.20 2g0k s LEU 67 Cb -0.14 -3.09 -0.02 0.00 -0.43 0.00 0.00 46.19 42.51 2g0k s LEU 67 CO -0.08 -0.12 -0.23 0.28 -0.29 0.00 0.00 176.35 175.91 2g0k s THR 68 N -2.03 2.28 -0.21 3.68 -1.32 -1.26 0.60 115.64 117.39 2g0k s THR 68 Ca 0.37 -1.00 -0.08 0.00 -1.21 0.00 0.00 61.69 59.77 2g0k s THR 68 Cb -0.10 -1.84 -0.04 0.00 -1.51 0.00 0.00 72.50 69.01 2g0k s THR 68 CO 0.31 0.57 0.09 0.54 -2.21 0.00 0.00 174.62 173.92 2g0k s VAL 69 N -0.34 4.84 -0.01 5.08 0.11 -1.03 -4.87 120.40 124.19 2g0k s VAL 69 Ca 0.02 -0.01 0.04 0.00 -2.93 0.00 0.00 61.98 59.11 2g0k s VAL 69 Cb -0.12 -3.22 -0.03 0.00 -1.53 0.00 0.00 36.38 31.48 2g0k s VAL 69 CO 0.02 0.41 -0.13 -0.13 -3.33 0.00 0.00 175.10 171.94 2g0k s ARG 70 N 0.80 2.40 0.34 1.54 3.00 -1.26 -3.59 118.95 122.17 2g0k s ARG 70 Ca 0.05 -0.78 0.03 0.00 0.00 0.00 0.00 55.73 55.03 2g0k s ARG 70 Cb -0.13 -2.36 0.61 0.00 0.00 0.00 0.00 34.95 33.06 2g0k s ARG 70 CO 0.02 0.59 1.91 0.07 0.00 0.00 0.00 175.30 177.90 2g0k h ARG 71 N 4.87 0.63 -3.10 3.54 0.11 -1.93 -3.40 114.38 115.10 2g0k h ARG 71 Ca -0.47 -0.10 -0.06 0.00 0.10 0.00 0.00 59.98 59.44 2g0k h ARG 71 Cb 1.16 -0.11 -0.15 0.00 1.11 0.00 0.00 29.97 31.98 2g0k h ARG 71 CO 0.50 0.56 -0.04 -1.54 0.10 0.00 0.00 179.97 179.56 2g0k s SER 72 N -6.66 -0.32 -0.25 0.08 1.04 -1.26 0.21 113.70 106.54 2g0k s SER 72 Ca -0.08 -0.08 -0.34 0.00 0.48 0.00 0.00 55.95 55.93 2g0k s SER 72 Cb 0.16 0.47 0.16 0.00 0.10 0.00 0.00 66.02 66.91 2g0k s SER 72 CO 0.77 -0.77 1.29 0.72 0.98 0.00 0.00 173.24 176.23 2g0k s PHE 73 N -3.05 -0.08 -0.31 5.02 -0.12 -0.92 -4.94 117.98 113.58 2g0k s PHE 73 Ca -0.02 0.09 -0.33 0.00 -0.05 0.00 0.00 56.93 56.62 2g0k s PHE 73 Cb 0.00 0.50 -0.10 0.00 -0.63 0.00 0.00 43.02 42.80 2g0k s PHE 73 CO -0.07 -0.11 2.20 -0.85 -0.05 0.00 0.00 175.22 176.35 2g0k n GLU 74 N 0.20 1.32 -2.07 1.99 0.28 -1.26 -0.29 120.64 120.81 2g0k n GLU 74 Ca 0.01 0.35 -0.40 0.00 -0.16 0.00 0.00 57.16 56.96 2g0k n GLU 74 Cb 0.58 -2.68 -0.03 0.00 1.43 0.00 0.00 31.44 30.74 2g0k n GLU 74 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 177.13 177.17 2g0k s GLY 75 N 7.64 0.42 -0.70 -1.84 0.00 0.32 -4.24 107.32 108.91 2g0k s GLY 75 Ca 1.07 -0.43 -0.25 0.00 0.00 0.00 0.00 44.72 45.11 2g0k s GLY 75 CO 0.45 3.31 1.15 -1.36 