#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yc8 s VAL 2 N 0.00 3.24 0.10 5.18 1.01 -1.26 -4.42 120.40 124.25 1yc8 s VAL 2 Ca 0.00 0.25 0.08 0.00 0.00 0.00 0.00 61.98 62.32 1yc8 s VAL 2 Cb 0.00 -3.31 -0.03 0.00 0.00 0.00 0.00 36.38 33.04 1yc8 s VAL 2 CO 0.00 -0.19 -0.22 -1.10 0.00 0.00 0.00 175.10 173.60 1yc8 s GLN 3 N 5.86 1.20 -0.09 2.72 -0.21 -0.11 -4.97 119.66 124.05 1yc8 s GLN 3 Ca 0.90 -1.16 0.03 0.00 0.02 0.00 0.00 55.36 55.14 1yc8 s GLN 3 Cb -0.29 -1.48 0.01 0.00 1.00 0.00 0.00 33.01 32.26 1yc8 s GLN 3 CO 0.34 0.35 -0.17 -0.51 -2.12 0.00 0.00 175.29 173.19 1yc8 s LEU 4 N -1.84 1.81 -0.39 2.90 1.02 -1.26 -0.63 118.68 120.29 1yc8 s LEU 4 Ca 0.08 -0.42 -0.05 0.00 0.02 0.00 0.00 54.13 53.75 1yc8 s LEU 4 Cb -0.10 -1.10 0.09 0.00 0.02 0.00 0.00 46.19 45.10 1yc8 s LEU 4 CO 0.04 0.06 0.19 -0.69 0.02 0.00 0.00 176.35 175.97 1yc8 s VAL 5 N 0.70 3.58 0.62 -1.59 1.01 -0.52 -4.43 120.40 119.77 1yc8 s VAL 5 Ca -0.13 -1.70 -0.09 0.00 0.00 0.00 0.00 61.98 60.07 1yc8 s VAL 5 Cb -0.16 -3.28 -0.01 0.00 0.00 0.00 0.00 36.38 32.93 1yc8 s VAL 5 CO 0.03 -0.52 0.97 -1.61 0.00 0.00 0.00 175.10 173.97 1yc8 s GLU 6 N 1.26 3.16 -0.08 2.72 2.02 -1.26 -2.71 118.70 123.82 1yc8 s GLU 6 Ca 0.04 0.35 -0.32 0.00 0.02 0.00 0.00 54.97 55.06 1yc8 s GLU 6 Cb -0.22 -2.16 0.13 0.00 0.10 0.00 0.00 34.13 31.97 1yc8 s GLU 6 CO -0.01 -0.69 1.29 -1.54 0.02 0.00 0.00 175.26 174.32 1yc8 s SER 7 N -4.26 -0.07 0.00 -0.19 1.04 -0.69 -4.97 113.70 104.56 1yc8 s SER 7 Ca 0.54 -0.08 0.00 0.00 0.48 0.00 0.00 55.95 56.89 1yc8 s SER 7 Cb -0.11 0.13 0.00 0.00 0.10 0.00 0.00 66.02 66.15 1yc8 s SER 7 CO 0.49 -0.24 0.00 0.61 0.98 0.00 0.00 173.24 175.08 1yc8 n GLY 8 N -0.37 0.39 2.22 7.32 0.00 -1.26 -1.33 105.19 112.16 1yc8 n GLY 8 Ca -0.06 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.76 1yc8 n GLY 8 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1yc8 n GLY 9 N -1.79 -3.30 0.00 -0.02 0.00 -1.26 -4.40 105.19 94.42 1yc8 n GLY 9 Ca 0.00 -1.37 0.00 0.00 0.00 0.00 0.00 46.02 44.65 1yc8 n GLY 9 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1yc8 n GLY 10 N -3.13 0.84 0.70 -0.02 0.00 0.12 -4.96 105.19 98.74 1yc8 n GLY 10 Ca 0.10 -1.81 0.04 0.00 0.00 0.00 0.00 46.02 44.35 1yc8 n GLY 10 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1yc8 n SER 11 N 0.11 2.59 0.00 1.61 7.64 -1.26 -1.70 113.62 122.61 1yc8 n SER 11 Ca 0.00 -3.46 0.00 0.00 1.01 0.00 0.00 58.87 56.42 1yc8 n SER 11 Cb 0.00 -0.54 0.00 0.00 -1.01 0.00 0.00 64.21 62.66 1yc8 n SER 11 CO 0.00 0.00 0.00 0.55 -3.01 0.00 0.00 175.04 172.58 1yc8 n VAL 12 N -1.07 0.00 -2.00 0.44 3.14 -1.26 -4.95 118.33 112.63 1yc8 n VAL 12 Ca 