#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 3.55 1.16 0.00 0.00 -1.26 -4.69 121.76 120.52 2g0k s ALA 2 Ca 0.00 -0.16 -0.17 0.00 0.00 0.00 0.00 51.96 51.63 2g0k s ALA 2 Cb 0.00 -3.10 0.24 0.00 0.00 0.00 0.00 23.12 20.26 2g0k s ALA 2 CO 0.00 -0.64 0.97 -0.35 0.00 0.00 0.00 175.76 175.74 2g0k n PRO 3 N 5.25 -2.38 -3.46 0.00 -0.04 -1.26 -4.10 135.00 129.02 2g0k n PRO 3 Ca 0.01 -1.54 -0.42 0.00 -0.04 0.00 0.00 63.50 61.51 2g0k n PRO 3 Cb 0.49 -1.32 -0.10 0.00 -0.04 0.00 0.00 33.50 32.53 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 -2.87 5.25 0.20 0.52 2.01 0.19 -2.30 115.64 118.64 2g0k s THR 4 Ca 0.61 -0.51 0.08 0.00 0.31 0.00 0.00 61.69 62.17 2g0k s THR 4 Cb -0.05 -3.89 -0.05 0.00 0.01 0.00 0.00 72.50 68.53 2g0k s THR 4 CO 0.46 -0.25 -0.15 0.00 -0.69 0.00 0.00 174.62 173.99 2g0k s ALA 5 N 1.74 1.98 -0.14 7.40 0.00 -1.23 0.68 121.76 132.20 2g0k s ALA 5 Ca 0.06 -1.64 0.01 0.00 0.00 0.00 0.00 51.96 50.39 2g0k s ALA 5 Cb -0.18 -0.09 0.02 0.00 0.00 0.00 0.00 23.12 22.87 2g0k s ALA 5 CO 0.10 0.07 -0.15 0.95 0.00 0.00 0.00 175.76 176.74 2g0k s THR 6 N -2.91 1.60 0.06 0.00 -4.23 0.53 -4.86 115.64 105.83 2g0k s THR 6 Ca 0.22 -0.66 0.08 0.00 -1.18 0.00 0.00 61.69 60.14 2g0k s THR 6 Cb -0.01 -1.48 -0.03 0.00 1.34 0.00 0.00 72.50 72.31 2g0k s THR 6 CO 0.07 0.46 -0.20 -0.69 -0.54 0.00 0.00 174.62 173.72 2g0k s VAL 7 N 1.35 2.69 0.98 2.29 1.01 -1.23 -0.95 120.40 126.54 2g0k s VAL 7 Ca 0.02 -1.31 -0.12 0.00 0.00 0.00 0.00 61.98 60.57 2g0k s VAL 7 Cb -0.13 -2.15 0.18 0.00 0.00 0.00 0.00 36.38 34.27 2g0k s VAL 7 CO -0.09 0.27 1.09 0.28 0.00 0.00 0.00 175.10 176.66 2g0k s THR 8 N -0.97 2.27 -0.16 3.92 -1.32 -0.71 -4.85 115.64 113.83 2g0k s THR 8 Ca 0.15 0.09 -0.29 0.00 -1.21 0.00 0.00 61.69 60.43 2g0k s THR 8 Cb -0.10 -2.54 -0.02 0.00 -1.51 0.00 0.00 72.50 68.33 2g0k s THR 8 CO 0.06 -0.12 1.42 -2.16 -2.21 0.00 0.00 174.62 171.61 2g0k s PRO 9 N -4.91 4.12 0.00 7.08 0.04 -1.26 -4.60 135.00 135.46 2g0k s PRO 9 Ca 0.65 1.75 0.00 0.00 0.04 0.00 0.00 61.00 63.44 2g0k s PRO 9 Cb -0.19 -3.88 0.00 0.00 0.04 0.00 0.00 34.50 30.48 2g0k s PRO 9 CO 0.58 -0.88 0.75 0.45 0.04 0.00 0.00 177.00 177.94 2g0k n SER 10 N 7.14 1.03 -4.53 6.66 2.88 -1.26 -4.92 113.62 120.61 2g0k n SER 10 Ca 0.16 -1.51 -0.43 0.00 -1.33 0.00 0.00 58.87 55.76 2g0k n SER 10 Cb 0.45 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.87 2g0k n SER 10 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2g0k s SER 11 N -0.51 6.37 0.00 -3.46 1.04 -1.13 -3.25 113.70 112.75 2g0k s SER 11 Ca 0.00 -0.25 0.00 0.00 0.48 0.00 0.00 55.95 56.18 2g0k s SER 11 Cb 0.00 -2.45 0.00 0.00 0.10 0.00 0.00 66.02 63.67 2g0k s SER 11 CO 0.00 -1.22 0.00 0.61 0.98 0.00 0.00 173.24 173.61 2g0k n GLY 12 N 5.09 1.08 3.66 7.32 0.00 -0.42 -4.09 105.19 117.82 2g0k n GLY 12 Ca 0.03 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.70 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 3.64 0.69 0.99 1.43 -1.20 -4.10 118.68 120.13 2g0k s LEU 13 Ca 0.00 0.11 -0.00 0.00 -1.03 0.00 0.00 54.13 53.21 2g0k s LEU 13 Cb 0.00 -1.86 0.11 0.00 0.03 0.00 0.00 46.19 44.47 2g0k s LEU 13 CO 0.00 0.30 0.96 -0.55 0.23 0.00 0.00 176.35 177.29 2g0k s SER 14 N -0.41 4.51 0.67 2.29 0.15 -1.26 -4.87 113.70 114.78 2g0k s SER 14 Ca 0.08 -0.33 -0.17 0.00 0.70 0.00 0.00 55.95 56.23 2g0k s SER 14 Cb -0.12 -0.13 -0.10 0.00 -1.71 0.00 0.00 66.02 63.95 2g0k s SER 14 CO 0.02 -1.74 0.05 -0.67 1.20 0.00 0.00 173.24 172.09 2g0k n ASP 