0.00 0.00 0.00 173.10 176.65 2g0k s PHE 76 N 8.21 2.44 0.33 1.90 0.40 2.14 -0.89 117.98 132.51 2g0k s PHE 76 Ca 0.69 -0.23 -0.29 0.00 -0.60 0.00 0.00 56.93 56.49 2g0k s PHE 76 Cb -0.15 -4.49 -0.12 0.00 0.51 0.00 0.00 43.02 38.77 2g0k s PHE 76 CO 0.24 -1.90 1.45 -0.11 0.70 0.00 0.00 175.22 175.61 2g0k n LEU 77 N 8.69 4.09 -0.34 -0.37 7.94 0.12 0.57 117.00 137.70 2g0k n LEU 77 Ca 0.00 1.19 0.19 0.00 -1.11 0.00 0.00 56.01 56.28 2g0k n LEU 77 Cb 0.48 -1.55 0.40 0.00 0.53 0.00 0.00 43.42 43.28 2g0k n LEU 77 CO 0.68 -0.12 1.13 -0.26 -1.11 0.00 0.00 177.39 177.72 2g0k h PHE 78 N 3.49 0.94 0.00 1.96 -1.00 -1.86 1.78 116.94 122.26 2g0k h PHE 78 Ca -0.48 0.04 0.00 0.00 2.81 0.00 0.00 57.97 60.34 2g0k h PHE 78 Cb 1.25 -0.26 0.00 0.00 3.61 0.00 0.00 35.95 40.55 2g0k h PHE 78 CO 0.54 -0.02 0.11 0.22 -1.61 0.00 0.00 178.31 177.56 2g0k h ASP 79 N 0.49 0.00 0.00 2.17 3.58 -1.91 -3.44 116.42 117.30 2g0k h ASP 79 Ca 0.66 0.00 0.00 0.00 0.42 0.00 0.00 57.03 58.11 2g0k h ASP 79 Cb 1.33 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.38 2g0k h ASP 79 CO -0.52 0.00 0.00 0.61 -2.88 0.00 0.00 179.24 176.45 2g0k n GLY 80 N -1.22 1.52 3.58 -0.78 0.00 0.61 -5.10 105.19 103.80 2g0k n GLY 80 Ca -0.02 -0.21 -0.30 0.00 0.00 0.00 0.00 46.02 45.49 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 3.43 -0.86 2.61 2.01 -1.13 -4.90 115.64 114.80 2g0k s THR 81 Ca 0.00 -1.14 -0.23 0.00 0.31 0.00 0.00 61.69 60.63 2g0k s THR 81 Cb 0.00 -2.57 0.07 0.00 0.01 0.00 0.00 72.50 70.01 2g0k s THR 81 CO 0.00 0.19 1.24 -0.60 -0.69 0.00 0.00 174.62 174.75 2g0k s ARG 82 N -2.00 3.41 0.20 4.92 3.52 -1.26 0.12 118.95 127.85 2g0k s ARG 82 Ca 0.20 -1.03 -0.08 0.00 -0.13 0.00 0.00 55.73 54.69 2g0k s ARG 82 Cb -0.11 -4.77 0.12 0.00 -1.56 0.00 0.00 34.95 28.63 2g0k s ARG 82 CO 0.12 -2.01 1.73 2.35 -0.81 0.00 0.00 175.30 176.68 2g0k h TRP 83 N 9.57 1.19 0.00 5.12 7.01 -1.38 -3.49 115.95 133.97 2g0k h TRP 83 Ca -0.01 -0.13 0.00 0.00 2.11 0.00 0.00 58.89 60.86 2g0k h TRP 83 Cb 1.03 -0.34 0.00 0.00 -2.10 0.00 0.00 29.16 27.75 2g0k h TRP 83 CO 1.16 0.95 0.00 0.41 -2.79 0.00 0.00 178.44 178.17 2g0k n GLY 84 N -0.72 2.96 3.58 2.65 0.00 -1.23 -4.92 105.19 107.51 2g0k n GLY 84 Ca 0.06 -1.91 -0.40 0.00 0.00 0.00 0.00 46.02 43.77 