0.23 0.00 -0.33 0.00 -2.96 0.00 0.00 64.34 61.28 1yc8 n VAL 12 Cb 0.83 0.00 0.02 0.00 -1.06 0.00 0.00 33.84 33.63 1yc8 n VAL 12 CO 0.00 0.00 0.00 -1.10 -6.46 0.00 0.00 176.83 169.27 1yc8 s GLN 13 N 0.65 3.21 -0.32 1.45 1.11 -1.26 -2.94 119.66 121.55 1yc8 s GLN 13 Ca 0.00 1.28 -0.36 0.00 0.01 0.00 0.00 55.36 56.29 1yc8 s GLN 13 Cb 0.00 -2.01 -0.12 0.00 -1.01 0.00 0.00 33.01 29.87 1yc8 s GLN 13 CO 0.00 -0.91 2.13 0.00 0.01 0.00 0.00 175.29 176.52 1yc8 n ALA 14 N -2.05 0.96 0.00 6.09 0.00 -1.26 0.02 120.51 124.27 1yc8 n ALA 14 Ca 0.09 0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.54 1yc8 n ALA 14 Cb 0.52 -2.52 0.00 0.00 0.00 0.00 0.00 19.45 17.46 1yc8 n ALA 14 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yc8 n GLY 15 N 6.19 0.85 2.73 0.00 0.00 0.17 -4.96 105.19 110.18 1yc8 n GLY 15 Ca 0.39 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.20 1yc8 n GLY 15 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1yc8 n GLY 16 N -0.97 -1.48 3.39 -0.02 0.00 0.10 -4.05 105.19 102.16 1yc8 n GLY 16 Ca 0.00 -1.68 -0.20 0.00 0.00 0.00 0.00 46.02 44.14 1yc8 n GLY 16 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1yc8 s SER 17 N -4.41 2.40 -0.06 1.61 0.15 -1.26 -2.42 113.70 109.70 1yc8 s SER 17 Ca 0.54 -1.21 -0.30 0.00 0.70 0.00 0.00 55.95 55.67 1yc8 s SER 17 Cb -0.02 -0.10 0.08 0.00 -1.71 0.00 0.00 66.02 64.28 1yc8 s SER 17 CO 0.38 -0.42 0.75 -0.76 1.20 0.00 0.00 173.24 174.39 1yc8 s LEU 18 N -3.39 -0.59 -0.19 3.45 1.43 -0.54 -5.01 118.68 113.84 1yc8 s LEU 18 Ca 0.29 0.60 0.00 0.00 -1.03 0.00 0.00 54.13 54.00 1yc8 s LEU 18 Cb 0.05 2.39 0.05 0.00 0.03 0.00 0.00 46.19 48.70 1yc8 s LEU 18 CO 0.11 -0.57 -0.07 -0.60 0.23 0.00 0.00 176.35 175.45 1yc8 s ARG 19 N -1.34 1.64 -0.01 1.70 3.52 -1.26 0.44 118.95 123.65 1yc8 s ARG 19 Ca -0.08 -0.71 -0.22 0.00 -0.13 0.00 0.00 55.73 54.59 1yc8 s ARG 19 Cb -0.00 -2.26 -0.05 0.00 -1.56 0.00 0.00 34.95 31.08 1yc8 s ARG 19 CO 0.07 -0.47 0.65 -0.51 -0.81 0.00 0.00 175.30 174.22 1yc8 s LEU 20 N 1.52 4.40 -0.15 -0.88 1.43 0.93 -4.41 118.68 121.52 1yc8 s LEU 20 Ca -0.01 1.22 -0.00 0.00 -1.03 0.00 0.00 54.13 54.30 1yc8 s LEU 20 Cb -0.16 -3.01 -0.01 0.00 0.03 0.00 0.00 46.19 43.04 1yc8 s LEU 20 CO -0.08 0.05 -0.13 -0.44 0.23 0.00 0.00 176.35 175.98 1yc8 s SER 21 N 0.02 3.91 -0.61 2.29 0.01 -0.44 -0.62 113.70 118.25 1yc8 s SER 21 Ca 0.34 -0.38 0.04 0.00 1.31 0.00 0.00 55.95 57.26 1yc8 s SER 21 Cb -0.19 -1.60 0.16 0.00 0.21 0.00 0.00 66.02 64.60 1yc8 s SER 21 CO 0.18 0.12 0.41 0.00 0.41 0.00 0.00 173.24 174.36 1yc8 s ALA 23 N -0.90 3.56 -0.20 0.00 0.00 -1.10 -2.26 121.76 120.85 1yc8 s ALA 23 Ca 0.23 1.12 -0.01 0.00 