15 N -2.75 -2.98 0.00 5.45 -0.08 -1.25 -2.31 116.55 112.63 2g0k n ASP 15 Ca 0.14 0.56 0.00 0.00 -1.51 0.00 0.00 54.79 53.98 2g0k n ASP 15 Cb 0.60 -0.99 0.00 0.00 2.34 0.00 0.00 41.12 43.07 2g0k n ASP 15 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2g0k n GLY 16 N 2.31 3.23 3.77 0.27 0.00 -1.17 -4.97 105.19 108.63 2g0k n GLY 16 Ca 0.07 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.71 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 -2.51 3.36 -0.18 2.61 2.01 -0.98 -4.92 115.64 115.03 2g0k s THR 17 Ca 0.00 1.20 0.01 0.00 0.31 0.00 0.00 61.69 63.21 2g0k s THR 17 Cb 0.00 -3.70 0.01 0.00 0.01 0.00 0.00 72.50 68.82 2g0k s THR 17 CO 0.00 0.16 -0.18 0.54 -0.69 0.00 0.00 174.62 174.45 2g0k s VAL 18 N -1.37 2.24 0.14 3.82 0.11 -1.26 -1.39 120.40 122.68 2g0k s VAL 18 Ca 0.53 -0.89 0.02 0.00 -2.93 0.00 0.00 61.98 58.71 2g0k s VAL 18 Cb -0.30 -1.94 -0.04 0.00 -1.53 0.00 0.00 36.38 32.57 2g0k s VAL 18 CO 0.38 0.53 0.26 0.68 -3.33 0.00 0.00 175.10 173.61 2g0k s VAL 19 N 1.21 5.25 0.11 2.04 -7.23 0.20 -4.94 120.40 117.03 2g0k s VAL 19 Ca 0.03 -0.69 0.05 0.00 -1.81 0.00 0.00 61.98 59.56 2g0k s VAL 19 Cb -0.14 -3.68 -0.04 0.00 0.56 0.00 0.00 36.38 33.08 2g0k s VAL 19 CO -0.10 -0.06 0.02 -0.75 -0.31 0.00 0.00 175.10 173.90 2g0k s LYS 20 N -3.13 2.61 -0.19 4.82 2.36 -1.26 0.14 119.74 125.09 2g0k s LYS 20 Ca 0.34 -0.85 -0.04 0.00 -2.55 0.00 0.00 55.97 52.87 2g0k s LYS 20 Cb -0.11 -2.56 0.08 0.00 -1.05 0.00 0.00 37.83 34.19 2g0k s LYS 20 CO 0.28 0.53 0.14 0.54 1.55 0.00 0.00 175.35 178.39 2g0k s VAL 21 N -1.41 -0.18 -0.20 4.02 0.11 -0.87 -1.73 120.40 120.14 2g0k s VAL 21 Ca 0.27 -0.19 0.01 0.00 -2.93 0.00 0.00 61.98 59.14 2g0k s VAL 21 Cb -0.11 -0.64 0.04 0.00 -1.53 0.00 0.00 36.38 34.13 2g0k s VAL 21 CO 0.19 -0.29 -0.13 0.00 -3.33 0.00 0.00 175.10 171.55 2g0k s ALA 22 N 2.21 2.18 0.24 1.54 0.00 -0.12 -1.96 121.76 125.84 2g0k s ALA 22 Ca 0.04 -1.30 -0.17 0.00 0.00 0.00 0.00 51.96 50.54 2g0k s ALA 22 Cb -0.16 -1.30 -0.08 0.00 0.00 0.00 0.00 23.12 21.58 2g0k s ALA 22 CO -0.12 -0.75 0.69 0.20 0.00 0.00 0.00 175.76 175.79 2g0k s GLY 23 N 1.32 2.50 -0.16 0.00 0.00 -1.11 0.20 107.32 110.07 2g0k s GLY 23 Ca -0.01 0.07 -0.04 0.00 0.00 0.00 0.00 44.72 44.74 2g0k s GLY 23 CO -0.09 0.36 0.14 0.00 0.00 0.00 0.00 173.10 173.51 2g0k s ALA 24 N -1.66 0.09 0.00 3.20 0.00 3.20 -3.26 121.76 123.34 2g0k s ALA 24 Ca 0.46 0.04 0.00 0.00 0.00 0.00 0.00 51.96 52.46 2g0k s ALA 24 Cb -0.14 -1.07 0.00 0.00 0.00 0.00 0.00 23.12 21.91 2g0k s ALA 24 CO 0.20 -1.05 0.00 0.41 0.00 0.00 0.00 175.76 175.32 2g0k n GLY 25 N 5.30 0.98 3.95 0.00 0.00 -1.17 0.56 105.19 114.81 2g0k n GLY 25 Ca -0.06 -0.02 -0.23 0.00 0.00 0.00 0.00 46.02 45.71 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 3.27 -0.13 0.99 1.02 -1.09 -4.74 118.68 118.01 2g0k s LEU 26 Ca 0.00 0.29 -0.36 0.00 0.02 0.00 0.00 54.13 54.07 2g0k s LEU 26 Cb 0.00 -3.11 -0.13 0.00 0.02 0.00 0.00 46.19 42.96 2g0k s LEU 26 CO 0.00 -1.10 1.79 0.00 0.02 0.00 0.00 176.35 177.06 2g0k n GLN 27 N -2.43 1.76 -2.38 1.70 6.02 -1.26 -4.54 117.38 116.25 2g0k n GLN 27 Ca 0.06 0.64 -0.42 0.00 -0.01 0.00 0.00 57.00 57.27 2g0k n GLN 27 Cb 0.59 -2.42 -0.03 0.00 1.02 0.00 0.00 30.24 29.40 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 3.52 3.43 0.00 -1.58 0.00 -1.26 -2.31 121.76 123.55 2g0k s ALA 28 Ca 0.94 0.90 0.00 0.00 0.00 0.00 0.00 51.96 53.80 2g0k s ALA 28 Cb -0.84 -3.45 0.00 0.00 0.00 0.00 0.00 23.12 18.83 2g0k s