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 -2.01 3.02 0.41 2.61 2.01 -1.26 0.12 115.64 120.53 2g0k s THR 85 Ca 0.00 0.01 -0.12 0.00 0.31 0.00 0.00 61.69 61.90 2g0k s THR 85 Cb 0.00 -3.03 -0.07 0.00 0.01 0.00 0.00 72.50 69.42 2g0k s THR 85 CO 0.00 -0.02 0.79 0.68 -0.69 0.00 0.00 174.62 175.38 2g0k s VAL 86 N 9.83 4.74 -0.74 3.82 -7.23 0.60 -4.77 120.40 126.66 2g0k s VAL 86 Ca 0.99 0.72 -0.12 0.00 -1.81 0.00 0.00 61.98 61.76 2g0k s VAL 86 Cb -0.26 -3.72 0.19 0.00 0.56 0.00 0.00 36.38 33.15 2g0k s VAL 86 CO 0.31 -0.52 0.66 -1.81 -0.31 0.00 0.00 175.10 173.44 2g0k s ASP 87 N -3.07 6.37 0.66 4.85 1.11 -1.26 -2.16 116.67 123.16 2g0k s ASP 87 Ca 0.52 -2.59 0.32 0.00 0.18 0.00 0.00 52.55 50.98 2g0k s ASP 87 Cb -0.10 -2.13 1.73 0.00 1.07 0.00 0.00 42.92 43.48 2g0k s ASP 87 CO 0.30 -0.57 1.99 0.00 1.18 0.00 0.00 175.17 178.07 2g0k n THR 89 N -3.01 0.15 -0.03 0.00 -2.24 -1.16 -3.80 114.28 104.19 2g0k n THR 89 Ca -0.01 -0.34 -0.02 0.00 -2.27 0.00 0.00 64.05 61.41 2g0k n THR 89 Cb 0.36 0.48 -0.06 0.00 -2.10 0.00 0.00 70.33 69.00 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 0.36 0.37 -4.58 4.28 -1.04 0.51 -4.91 114.28 109.27 2g0k n THR 90 Ca 0.17 -0.28 -0.27 0.00 -2.04 0.00 0.00 64.05 61.63 2g0k n THR 90 Cb 0.36 -0.49 -0.06 0.00 -1.82 0.00 0.00 70.33 68.31 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 -2.14 0.46 -2.71 2.41 0.00 -0.68 -5.07 120.51 112.77 2g0k n ALA 91 Ca -0.09 -2.00 -0.39 0.00 0.00 0.00 0.00 53.44 50.95 2g0k n ALA 91 Cb 0.60 1.21 -0.05 0.00 0.00 0.00 0.00 19.45 21.20 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 -2.90 3.42 0.17 0.00 0.00 -1.26 -4.36 121.76 116.83 2g0k s ALA 92 Ca 0.09 -0.06 0.05 0.00 0.00 0.00 0.00 51.96 52.04 2g0k s ALA 92 Cb 0.00 -2.82 -0.04 0.00 0.00 0.00 0.00 23.12 20.27 2g0k s ALA 92 CO 0.06 -0.11 0.16 0.00 0.00 0.00 0.00 175.76 175.87 2g0k s GLN 94 N -3.16 0.50 0.42 0.00 0.74 -1.09 -0.66 119.66 116.41 2g0k s GLN 94 Ca 0.31 0.88 0.01 0.00 0.05 0.00 0.00 55.36 56.61 2g0k s GLN 94 Cb -0.10 0.07 -0.01 0.00 1.10 0.00 0.00 33.01 34.07 2g0k s GLN 94 CO 0.24 -0.14 0.63 0.08 -0.55 0.00 0.00 175.29 175.55 2g0k s VAL 95 N 1.26 4.22 -0.17 1.34 1.01 -1.10 -1.98 120.40 124.98 2g0k s VAL 95 Ca -0.08 -0.54 -0.35 0.00 0.00 0.00 0.00 