0.00 0.00 0.00 51.96 53.30 1yc8 s ALA 23 Cb -0.10 -3.51 0.01 0.00 0.00 0.00 0.00 23.12 19.51 1yc8 s ALA 23 CO -0.12 -0.58 -0.12 0.08 0.00 0.00 0.00 175.76 175.02 1yc8 s VAL 24 N 0.60 2.73 0.17 0.00 1.01 -0.17 -1.44 120.40 123.31 1yc8 s VAL 24 Ca 0.61 -0.73 0.11 0.00 0.00 0.00 0.00 61.98 61.96 1yc8 s VAL 24 Cb -0.37 -2.21 -0.04 0.00 0.00 0.00 0.00 36.38 33.76 1yc8 s VAL 24 CO 0.34 0.47 -0.22 -0.94 0.00 0.00 0.00 175.10 174.76 1yc8 s SER 25 N 1.38 3.59 0.00 3.32 1.04 0.20 -4.77 113.70 118.46 1yc8 s SER 25 Ca 0.05 -0.77 0.00 0.00 0.48 0.00 0.00 55.95 55.71 1yc8 s SER 25 Cb -0.14 -0.35 0.00 0.00 0.10 0.00 0.00 66.02 65.63 1yc8 s SER 25 CO -0.08 0.13 0.00 0.61 0.98 0.00 0.00 173.24 174.88 1yc8 n GLY 26 N 0.38 2.38 3.60 7.32 0.00 -1.26 -0.94 105.19 116.67 1yc8 n GLY 26 Ca -0.13 -1.94 -0.43 0.00 0.00 0.00 0.00 46.02 43.52 1yc8 n GLY 26 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1yc8 s SER 27 N 0.00 6.08 0.01 1.61 0.01 -1.26 -4.84 113.70 115.30 1yc8 s SER 27 Ca 0.00 1.01 0.13 0.00 1.31 0.00 0.00 55.95 58.40 1yc8 s SER 27 Cb 0.00 -2.53 -0.20 0.00 0.21 0.00 0.00 66.02 63.50 1yc8 s SER 27 CO 0.00 -1.61 0.78 0.00 0.41 0.00 0.00 173.24 172.83 1yc8 h THR 28 N 6.64 0.86 0.00 1.44 1.03 -2.00 -3.44 112.91 117.43 1yc8 h THR 28 Ca -0.30 -2.60 0.00 0.00 -0.01 0.00 0.00 66.41 63.49 1yc8 h THR 28 Cb 1.14 2.38 0.00 0.00 -1.07 0.00 0.00 68.15 70.59 1yc8 h THR 28 CO 1.07 0.49 0.00 -1.22 -0.01 0.00 0.00 175.52 175.85 1yc8 n TYR 29 N -3.05 0.00 -3.53 0.00 4.02 -1.26 -4.93 117.16 108.42 1yc8 n TYR 29 Ca -0.13 0.00 -0.13 0.00 -0.01 0.00 0.00 57.90 57.63 1yc8 n TYR 29 Cb 0.98 -0.44 -0.05 0.00 -0.02 0.00 0.00 39.34 39.82 1yc8 n TYR 29 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 176.86 174.73 1yc8 s SER 30 N -3.04 -0.51 0.51 7.72 0.01 -1.26 -5.06 113.70 112.08 1yc8 s SER 30 Ca 0.00 0.44 -0.23 0.00 1.31 0.00 0.00 55.95 57.48 1yc8 s SER 30 Cb 0.00 0.44 -0.06 0.00 0.21 0.00 0.00 66.02 66.61 1yc8 s SER 30 CO 0.00 -0.55 1.31 -0.81 0.41 0.00 0.00 173.24 173.60 1yc8 n PRO 31 N 0.57 1.74 -4.40 12.44 -0.04 -1.26 -4.87 135.00 139.18 1yc8 n PRO 31 Ca -0.14 0.63 -0.28 0.00 -0.04 0.00 0.00 63.50 63.67 1yc8 n PRO 31 Cb 0.59 -2.49 -0.12 0.00 -0.04 0.00 0.00 33.50 31.43 1yc8 n PRO 31 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1yc8 s THR 33 N -1.32 5.28 -0.16 0.00 2.01 -0.91 -3.90 115.64 116.63 1yc8 s THR 33 Ca 0.17 0.58 -0.02 0.00 0.31 0.00 0.00 61.69 62.73 1yc8 s THR 33 Cb -0.09 -3.63 -0.01 0.00 0.01 0.00 0.00 72.50 68.77 1yc8 s THR 33 CO 0.08 0.43 -0.09 -0.89 -0.69 0.00 0.00 174.62 173.46 1yc8 s THR 34 N 0.13 3.24 0.22 -0.82 2.01 -0.77 -1.78 115.64 117.86 1yc8 s THR 