ALA 28 CO 0.56 -0.45 0.00 0.41 0.00 0.00 0.00 175.76 176.28 2g0k n GLY 29 N 3.12 0.56 3.84 0.00 0.00 -0.29 -4.93 105.19 107.48 2g0k n GLY 29 Ca 0.09 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.73 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 -2.37 5.16 0.40 2.61 2.01 -0.98 -4.82 115.64 117.65 2g0k s THR 30 Ca 0.00 0.68 -0.14 0.00 0.31 0.00 0.00 61.69 62.54 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 0.57 0.81 0.00 -0.69 0.00 0.00 174.62 175.31 2g0k s ALA 31 N -0.93 3.26 -0.00 7.40 0.00 -1.26 -2.19 121.76 128.04 2g0k s ALA 31 Ca 0.21 0.01 0.01 0.00 0.00 0.00 0.00 51.96 52.19 2g0k s ALA 31 Cb -0.15 -2.84 -0.00 0.00 0.00 0.00 0.00 23.12 20.13 2g0k s ALA 31 CO 0.11 0.09 -0.04 0.71 0.00 0.00 0.00 175.76 176.62 2g0k s TYR 32 N -2.26 0.38 -0.34 0.00 2.02 -0.77 -4.14 117.35 112.26 2g0k s TYR 32 Ca 0.55 -0.07 -0.11 0.00 -0.37 0.00 0.00 57.07 57.07 2g0k s TYR 32 Cb -0.10 -0.25 0.00 0.00 -0.40 0.00 0.00 41.96 41.21 2g0k s TYR 32 CO 0.25 -0.01 0.18 -0.51 -1.57 0.00 0.00 175.55 173.89 2g0k s ASP 33 N -0.08 5.68 0.06 2.29 1.01 0.87 -3.24 116.67 123.26 2g0k s ASP 33 Ca 0.01 -0.66 0.01 0.00 0.71 0.00 0.00 52.55 52.62 2g0k s ASP 33 Cb -0.02 -2.03 -0.04 0.00 1.01 0.00 0.00 42.92 41.84 2g0k s ASP 33 CO -0.00 -0.26 0.14 -0.69 0.21 0.00 0.00 175.17 174.57 2g0k s VAL 34 N 1.61 4.97 0.10 -1.27 1.01 -0.53 1.33 120.40 127.62 2g0k s VAL 34 Ca 0.04 -0.55 -0.26 0.00 0.00 0.00 0.00 61.98 61.20 2g0k s VAL 34 Cb -0.18 -3.40 0.09 0.00 0.00 0.00 0.00 36.38 32.89 2g0k s VAL 34 CO 0.07 0.15 1.10 -0.83 0.00 0.00 0.00 175.10 175.59 2g0k s GLY 35 N -2.40 -0.22 -0.30 4.51 0.00 3.25 -0.69 107.32 111.48 2g0k s GLY 35 Ca 0.32 0.21 -0.03 0.00 0.00 0.00 0.00 44.72 45.21 2g0k s GLY 35 CO 0.24 0.86 0.01 1.62 0.00 0.00 0.00 173.10 175.84 2g0k s GLN 36 N -2.72 2.55 0.04 2.90 0.74 -1.25 -1.12 119.66 120.80 2g0k s GLN 36 Ca 0.16 -1.19 0.03 0.00 0.05 0.00 0.00 55.36 54.41 2g0k s GLN 36 Cb 0.00 -3.22 -0.04 0.00 1.10 0.00 0.00 33.01 30.86 2g0k s GLN 36 CO 0.01 -0.59 -0.01 0.00 -0.55 0.00 0.00 175.29 174.14 2g0k s ALA 38 N -1.17 1.54 -0.02 0.00 0.00 0.58 -2.53 121.76 120.16 2g0k s ALA 38 Ca 0.22 -0.62 -0.30 0.00 0.00 0.00 0.00 51.96 51.26 2g0k s ALA 38 Cb -0.11 -0.60 -0.07 0.00 0.00 0.00 0.00 23.12 22.34 2g0k s ALA 38 CO 0.13 0.20 1.72 -0.46 0.00 0.00 0.00 175.76 177.36 2g0k s TRP 39 N 0.40 1.87 -0.26 0.00 -0.00 -1.26 -0.70 118.94 118.99 2g0k s TRP 39 Ca -0.12 0.06 -0.03 0.00 -0.00 0.00 0.00 56.10 56.00 2g0k s TRP 39 Cb -0.15 -3.99 -0.15 0.00 -0.00 0.00 0.00 33.47 29.17 2g0k s TRP 39 CO 0.04 -4.24 -0.27 1.33 -0.00 0.00 0.00 176.95 173.82 2g0k n VAL 40 N 5.42 1.48 -4.22 5.86 0.24 0.13 -4.90 118.33 122.34 2g0k n VAL 40 Ca 0.18 -0.50 -0.13 0.00 -2.04 0.00 0.00 64.34 61.85 2g0k n VAL 40 Cb 0.42 -1.56 -0.10 0.00 -1.47 0.00 0.00 33.84 31.13 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 -6.80 0.83 -0.32 -1.34 1.01 0.33 -4.99 116.67 105.39 2g0k s ASP 41 Ca -0.36 -1.24 -0.36 0.00 0.71 0.00 0.00 52.55 51.31 2g0k s ASP 41 Cb 0.11 0.20 -0.12 0.00 1.01 0.00 0.00 42.92 44.12 2g0k s ASP 41 CO 0.55 -0.67 2.12 1.07 0.21 0.00 0.00 175.17 178.46 2g0k n THR 42 N -0.23 0.23 -0.97 -1.27 5.66 -1.26 0.19 114.28 116.63 2g0k n THR 42 Ca -0.04 -0.23 0.00 0.00 -3.05 0.00 0.00 64.05 60.73 2g0k n THR 42 Cb 0.64 -1.63 0.00 0.00 -1.55 0.00 0.00 70.33 67.79 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 6.15 0.32 3.02 1.09 0.00 -1.26 -4.96 105.19 109.55 