61.98 61.01 2g0k s VAL 95 Cb -0.07 -3.55 0.15 0.00 0.00 0.00 0.00 36.38 32.91 2g0k s VAL 95 CO -0.12 -0.36 1.38 -0.83 0.00 0.00 0.00 175.10 175.16 2g0k s GLY 96 N -4.18 -0.35 -0.05 4.51 0.00 0.26 -3.03 107.32 104.48 2g0k s GLY 96 Ca 0.46 1.37 0.02 0.00 0.00 0.00 0.00 44.72 46.58 2g0k s GLY 96 CO 0.37 0.39 -0.10 0.48 0.00 0.00 0.00 173.10 174.23 2g0k s LEU 97 N -2.52 1.66 0.15 0.66 2.34 1.04 0.72 118.68 122.73 2g0k s LEU 97 Ca 0.13 -0.24 0.07 0.00 0.06 0.00 0.00 54.13 54.15 2g0k s LEU 97 Cb 0.03 -0.70 -0.04 0.00 -0.56 0.00 0.00 46.19 44.92 2g0k s LEU 97 CO -0.04 0.04 -0.04 -0.44 -1.06 0.00 0.00 176.35 174.81 2g0k s SER 98 N 0.50 4.63 0.00 1.48 0.01 14.28 -2.51 113.70 132.10 2g0k s SER 98 Ca -0.10 -0.40 0.00 0.00 1.31 0.00 0.00 55.95 56.76 2g0k s SER 98 Cb -0.13 -0.95 0.00 0.00 0.21 0.00 0.00 66.02 65.15 2g0k s SER 98 CO 0.02 0.12 0.00 -0.90 0.41 0.00 0.00 173.24 172.89 2g0k n ASP 99 N 0.17 1.30 -0.03 2.44 5.75 -0.98 0.93 116.55 126.13 2g0k n ASP 99 Ca -0.11 -0.25 -0.13 0.00 -0.01 0.00 0.00 54.79 54.30 2g0k n ASP 99 Cb 0.54 0.00 -0.08 0.00 -1.03 0.00 0.00 41.12 40.55 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 0.43 0.11 0.00 2.12 0.00 -1.92 -2.84 119.26 117.17 2g0k h ALA 100 Ca 0.00 -0.23 -0.03 0.00 0.00 0.00 0.00 54.91 54.65 2g0k h ALA 100 Cb 0.00 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.76 2g0k h ALA 100 CO 0.00 -0.15 -0.15 0.00 0.00 0.00 0.00 179.25 178.95 2g0k h ALA 101 N 0.65 1.17 -0.75 0.00 0.00 -1.96 -3.46 119.26 114.90 2g0k h ALA 101 Ca 0.02 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.79 2g0k h ALA 101 Cb 0.45 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.22 2g0k h ALA 101 CO 0.01 0.19 0.00 0.41 0.00 0.00 0.00 179.25 179.86 2g0k n GLY 102 N -0.37 0.66 3.34 0.00 0.00 -1.07 -5.12 105.19 102.62 2g0k n GLY 102 Ca -0.01 -0.36 -0.18 0.00 0.00 0.00 0.00 46.02 45.47 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 -1.90 1.46 0.06 1.61 6.03 -1.26 -4.83 114.94 116.11 2g0k s ASN 103 Ca 0.00 -1.44 -0.27 0.00 -1.03 0.00 0.00 52.86 50.12 2g0k s ASN 103 Cb 0.00 0.21 0.10 0.00 -3.03 0.00 0.00 41.25 38.53 2g0k s ASN 103 CO 0.00 -0.77 1.17 -0.83 -2.03 0.00 0.00 177.10 174.64 2g0k s GLY 104 N -3.36 -0.21 0.92 0.45 0.00 -1.26 -2.33 107.32 