34 Ca 0.18 -0.58 0.11 0.00 0.31 0.00 0.00 61.69 61.71 1yc8 s THR 34 Cb -0.13 -2.40 -0.05 0.00 0.01 0.00 0.00 72.50 69.93 1yc8 s THR 34 CO 0.05 0.49 -0.21 -0.83 -0.69 0.00 0.00 174.62 173.44 1yc8 s GLY 35 N 0.68 1.76 -0.10 4.40 0.00 0.21 -2.41 107.32 111.86 1yc8 s GLY 35 Ca -0.05 -1.69 0.02 0.00 0.00 0.00 0.00 44.72 43.00 1yc8 s GLY 35 CO 0.02 -1.74 -0.18 -0.98 0.00 0.00 0.00 173.10 170.23 1yc8 s TRP 36 N -1.91 2.13 0.00 1.90 0.52 -0.74 0.87 118.94 121.71 1yc8 s TRP 36 Ca 0.24 -0.96 0.05 0.00 0.02 0.00 0.00 56.10 55.45 1yc8 s TRP 36 Cb -0.07 -1.49 -0.01 0.00 -1.15 0.00 0.00 33.47 30.74 1yc8 s TRP 36 CO 0.12 -0.45 -0.16 0.14 0.02 0.00 0.00 176.95 176.62 1yc8 s VAL 37 N 0.76 1.24 0.28 4.03 -7.23 0.63 -0.73 120.40 119.39 1yc8 s VAL 37 Ca -0.11 -0.76 0.10 0.00 -1.81 0.00 0.00 61.98 59.41 1yc8 s VAL 37 Cb -0.16 -1.05 -0.05 0.00 0.56 0.00 0.00 36.38 35.68 1yc8 s VAL 37 CO 0.02 0.28 -0.04 0.00 -0.31 0.00 0.00 175.10 175.05 1yc8 s ARG 38 N -0.55 2.14 -0.16 4.82 1.70 -1.13 0.42 118.95 126.19 1yc8 s ARG 38 Ca 0.05 -1.54 -0.03 0.00 -0.47 0.00 0.00 55.73 53.75 1yc8 s ARG 38 Cb -0.06 -2.05 0.05 0.00 -0.57 0.00 0.00 34.95 32.32 1yc8 s ARG 38 CO -0.00 0.32 0.03 -1.14 -1.08 0.00 0.00 175.30 173.43 1yc8 s GLN 39 N -3.65 0.59 0.40 3.89 0.74 0.81 -2.47 119.66 119.97 1yc8 s GLN 39 Ca 0.32 -0.26 -0.24 0.00 0.05 0.00 0.00 55.36 55.23 1yc8 s GLN 39 Cb -0.05 -1.81 -0.09 0.00 1.10 0.00 0.00 33.01 32.16 1yc8 s GLN 39 CO 0.19 -0.56 1.06 0.00 -0.55 0.00 0.00 175.29 175.42 1yc8 s ALA 40 N 1.91 3.08 -0.10 1.58 0.00 -1.26 -0.66 121.76 126.33 1yc8 s ALA 40 Ca 0.01 0.71 -0.37 0.00 0.00 0.00 0.00 51.96 52.31 1yc8 s ALA 40 Cb -0.16 -3.28 -0.15 0.00 0.00 0.00 0.00 23.12 19.53 1yc8 s ALA 40 CO -0.07 -0.23 1.64 -2.30 0.00 0.00 0.00 175.76 174.79 1yc8 n PRO 41 N -0.08 1.44 0.00 0.00 -0.02 -1.26 0.00 135.00 135.08 1yc8 n PRO 41 Ca 0.05 0.52 0.00 0.00 -2.02 0.00 0.00 63.50 62.05 1yc8 n PRO 41 Cb 0.49 -2.23 0.00 0.00 -0.02 0.00 0.00 33.50 31.74 1yc8 n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1yc8 n GLY 42 N 3.69 2.84 3.95 -1.23 0.00 -1.26 -4.97 105.19 108.21 1yc8 n GLY 42 Ca 0.23 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.97 1yc8 n GLY 42 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1yc8 n LYS 43 N -1.37 -0.91 0.00 1.61 4.76 0.10 -5.11 118.16 117.24 1yc8 n LYS 43 Ca 0.00 -2.34 0.00 0.00 -2.87 0.00 0.00 58.31 53.10 1yc8 n LYS 43 Cb 0.00 -1.15 0.00 0.00 -1.84 0.00 0.00 35.03 32.04 1yc8 n LYS 43 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1yc8 n GLY 44 N -3.51 0.89 3.27 0.72 0.00 -1.26 -4.57 105.19 100.72 1yc8 n GLY 44 Ca 0.17 -0.44 -0.30 0.00 0.00 0.00 0.00 