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 -1.72 1.94 -0.00 1.61 1.01 0.51 -5.09 120.40 118.66 2g0k s VAL 44 Ca 0.00 -1.53 0.07 0.00 0.00 0.00 0.00 61.98 60.52 2g0k s VAL 44 Cb 0.00 -2.13 -0.02 0.00 0.00 0.00 0.00 36.38 34.24 2g0k s VAL 44 CO 0.00 -0.09 -0.21 -1.48 0.00 0.00 0.00 175.10 173.32 2g0k s LEU 45 N 1.20 2.07 0.15 3.92 2.34 -1.26 0.12 118.68 127.22 2g0k s LEU 45 Ca -0.07 -0.42 0.03 0.00 0.06 0.00 0.00 54.13 53.73 2g0k s LEU 45 Cb -0.20 -1.07 -0.04 0.00 -0.56 0.00 0.00 46.19 44.33 2g0k s LEU 45 CO -0.06 0.24 0.28 0.00 -1.06 0.00 0.00 176.35 175.75 2g0k s ALA 46 N -0.57 3.95 0.09 1.48 0.00 0.13 -4.13 121.76 122.70 2g0k s ALA 46 Ca 0.08 -1.05 0.06 0.00 0.00 0.00 0.00 51.96 51.05 2g0k s ALA 46 Cb -0.08 -1.76 -0.04 0.00 0.00 0.00 0.00 23.12 21.24 2g0k s ALA 46 CO -0.00 0.53 -0.06 0.00 0.00 0.00 0.00 175.76 176.23 2g0k s ASN 48 N -2.21 4.05 0.00 0.00 4.22 -0.90 0.57 114.94 120.67 2g0k s ASN 48 Ca 0.23 -0.89 0.18 0.00 -2.14 0.00 0.00 52.86 50.24 2g0k s ASN 48 Cb -0.11 -1.60 1.06 0.00 1.28 0.00 0.00 41.25 41.88 2g0k s ASN 48 CO 0.15 -0.10 1.47 -0.81 -2.04 0.00 0.00 177.10 175.77 2g0k n PRO 49 N 4.62 0.62 0.09 3.55 -0.04 -1.26 -2.39 135.00 140.19 2g0k n PRO 49 Ca -0.17 0.00 0.13 0.00 -0.04 0.00 0.00 63.50 63.42 2g0k n PRO 49 Cb 0.47 -1.45 0.39 0.00 -0.04 0.00 0.00 33.50 32.87 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 -0.95 2.39 -2.16 0.55 0.00 -1.26 -3.57 120.51 115.52 2g0k n ALA 50 Ca 0.13 -0.07 0.05 0.00 0.00 0.00 0.00 53.44 53.55 2g0k n ALA 50 Cb 0.06 -1.42 0.09 0.00 0.00 0.00 0.00 19.45 18.17 2g0k n ALA 50 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2g0k n ASP 51 N -2.16 1.24 -4.57 0.00 8.00 -1.00 -5.02 116.55 113.04 2g0k n ASP 51 Ca 0.05 -2.67 -0.43 0.00 0.71 0.00 0.00 54.79 52.45 2g0k n ASP 51 Cb 0.42 -0.38 -0.04 0.00 -0.02 0.00 0.00 41.12 41.11 2g0k n ASP 51 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 2g0k s PHE 52 N -1.15 2.90 0.48 1.24 2.19 -1.23 -3.81 117.98 118.60 2g0k s PHE 52 Ca 0.34 0.40 0.07 0.00 0.33 0.00 0.00 56.93 58.08 2g0k s PHE 52 Cb 0.37 -4.04 0.02 0.00 -1.31 0.00 0.00 43.02 38.06 2g0k s PHE 52 CO -0.13 -1.14 0.49 0.45 1.83 0.00 0.00 175.22 176.72 2g0k s SER 53 N 2.32 5.00 -0.00 6.13 0.15 0.14 -4.97 113.70 122.47 2g0k s SER 53 Ca 0.38 -0.88 -0.10 0.00 0.70 0.00 0.00 55.95 56.05 2g0k s SER 53 Cb -0.10 -0.13 0.01 0.00 -1.71 0.00 0.00 66.02 64.09 2g0k s SER 53 CO 0.27 -0.93 0.20 -0.94 1.20 0.00 0.00 173.24 173.04 2g0k s SER 54 N -4.30 -0.05 -0.05 5.45 1.04 -1.26 -2.33 113.70 112.20 2g0k s SER 54 Ca 0.48 -0.10 -0.29 0.00 0.48 0.00 0.00 55.95 56.52 2g0k s SER 54 Cb -0.04 0.24 0.10 0.00 0.10 0.00 0.00 66.02 66.43 2g0k s SER 54 CO 0.29 -0.39 0.87 0.54 0.98 0.00 0.00 173.24 175.53 2g0k s VAL 55 N -1.34 0.00 -0.06 5.02 0.11 -1.20 -4.99 120.40 117.94 2g0k s VAL 55 Ca -0.14 0.00 0.04 0.00 -2.93 0.00 0.00 61.98 58.95 2g0k s VAL 55 Cb -0.07 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 33.79 2g0k s VAL 55 CO 0.02 0.00 -0.17 -0.89 -3.33 0.00 0.00 175.10 170.74 2g0k s THR 56 N -2.27 1.42 0.27 5.04 2.01 -1.26 -1.84 115.64 119.01 2g0k s THR 56 Ca 0.00 -0.68 -0.29 0.00 0.31 0.00 0.00 61.69 61.03 2g0k s THR 56 Cb -0.01 -1.24 -0.09 0.00 0.01 0.00 0.00 72.50 71.17 2g0k s THR 56 CO -0.03 0.41 1.17 0.00 -0.69 0.00 0.00 174.62 175.48 2g0k s ALA 57 N 0.27 3.44 1.03 7.40 0.00 -0.93 -4.74 121.76 128.21 2g0k s ALA 57 Ca -0.09 1.00 -0.07 0.00 0.00 0.00 0.00 51.96 52.79 2g0k s ALA 57 Cb -0.14 -3.38 0.10 0.00 