101.54 2g0k s GLY 104 Ca 0.36 0.23 -0.12 0.00 0.00 0.00 0.00 44.72 45.20 2g0k s GLY 104 CO 0.15 1.69 1.11 2.56 0.00 0.00 0.00 173.10 178.61 2g0k s PRO 105 N -2.46 1.06 -0.21 2.90 0.04 -1.26 -4.49 135.00 130.57 2g0k s PRO 105 Ca 0.18 0.50 -0.42 0.00 0.04 0.00 0.00 61.00 61.31 2g0k s PRO 105 Cb 0.01 -1.81 -0.20 0.00 0.04 0.00 0.00 34.50 32.54 2g0k s PRO 105 CO -0.00 -2.30 1.27 -0.85 0.04 0.00 0.00 177.00 175.16 2g0k n GLU 106 N -3.87 0.00 -0.96 4.56 0.28 -0.88 -4.57 120.64 115.19 2g0k n GLU 106 Ca 0.06 0.00 -0.35 0.00 -0.16 0.00 0.00 57.16 56.71 2g0k n GLU 106 Cb 0.57 -1.47 0.04 0.00 1.43 0.00 0.00 31.44 32.02 2g0k n GLU 106 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2g0k n GLY 107 N 2.53 -4.32 3.05 -1.84 0.00 -1.26 -4.86 105.19 98.49 2g0k n GLY 107 Ca 0.24 -0.69 -0.32 0.00 0.00 0.00 0.00 46.02 45.25 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 -1.93 2.38 0.06 1.61 1.01 -1.17 -5.06 120.40 117.30 2g0k s VAL 108 Ca 0.38 -2.14 -0.30 0.00 0.00 0.00 0.00 61.98 59.92 2g0k s VAL 108 Cb -0.14 -2.66 -0.04 0.00 0.00 0.00 0.00 36.38 33.53 2g0k s VAL 108 CO 0.78 -0.47 0.97 0.00 0.00 0.00 0.00 175.10 176.38 2g0k s ALA 109 N 0.98 3.21 0.20 5.51 0.00 -1.26 -2.70 121.76 127.69 2g0k s ALA 109 Ca 0.06 0.56 0.04 0.00 0.00 0.00 0.00 51.96 52.62 2g0k s ALA 109 Cb -0.20 -3.31 -0.01 0.00 0.00 0.00 0.00 23.12 19.60 2g0k s ALA 109 CO -0.07 -0.13 0.13 0.44 0.00 0.00 0.00 175.76 176.13 2g0k n ILE 110 N 3.33 0.00 -3.63 0.00 -5.35 0.17 -4.95 119.36 108.93 2g0k n ILE 110 Ca 0.04 -1.33 -0.03 0.00 -0.27 0.00 0.00 62.75 61.16 2g0k n ILE 110 Cb 0.50 0.60 -0.04 0.00 -1.74 0.00 0.00 39.64 38.96 2g0k n ILE 110 CO 0.00 0.00 0.00 -0.55 -1.76 0.00 0.00 176.55 174.24 2g0k s SER 111 N -2.31 -0.09 -0.25 7.28 0.15 -1.23 -3.82 113.70 113.42 2g0k s SER 111 Ca 0.18 0.07 -0.07 0.00 0.70 0.00 0.00 55.95 56.83 2g0k s SER 111 Cb 0.01 0.08 -0.02 0.00 -1.71 0.00 0.00 66.02 64.37 2g0k s SER 111 CO 0.13 -0.10 0.06 -0.36 1.20 0.00 0.00 173.24 174.17 2g0k s PHE 112 N -1.41 3.08 0.00 3.44 0.40 -1.26 -2.57 117.98 119.66 2g0k s PHE 112 Ca 0.08 -0.57 0.00 0.00 -0.60 0.00 0.00 56.93 55.85 2g0k s PHE 112 Cb -0.01 -2.22 0.00 0.00 0.51 0.00 0.00 43.02 41.30 2g0k s PHE 112 CO -0.05 -0.41 0.00 0.27 0.70 0.00 0.00 175.22 175.72