46.02 45.45 1yc8 n GLY 44 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1yc8 s LEU 45 N 0.00 2.04 -0.02 0.99 1.43 -1.26 -3.98 118.68 117.88 1yc8 s LEU 45 Ca 0.00 -0.46 0.01 0.00 -1.03 0.00 0.00 54.13 52.65 1yc8 s LEU 45 Cb 0.00 -1.28 0.01 0.00 0.03 0.00 0.00 46.19 44.95 1yc8 s LEU 45 CO 0.00 0.27 -0.04 -1.83 0.23 0.00 0.00 176.35 174.98 1yc8 s GLU 46 N -0.37 0.50 -0.25 1.70 -1.05 -1.03 -5.02 118.70 113.19 1yc8 s GLU 46 Ca 0.03 -0.10 -0.29 0.00 -0.15 0.00 0.00 54.97 54.47 1yc8 s GLU 46 Cb -0.11 -0.54 -0.03 0.00 -0.44 0.00 0.00 34.13 33.01 1yc8 s GLU 46 CO 0.01 0.00 1.74 -0.46 0.95 0.00 0.00 175.26 177.50 1yc8 s TRP 47 N 0.43 1.89 0.00 4.83 -0.00 -1.26 -2.85 118.94 121.98 1yc8 s TRP 47 Ca -0.05 0.52 0.00 0.00 -0.00 0.00 0.00 56.10 56.57 1yc8 s TRP 47 Cb -0.08 -4.05 0.00 0.00 -0.00 0.00 0.00 33.47 29.34 1yc8 s TRP 47 CO -0.00 -3.16 0.00 0.28 -0.00 0.00 0.00 176.95 174.07 1yc8 n VAL 48 N 6.83 0.00 -4.23 5.86 0.31 0.09 -4.44 118.33 122.75 1yc8 n VAL 48 Ca 0.21 0.07 -0.13 0.00 -0.01 0.00 0.00 64.34 64.48 1yc8 n VAL 48 Cb 0.46 -0.49 -0.10 0.00 -0.91 0.00 0.00 33.84 32.79 1yc8 n VAL 48 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 1yc8 s SER 49 N -1.33 1.20 -0.09 4.52 0.15 -1.22 -0.45 113.70 116.47 1yc8 s SER 49 Ca 0.00 -1.15 -0.25 0.00 0.70 0.00 0.00 55.95 55.25 1yc8 s SER 49 Cb 0.00 0.12 0.06 0.00 -1.71 0.00 0.00 66.02 64.48 1yc8 s SER 49 CO 0.00 -0.55 0.58 -0.44 1.20 0.00 0.00 173.24 174.02 1yc8 s SER 50 N -3.15 -0.55 -0.19 5.45 0.01 -0.73 -1.79 113.70 112.74 1yc8 s SER 50 Ca 0.22 0.72 -0.01 0.00 1.31 0.00 0.00 55.95 58.19 1yc8 s SER 50 Cb 0.06 0.68 0.05 0.00 0.21 0.00 0.00 66.02 67.03 1yc8 s SER 50 CO 0.03 -0.46 -0.02 -0.51 0.41 0.00 0.00 173.24 172.68 1yc8 s ILE 51 N -0.80 1.02 -0.22 1.44 2.07 -1.01 -1.88 121.20 121.82 1yc8 s ILE 51 Ca -0.08 -0.76 0.22 0.00 -1.41 0.00 0.00 60.65 58.61 1yc8 s ILE 51 Cb -0.02 -1.33 0.22 0.00 0.13 0.00 0.00 42.46 41.45 1yc8 s ILE 51 CO 0.06 -0.04 1.67 -1.54 -1.91 0.00 0.00 174.94 173.17 1yc8 n SER 52 N 4.88 0.57 0.00 4.50 3.41 0.03 -1.85 113.62 125.15 1yc8 n SER 52 Ca -0.11 0.76 0.00 0.00 -0.26 0.00 0.00 58.87 59.26 1yc8 n SER 52 Cb 0.46 -0.83 0.00 0.00 -0.26 0.00 0.00 64.21 63.58 1yc8 n SER 52 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1yc8 n SER 53 N -2.26 0.00 0.29 4.04 3.41 -1.25 -4.12 113.62 113.73 1yc8 n SER 53 Ca -0.01 0.00 0.17 0.00 -0.26 0.00 0.00 58.87 58.77 1yc8 n SER 53 Cb 0.05 0.00 0.87 0.00 -0.26 0.00 0.00 64.21 64.87 1yc8 n SER 53 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 1yc8 h PRO 54 N 0.00 0.00 0.00 4.33 0.11 -1.91 -3.45 132.00 131.08 1yc8 h PRO 54 