0.00 0.00 0.00 23.12 19.70 2g0k s ALA 57 CO 0.04 -0.33 0.53 -0.40 0.00 0.00 0.00 175.76 175.60 2g0k n ASP 58 N 1.44 -0.34 0.24 0.00 5.68 -0.79 -1.14 116.55 121.64 2g0k n ASP 58 Ca 0.01 -1.09 0.16 0.00 -0.50 0.00 0.00 54.79 53.37 2g0k n ASP 58 Cb 0.44 -0.42 0.84 0.00 -1.14 0.00 0.00 41.12 40.84 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 -2.01 1.00 -0.11 2.12 0.00 -1.92 0.16 119.26 118.50 2g0k h ALA 59 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.73 2g0k h ALA 59 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.29 2g0k h ALA 59 CO 0.12 0.00 0.00 0.09 0.00 0.00 0.00 179.25 179.46 2g0k n ASN 60 N -2.67 0.92 -2.70 0.00 3.02 -1.26 -4.88 115.26 107.69 2g0k n ASN 60 Ca -0.01 -1.68 -0.21 0.00 -0.03 0.00 0.00 54.58 52.65 2g0k n ASN 60 Cb 0.10 -0.07 0.01 0.00 -0.61 0.00 0.00 39.78 39.21 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 0.93 -0.51 3.05 7.41 0.00 0.56 -4.77 105.19 111.86 2g0k n GLY 61 Ca 0.13 0.06 -0.22 0.00 0.00 0.00 0.00 46.02 45.99 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 -2.35 1.47 0.29 1.61 0.15 -1.26 -2.66 113.70 110.95 2g0k s SER 62 Ca 0.14 -0.23 0.04 0.00 0.70 0.00 0.00 55.95 56.60 2g0k s SER 62 Cb -0.06 -0.32 -0.06 0.00 -1.71 0.00 0.00 66.02 63.87 2g0k s SER 62 CO 0.18 0.11 0.01 0.00 1.20 0.00 0.00 173.24 174.74 2g0k s ALA 63 N 0.00 2.19 -0.16 5.45 0.00 -1.20 -1.88 121.76 126.15 2g0k s ALA 63 Ca -0.01 -1.94 -0.08 0.00 0.00 0.00 0.00 51.96 49.94 2g0k s ALA 63 Cb -0.08 0.51 0.06 0.00 0.00 0.00 0.00 23.12 23.61 2g0k s ALA 63 CO 0.00 -0.24 0.39 -1.54 0.00 0.00 0.00 175.76 174.37 2g0k s SER 64 N -3.42 -0.41 0.27 0.00 1.04 -1.26 -2.76 113.70 107.16 2g0k s SER 64 Ca 0.33 0.85 -0.07 0.00 0.48 0.00 0.00 55.95 57.53 2g0k s SER 64 Cb 0.07 0.81 -0.01 0.00 0.10 0.00 0.00 66.02 66.99 2g0k s SER 64 CO 0.13 -0.20 0.42 -0.89 0.98 0.00 0.00 173.24 173.68 2g0k s THR 65 N 1.61 0.00 -0.12 2.02 2.01 -0.83 -4.96 115.64 115.38 2g0k s THR 65 Ca -0.08 -1.57 0.01 0.00 0.31 0.00 0.00 61.69 60.36 2g0k s THR 65 Cb -0.09 -2.41 0.02 0.00 0.01 0.00 0.00 72.50 70.02 2g0k s THR 65 CO -0.12 0.00 -0.13 -0.44 -0.69 0.00 0.00 174.62 173.24 2g0k s SER 66 N -3.12 2.43 -0.06 3.53 0.01 -1.26 -2.05 113.70 113.18 2g0k s SER 66 Ca 0.28 -0.41 -0.04 0.00 1.31 0.00 0.00 55.95 57.08 2g0k s SER 66 Cb 0.01 -1.05 -0.04 0.00 0.21 0.00 0.00 66.02 65.15 2g0k s SER 66 CO 0.13 -0.04 0.15 -0.22 0.41 0.00 0.00 173.24 173.68 2g0k s LEU 67 N 1.28 4.33 -0.05 2.44 1.98 0.12 -4.94 118.68 123.85 2g0k s LEU 67 Ca -0.01 0.38 -0.04 0.00 -2.89 0.00 0.00 54.13 51.57 2g0k s LEU 67 Cb -0.14 -2.35 -0.04 0.00 0.66 0.00 0.00 46.19 44.32 2g0k s LEU 67 CO -0.06 0.33 0.16 0.28 -1.89 0.00 0.00 176.35 175.17 2g0k s THR 68 N -1.19 5.39 -0.19 3.68 -1.32 -1.26 0.60 115.64 121.35 2g0k s THR 68 Ca 0.22 -0.06 -0.08 0.00 -1.21 0.00 0.00 61.69 60.56 2g0k s THR 68 Cb -0.12 -3.45 -0.04 0.00 -1.51 0.00 0.00 72.50 67.37 2g0k s THR 68 CO 0.12 0.43 0.07 -0.69 -2.21 0.00 0.00 174.62 172.34 2g0k s VAL 69 N -1.21 4.84 0.04 5.08 1.01 -0.49 -4.90 120.40 124.77 2g0k s VAL 69 Ca 0.23 -0.01 0.09 0.00 0.00 0.00 0.00 61.98 62.28 2g0k s VAL 69 Cb -0.12 -3.19 -0.03 0.00 0.00 0.00 0.00 36.38 33.04 2g0k s VAL 69 CO 0.13 0.45 -0.25 -0.13 0.00 0.00 0.00 175.10 175.30 2g0k s ARG 70 N 0.45 1.88 0.26 2.72 3.00 -1.26 -3.02 118.95 122.98 2g0k s ARG 70 Ca 0.04 -1.07 0.06 0.00 0.00 0.00 0.00 55.73 54.76 2g0k s ARG 70 Cb -0.12 -2.02 0.34 0.00 0.00 0.00 0.00 34.95 33.15 2g0k s ARG 70 CO 0.00 