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1yc8 h PRO 54 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 1yc8 h PRO 54 CO 0.00 0.05 0.00 0.41 -0.21 0.00 0.00 178.00 178.25 1yc8 n GLY 55 N -0.67 0.86 3.75 -0.55 0.00 -1.26 -5.11 105.19 102.19 1yc8 n GLY 55 Ca -0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.59 1yc8 n GLY 55 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1yc8 s THR 56 N -1.48 2.58 0.00 2.61 2.01 -1.26 -4.83 115.64 115.27 1yc8 s THR 56 Ca 0.00 0.49 0.00 0.00 0.31 0.00 0.00 61.69 62.49 1yc8 s THR 56 Cb 0.00 -3.31 0.00 0.00 0.01 0.00 0.00 72.50 69.20 1yc8 s THR 56 CO 0.00 0.08 0.00 -0.38 -0.69 0.00 0.00 174.62 173.63 1yc8 n ILE 57 N 2.32 0.00 0.00 1.82 5.41 -1.26 -0.79 119.36 126.86 1yc8 n ILE 57 Ca 0.07 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.82 1yc8 n ILE 57 Cb 0.40 -1.06 0.00 0.00 -0.71 0.00 0.00 39.64 38.26 1yc8 n ILE 57 CO 0.00 0.00 0.00 -1.22 0.00 0.00 0.00 176.55 175.33 1yc8 n TYR 58 N -0.81 0.00 -3.93 1.39 4.02 -0.79 -4.82 117.16 112.22 1yc8 n TYR 58 Ca 0.00 0.00 -0.10 0.00 -0.01 0.00 0.00 57.90 57.79 1yc8 n TYR 58 Cb 0.00 0.00 -0.10 0.00 -0.02 0.00 0.00 39.34 39.22 1yc8 n TYR 58 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 176.86 176.56 1yc8 s TYR 59 N -1.12 0.18 -0.05 -0.72 1.51 -1.26 -1.77 117.35 114.11 1yc8 s TYR 59 Ca 0.00 -0.43 -0.30 0.00 -1.01 0.00 0.00 57.07 55.33 1yc8 s TYR 59 Cb 0.00 -0.13 -0.03 0.00 -0.11 0.00 0.00 41.96 41.68 1yc8 s TYR 59 CO 0.00 -0.32 1.24 -1.14 -1.11 0.00 0.00 175.55 174.22 1yc8 s GLN 60 N -2.14 4.33 0.47 -0.62 2.00 0.40 -4.88 119.66 119.22 1yc8 s GLN 60 Ca -0.09 1.72 0.32 0.00 -2.00 0.00 0.00 55.36 55.32 1yc8 s GLN 60 Cb -0.04 -3.58 1.44 0.00 0.80 0.00 0.00 33.01 31.63 1yc8 s GLN 60 CO -0.03 -0.49 1.68 -0.44 -0.50 0.00 0.00 175.29 175.51 1yc8 h ASP 61 N 7.58 0.20 0.35 6.67 3.32 -1.93 0.49 116.42 133.10 1yc8 h ASP 61 Ca -0.34 0.08 0.00 0.00 0.02 0.00 0.00 57.03 56.79 1yc8 h ASP 61 Cb 1.16 0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.77 1yc8 h ASP 61 CO 0.89 -0.07 0.00 0.77 -1.72 0.00 0.00 179.24 179.11 1yc8 h SER 62 N 0.11 0.00 -0.00 6.45 4.64 -1.97 -3.10 113.55 119.68 1yc8 h SER 62 Ca 0.75 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 62.07 1yc8 h SER 62 Cb 2.51 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.60 1yc8 h SER 62 CO -0.25 0.00 -0.10 1.33 -0.87 0.00 0.00 176.83 176.94 1yc8 n VAL 63 N -2.64 0.00 -1.63 0.95 0.24 0.17 -4.96 118.33 110.46 1yc8 n VAL 63 Ca -0.01 -0.45 -0.49 0.00 -2.04 0.00 0.00 64.34 61.35 1yc8 n VAL 63 Cb 0.14 1.01 -0.05 0.00 -1.47 0.00 0.00 33.84 33.46 1yc8 n VAL 63 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 1yc8 n LYS 64 N -0.89 1.63 0.00 7.34 5.02 -1.07 -0.01 118.16 130.18 1yc8 n LYS 64 Ca 0.01 0.59 0.00 0.00 -2.02 0.00 0.00 58.31 56.88 1yc8 n LYS 64 Cb 0.04 -2.29 0.00 0.00 -0.02 0.00 0.00 35.03 32.76 1yc8 n LYS 64 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1yc8 n GLY 65 N 2.98 1.94 0.03 0.72 0.00 -1.26 -4.77 105.19 104.82 1yc8 n GLY 65 Ca 0.18 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.17 1yc8 n GLY 65 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1yc8 n ARG 66 N -2.00 2.08 -4.59 1.61 1.74 0.99 -5.00 116.66 111.49 1yc8 n ARG 66 Ca 0.00 0.01 -0.34 0.00 -0.77 0.00 0.00 57.85 56.75 1yc8 n ARG 66 Cb 0.00 -1.13 -0.11 0.00 -1.02 0.00 0.00 32.46 30.20 1yc8 n ARG 66 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 1yc8 s PHE 67 N -2.12 2.96 -0.20 -1.55 2.99 -0.35 -0.60 117.98 119.11 1yc8 s PHE 67 Ca -0.05 -0.01 0.01 0.00 0.00 0.00 0.00 56.93 56.89 1yc8 s PHE 67 Cb 0.02 -1.74 0.04 0.00 0.00 0.00 0.00 43.02 41.33 1yc8 s PHE 67 CO 0.18 0.30 -0.14 0.99 -0.00 0.00 0.00 175.22 176.56 1yc8 s THR 68 N -0.68 1.88 -0.33 0.64 2.01 0.09 -4.83 115.64 114.42 1yc8 s THR 68 Ca 0.10 -1.09 -0.13 0.00 0.31 0.00 0.00 61.69 60.89 1yc8 s THR 68 Cb -0.11 -1.86 -0.02 0.00 0.01 0.00 0.00 72.50 70.51 1yc8 s THR 68 CO 0.02 0.26 0.23 -0.51 -0.69 0.00 0.00 174.62 173.93 1yc8 s ILE 69 N 1.31 5.28 0.22 1.82 2.07 -1.26 -0.97 121.20 129.67 1yc8 s ILE 69 Ca -0.00 -0.17 0.08 0.00 -1.41 0.00 0.00 60.65 59.15 1yc8 s ILE 69 Cb -0.16 -3.69 -0.05 0.00 0.13 0.00 0.00 42.46 38.70 1yc8 s ILE 69 CO -0.09 0.02 -0.14 -0.94 -1.91 0.00 0.00 174.94 171.89 1yc8 s SER 70 N 1.73 2.71 0.03 4.50 1.04 -1.07 -4.94 113.70 117.70 1yc8 s SER 70 Ca 0.06 -1.05 -0.01 0.00 0.48 0.00 0.00 55.95 55.44 1yc8 s SER 70 Cb -0.17 -0.16 -0.03 0.00 0.10 0.00 0.00 66.02 65.76 1yc8 s SER 70 CO 0.11 -0.17 -0.02 -0.60 0.98 0.00 0.00 173.24 173.54 1yc8 s ARG 71 N -3.64 0.46 -0.41 4.02 3.52 -1.26 0.11 118.95 121.74 1yc8 s ARG 71 Ca 0.24 -0.87 0.02 0.00 -0.13 0.00 0.00 55.73 54.99 1yc8 s ARG 71 Cb -0.01 0.16 0.13 0.00 -1.56 0.00 0.00 34.95 33.67 1yc8 s ARG 71 CO 0.08 -0.08 0.20 0.34 -0.81 0.00 0.00 175.30 175.03 1yc8 s ASP 72 N -2.12 3.78 0.26 -2.12 3.68 0.16 -4.99 116.67 115.34 1yc8 s ASP 72 Ca -0.06 -2.43 -0.01 0.00 2.13 0.00 0.00 52.55 52.19 1yc8 s ASP 72 Cb -0.02 -1.04 0.57 0.00 -1.45 0.00 0.00 42.92 40.98 1yc8 s ASP 72 CO -0.05 -0.30 1.71 0.78 0.13 0.00 0.00 175.17 177.44 1yc8 h ASN 73 N 7.01 0.28 -0.24 -0.34 2.35 -1.96 0.54 115.58 123.24 1yc8 h ASN 73 Ca -0.04 0.13 0.06 0.00 -0.55 0.00 0.00 56.30 55.91 1yc8 h ASN 73 Cb 0.95 0.11 -0.07 0.00 0.05 0.00 0.00 38.32 39.36 1yc8 h ASN 73 CO 0.49 0.06 -0.23 