0.52 1.62 0.07 0.00 0.00 0.00 175.30 177.51 2g0k h ARG 71 N 4.84 0.18 -3.02 3.54 0.11 -1.91 -3.40 114.38 114.72 2g0k h ARG 71 Ca -0.46 -0.11 -0.03 0.00 0.10 0.00 0.00 59.98 59.47 2g0k h ARG 71 Cb 1.14 0.01 -0.13 0.00 1.11 0.00 0.00 29.97 32.10 2g0k h ARG 71 CO 0.44 0.68 0.12 0.45 0.10 0.00 0.00 179.97 181.77 2g0k s SER 72 N -6.88 -0.48 -0.16 0.08 0.15 -1.26 0.69 113.70 105.83 2g0k s SER 72 Ca -0.04 -0.02 -0.34 0.00 0.70 0.00 0.00 55.95 56.25 2g0k s SER 72 Cb 0.13 0.56 0.14 0.00 -1.71 0.00 0.00 66.02 65.13 2g0k s SER 72 CO 0.78 -0.90 1.30 0.72 1.20 0.00 0.00 173.24 176.35 2g0k s PHE 73 N -3.50 -0.06 -0.01 3.44 -0.12 -0.95 -4.95 117.98 111.83 2g0k s PHE 73 Ca 0.00 0.01 -0.30 0.00 -0.05 0.00 0.00 56.93 56.60 2g0k s PHE 73 Cb -0.00 0.52 -0.07 0.00 -0.63 0.00 0.00 43.02 42.84 2g0k s PHE 73 CO -0.10 -0.15 1.71 -1.83 -0.05 0.00 0.00 175.22 174.80 2g0k s GLU 74 N -2.27 4.18 -0.88 1.99 1.03 -1.26 -0.54 118.70 120.94 2g0k s GLU 74 Ca 0.12 2.30 -0.25 0.00 0.03 0.00 0.00 54.97 57.17 2g0k s GLU 74 Cb 0.02 -3.95 0.01 0.00 -0.80 0.00 0.00 34.13 29.41 2g0k s GLU 74 CO -0.04 -0.85 1.59 0.20 -1.33 0.00 0.00 175.26 174.84 2g0k s GLY 75 N 3.39 0.78 -0.70 -3.83 0.00 0.11 -3.85 107.32 103.22 2g0k s GLY 75 Ca 0.76 -1.69 -0.25 0.00 0.00 0.00 0.00 44.72 43.54 2g0k s GLY 75 CO 0.32 2.98 1.15 -1.36 0.00 0.00 0.00 173.10 176.19 2g0k s PHE 76 N 6.95 2.45 0.29 1.90 0.08 2.32 -0.82 117.98 131.14 2g0k s PHE 76 Ca 0.53 -0.26 -0.30 0.00 0.12 0.00 0.00 56.93 57.02 2g0k s PHE 76 Cb -0.05 -4.49 -0.13 0.00 -0.57 0.00 0.00 43.02 37.79 2g0k s PHE 76 CO 0.01 -1.89 1.31 -0.11 -0.10 0.00 0.00 175.22 174.44 2g0k n LEU 77 N 8.66 3.12 -0.33 -0.37 7.94 0.13 0.42 117.00 136.56 2g0k n LEU 77 Ca 0.00 1.17 0.19 0.00 -1.11 0.00 0.00 56.01 56.27 2g0k n LEU 77 Cb 0.47 -1.43 0.40 0.00 0.53 0.00 0.00 43.42 43.40 2g0k n LEU 77 CO 0.68 -0.60 1.11 -0.26 -1.11 0.00 0.00 177.39 177.21 2g0k h PHE 78 N 3.27 0.87 0.00 1.96 -1.00 -1.87 1.94 116.94 122.11 2g0k h PHE 78 Ca -0.45 0.04 0.00 0.00 2.81 0.00 0.00 57.97 60.37 2g0k h PHE 78 Cb 1.29 -0.23 0.00 0.00 3.61 0.00 0.00 35.95 40.62 2g0k h PHE 78 CO 0.53 -0.08 0.14 0.22 -1.61 0.00 0.00 178.31 177.51 2g0k h ASP 79 N 0.42 0.00 0.00 2.17 3.58 -1.93 -3.44 116.42 117.21 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 1.38 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.43 2g0k h ASP 79 CO -0.55 0.00 0.00 0.61 -2.88 0.00 0.00 179.24 176.42 2g0k n GLY 80 N -1.22 1.55 3.58 -0.78 0.00 0.66 -5.09 105.19 103.89 2g0k n GLY 80 Ca -0.02 -0.16 -0.34 0.00 0.00 0.00 0.00 46.02 45.50 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 3.72 -0.93 2.61 2.01 -1.11 -4.89 115.64 115.06 2g0k s THR 81 Ca 0.00 -0.47 -0.24 0.00 0.31 0.00 0.00 61.69 61.29 2g0k s THR 81 Cb 0.00 -2.52 0.03 0.00 0.01 0.00 0.00 72.50 70.02 2g0k s THR 81 CO 0.00 0.60 1.50 -0.13 -0.69 0.00 0.00 174.62 175.89 2g0k s ARG 82 N -0.80 3.33 0.04 4.92 0.52 -1.26 0.17 118.95 125.88 2g0k s ARG 82 Ca 0.12 -0.76 -0.31 0.00 -0.52 0.00 0.00 55.73 54.26 2g0k s ARG 82 Cb -0.11 -5.04 -0.18 0.00 0.52 0.00 0.00 34.95 30.14 2g0k s ARG 82 CO 0.01 -2.37 1.43 2.35 0.02 0.00 0.00 175.30 176.74 2g0k h TRP 83 N 10.26 -0.88 0.00 -0.53 7.01 -1.35 -3.48 115.95 126.97 2g0k h TRP 83 Ca 0.07 -0.02 0.00 0.00 2.11 0.00 0.00 58.89 61.05 2g0k h TRP 83 Cb 1.02 0.29 0.00 0.00 -2.10 0.00 0.00 29.16 28.38 2g0k h TRP 83 CO 1.23 -0.52 0.00 0.41 -2.79 0.00 0.00 178.44 176.77 2g0k n GLY 84 N -1.15 3.03 3.71 2.65 0.00 -1.22 -4.96 105.19 107.27 2g0k n GLY 84 Ca -0.13 -1.29 -0.42 0.00 0.00 0.00 0.00 46.02 44.17 2g0k n GLY 84 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2g0k n THR 85 N -1.45 0.09 -4.38 2.61 -1.04 -1.26 0.09 114.28 108.95 2g0k n THR 85 Ca 0.00 -0.02 -0.31 0.00 -2.04 0.00 0.00 64.05 61.69 2g0k n THR 85 Cb 0.00 -2.03 -0.11 0.00 -1.82 0.00 0.00 70.33 66.37 2g0k n THR 85 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 2g0k s VAL 86 N 1.56 3.31 -0.69 12.58 0.11 0.30 -4.83 120.40 132.74 2g0k s VAL 86 Ca 0.77 -1.13 -0.15 0.00 -2.93 0.00 0.00 61.98 58.53 2g0k s VAL 86 Cb -0.49 -2.49 0.17 0.00 -1.53 0.00 0.00 36.38 32.04 2g0k s VAL 86 CO 0.33 0.23 0.66 -1.81 -3.33 0.00 0.00 175.10 171.18 2g0k s ASP 87 N -1.85 6.46 0.66 3.54 1.01 -1.26 -2.23 116.67 122.99 2g0k s ASP 87 Ca 0.19 -2.18 0.33 0.00 0.71 0.00 0.00 52.55 51.59 2g0k s ASP 87 Cb -0.11 -2.22 1.79 0.00 1.01 0.00 0.00 42.92 43.39 2g0k s ASP 87 CO 0.10 -0.75 2.02 0.00 0.21 0.00 0.00 175.17 176.75 2g0k n THR 89 N -3.03 0.10 -0.04 0.00 -2.24 -1.14 -3.81 114.28 104.12 2g0k n THR 89 Ca -0.01 -0.33 -0.02 0.00 -2.27 0.00 0.00 64.05 61.41 2g0k n THR 89 Cb 0.33 0.56 -0.09 0.00 -2.10 0.00 0.00 70.33 69.03 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 0.39 0.55 -4.39 4.28 -1.04 0.48 -4.96 114.28 109.59 2g0k n THR 90 Ca 0.18 -0.42 -0.21 0.00 -2.04 0.00 0.00 64.05 61.55 2g0k n THR 90 Cb 0.38 -0.42 -0.09 0.00 -1.82 0.00 0.00 70.33 68.38 2g0k n THR 90 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2g0k s ALA 91 N -2.45 2.30 -0.15 2.41 0.00 -0.78 -5.06 121.76 118.02 2g0k s ALA 91 Ca -0.05 -1.64 -0.20 0.00 0.00 0.00 0.00 51.96 50.07 2g0k s ALA 91 Cb 0.05 1.06 -0.03 0.00 0.00 0.00 0.00 23.12 24.20 2g0k s ALA 91 CO 0.48 -0.47 0.59 0.00 0.00 0.00 0.00 175.76 176.36 2g0k s ALA 92 N -3.42 3.48 0.46 0.00 0.00 -1.26 -4.27 121.76 116.74 2g0k s ALA 92 Ca 0.32 -0.17 0.08 0.00 0.00 0.00 0.00 51.96 52.19 2g0k s ALA 92 Cb 0.04 -2.86 0.01 0.00 0.00 0.00 0.00 23.12 20.30 2g0k s ALA 92 CO 0.18 -0.29 0.48 0.00 0.00 0.00 0.00 175.76 176.13 2g0k s GLN 94 N -4.27 0.88 0.31 0.00 -2.07 -1.05 -1.38 119.66 112.08 2g0k s GLN 94 Ca 0.49 0.27 0.07 0.00 -1.82 0.00 0.00 55.36 54.38 2g0k s GLN 94 Cb -0.05 0.41 -0.03 0.00 -1.09 0.00 0.00 33.01 32.26 2g0k s GLN 94 CO 0.29 -0.24 0.30 0.08 -1.32 0.00 0.00 175.29 174.40 2g0k s VAL 95 N -0.90 3.95 0.00 3.63 1.01 -1.12 -1.83 120.40 125.15 2g0k s VAL 95 Ca -0.09 -1.30 0.00 0.00 0.00 0.00 0.00 61.98 60.58 2g0k s VAL 95 Cb -0.02 -3.31 0.00 0.00 0.00 0.00 0.00 36.38 33.05 2g0k s VAL 95 CO 0.07 -0.23 0.00 0.61 0.00 0.00 0.00 175.10 175.55 2g0k n GLY 96 N -1.36 0.39 3.01 4.51 0.00 -0.28 -2.94 105.19 108.52 2g0k n GLY 96 Ca -0.04 -0.80 -0.19 0.00 0.00 0.00 0.00 46.02 45.00 2g0k n GLY 96 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2g0k s LEU 97 N 0.00 1.94 0.06 0.99 2.34 1.15 0.69 118.68 125.85 2g0k s LEU 97 Ca 0.00 -0.16 0.09 0.00 0.06 0.00 0.00 54.13 54.11 2g0k s LEU 97 Cb 0.00 -0.48 -0.03 0.00 -0.56 0.00 0.00 46.19 45.12 2g0k s LEU 97 CO 0.00 0.09 -0.24 -0.44 -1.06 0.00 0.00 176.35 174.70 2g0k s SER 98 N -0.08 2.94 0.00 1.48 0.01 12.23 -2.91 113.70 127.36 2g0k s SER 98 Ca 0.01 -0.60 0.00 0.00 1.31 0.00 0.00 55.95 56.68 2g0k s SER 98 Cb -0.05 -0.24 0.00 0.00 0.21 0.00 0.00 66.02 65.94 2g0k s SER 98 CO -0.00 0.21 0.00 -0.90 0.41 0.00 0.00 173.24 172.96 2g0k n ASP 99 N 1.65 0.27 -0.04 2.44 5.75 -1.04 0.30 116.55 125.88 2g0k n ASP 99 Ca -0.17 0.00 -0.13 0.00 -0.01 0.00 0.00 54.79 54.47 2g0k n ASP 99 Cb 0.53 0.00 -0.09 0.00 -1.03 0.00 0.00 41.12 40.53 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 -0.68 0.12 0.00 2.12 0.00 -1.92 -3.00 119.26 115.90 2g0k h ALA 100 Ca 0.00 -0.31 -0.03 0.00 0.00 0.00 0.00 54.91 54.56 2g0k h ALA 100 Cb 0.00 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.76 2g0k h ALA 100 CO 0.00 -0.03 -0.15 0.00 0.00 0.00 0.00 179.25 179.07 2g0k h ALA 101 N 0.53 1.19 -0.80 0.00 0.00 -1.96 -3.46 119.26 114.75 2g0k h ALA 101 Ca 0.01 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.78 2g0k h ALA 101 Cb 0.65 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.42 2g0k h ALA 101 CO 0.02 0.19 0.00 0.41 0.00 0.00 0.00 179.25 179.88 2g0k n GLY 102 N -0.42 0.64 3.33 0.00 0.00 -1.13 -5.12 105.19 102.48 2g0k n GLY 102 Ca -0.01 -0.34 -0.17 0.00 0.00 0.00 0.00 46.02 45.50 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 -1.92 1.85 0.12 1.61 6.03 -1.26 -4.83 114.94 116.53 2g0k s ASN 103 Ca 0.00 -1.21 -0.26 0.00 -1.03 0.00 0.00 52.86 50.37 2g0k s ASN 103 Cb 0.00 0.00 0.08 0.00 -3.03 0.00 0.00 41.25 38.30 2g0k s ASN 103 CO 0.00 -0.50 1.05 -0.83 -2.03 0.00 0.00 177.10 174.79 2g0k s GLY 104 N -3.30 -0.22 0.88 0.45 0.00 -1.26 -2.51 107.32 101.36 2g0k s GLY 104 Ca 0.28 0.18 -0.12 0.00 0.00 0.00 0.00 44.72 45.06 2g0k s GLY 104 CO 0.08 0.47 1.10 2.56 0.00 0.00 0.00 173.10 177.31 2g0k s PRO 105 N -2.91 1.44 -0.44 2.90 0.04 -1.26 -4.49 135.00 130.28 2g0k s PRO 105 Ca 0.14 0.64 -0.42 0.00 0.04 0.00 0.00 61.00 61.41 2g0k s PRO 105 Cb -0.00 -1.84 -0.18 0.00 0.04 0.00 0.00 34.50 32.52 2g0k s PRO 105 CO 0.01 -2.07 1.42 -0.85 0.04 0.00 0.00 177.00 175.55 2g0k n GLU 106 N -3.74 0.00 -0.97 4.56 0.28 -0.97 -4.59 120.64 115.21 2g0k n GLU 106 Ca 0.07 0.00 -0.34 0.00 -0.16 0.00 0.00 57.16 56.72 2g0k n GLU 106 Cb 0.56 -1.34 0.03 0.00 1.43 0.00 0.00 31.44 32.13 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 3.52 -4.24 3.12 -1.84 0.00 -1.26 -4.87 105.19 99.62 2g0k n GLY 107 Ca 0.27 -0.68 -0.35 0.00 0.00 0.00 0.00 46.02 45.27 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 -1.88 2.98 -0.16 1.61 1.01 -1.15 -5.07 120.40 117.74 2g0k s VAL 108 Ca 0.40 -1.87 -0.26 0.00 0.00 0.00 0.00 61.98 60.25 2g0k s VAL 108 Cb -0.21 -2.95 -0.02 0.00 0.00 0.00 0.00 36.38 33.20 2g0k s VAL 108 CO 0.76 -0.46 0.84 0.00 0.00 0.00 0.00 175.10 176.24 2g0k s ALA 109 N 1.13 3.50 0.19 5.51 0.00 -1.26 -2.78 121.76 128.05 2g0k s ALA 109 Ca 0.04 0.07 0.03 0.00 0.00 0.00 0.00 51.96 52.10 2g0k s ALA 109 Cb -0.21 -3.24 -0.01 0.00 0.00 0.00 0.00 23.12 19.66 2g0k s ALA 109 CO -0.04 -0.63 0.10 0.44 0.00 0.00 0.00 175.76 175.64 2g0k n ILE 110 N 4.69 0.00 -3.84 0.00 -5.35 -0.48 -4.99 119.36 109.39 2g0k n ILE 110 Ca 0.05 -1.22 -0.01 0.00 -0.27 0.00 0.00 62.75 61.30 2g0k n ILE 110 Cb 0.49 0.51 0.01 0.00 -1.74 0.00 0.00 39.64 38.90 2g0k n ILE 110 CO 0.00 0.00 0.00 -0.44 -1.76 0.00 0.00 176.55 174.35 2g0k s SER 111 N -2.23 -0.04 -0.19 7.28 0.01 -1.22 -3.55 113.70 113.77 2g0k s SER 111 Ca 0.14 -0.45 0.01 0.00 1.31 0.00 0.00 55.95 56.97 2g0k s SER 111 Cb 0.01 0.37 0.04 0.00 0.21 0.00 0.00 66.02 66.65 2g0k s SER 111 CO 0.10 -0.73 -0.11 -0.36 0.41 0.00 0.00 173.24 172.56 2g0k s PHE 112 N -2.38 2.35 0.00 2.43 0.40 -1.26 -1.30 117.98 118.22 2g0k s PHE 112 Ca 0.20 -1.51 0.00 0.00 -0.60 0.00 0.00 56.93 55.02 2g0k s PHE 112 Cb -0.01 -1.62 0.00 0.00 0.51 0.00 0.00 43.02 41.90 2g0k s PHE 112 CO 0.02 -0.73 0.00 0.09 0.70 0.00 0.00 175.22 175.30