0.00 -1.65 0.00 0.00 177.43 176.09 1yc8 h ALA 74 N 1.62 -0.11 0.00 -0.83 0.00 -1.96 -0.22 119.26 117.77 1yc8 h ALA 74 Ca 0.48 0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.46 1yc8 h ALA 74 Cb 0.81 0.48 0.00 0.00 0.00 0.00 0.00 17.79 19.08 1yc8 h ALA 74 CO -0.47 -0.65 -0.09 1.63 0.00 0.00 0.00 179.25 179.67 1yc8 n LYS 75 N -5.37 0.09 -3.63 0.00 5.02 -0.42 -4.92 118.16 108.93 1yc8 n LYS 75 Ca -0.01 0.06 -0.22 0.00 -2.02 0.00 0.00 58.31 56.12 1yc8 n LYS 75 Cb 0.28 -1.59 0.04 0.00 -0.02 0.00 0.00 35.03 33.74 1yc8 n LYS 75 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1yc8 n ASN 76 N -1.74 -2.67 -3.91 4.39 4.05 0.18 -4.56 115.26 111.00 1yc8 n ASN 76 Ca 0.06 -0.84 -0.20 0.00 0.45 0.00 0.00 54.58 54.05 1yc8 n ASN 76 Cb 0.37 -4.09 -0.16 0.00 1.23 0.00 0.00 39.78 37.12 1yc8 n ASN 76 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 177.26 173.32 1yc8 s THR 77 N -3.59 0.61 -0.09 -0.44 2.01 -1.03 -0.99 115.64 112.12 1yc8 s THR 77 Ca 0.15 -0.18 -0.01 0.00 0.31 0.00 0.00 61.69 61.97 1yc8 s THR 77 Cb -0.04 -0.62 -0.03 0.00 0.01 0.00 0.00 72.50 71.82 1yc8 s THR 77 CO 0.81 0.24 -0.04 -0.69 -0.69 0.00 0.00 174.62 174.25 1yc8 s VAL 78 N 0.82 3.93 0.34 3.82 1.01 -0.96 -0.66 120.40 128.70 1yc8 s VAL 78 Ca -0.12 -0.39 0.08 0.00 0.00 0.00 0.00 61.98 61.56 1yc8 s VAL 78 Cb -0.14 -2.64 -0.04 0.00 0.00 0.00 0.00 36.38 33.56 1yc8 s VAL 78 CO 0.01 0.59 0.11 -0.31 0.00 0.00 0.00 175.10 175.50 1yc8 s TYR 79 N -0.67 2.67 -0.26 5.22 2.02 0.31 -0.20 117.35 126.44 1yc8 s TYR 79 Ca 0.10 -0.40 -0.01 0.00 -0.37 0.00 0.00 57.07 56.39 1yc8 s TYR 79 Cb -0.12 -1.61 0.14 0.00 -0.40 0.00 0.00 41.96 39.97 1yc8 s TYR 79 CO 0.02 0.37 0.38 -1.17 -1.57 0.00 0.00 175.55 173.58 1yc8 s LEU 80 N -3.82 -0.64 -0.13 -1.29 2.96 0.21 -2.61 118.68 113.35 1yc8 s LEU 80 Ca 0.37 -0.00 -0.20 0.00 -0.22 0.00 0.00 54.13 54.08 1yc8 s LEU 80 Cb -0.02 1.07 -0.04 0.00 0.50 0.00 0.00 46.19 47.70 1yc8 s LEU 80 CO 0.22 -0.32 0.56 -1.58 -1.32 0.00 0.00 176.35 173.91 1yc8 s GLN 81 N 2.53 4.32 -0.30 1.98 2.00 -0.15 -0.05 119.66 129.99 1yc8 s GLN 81 Ca 0.12 0.57 0.03 0.00 -2.00 0.00 0.00 55.36 54.08 1yc8 s GLN 81 Cb -0.15 -3.48 0.08 0.00 0.80 0.00 0.00 33.01 30.26 1yc8 s GLN 81 CO -0.21 0.02 -0.04 -1.64 -0.50 0.00 0.00 175.29 172.92 1yc8 s MET 82 N 1.05 1.94 0.32 1.67 -1.94 0.17 -0.73 119.30 121.79 1yc8 s MET 82 Ca 0.29 -1.56 0.05 0.00 -1.71 0.00 0.00 55.69 52.76 1yc8 s MET 82 Cb -0.16 -3.04 -0.02 0.00 2.01 0.00 0.00 34.83 33.63 1yc8 s MET 82 CO 0.12 -0.73 0.46 -0.80 -0.01 0.00 0.00 175.02 174.06 1yc8 s ASN 83 N 1.04 6.07 -0.87 3.03 0.02 0.23 -1.46 114.94 123.01 1yc8 s ASN 83 Ca -0.01 -0.05 -0.13 0.00 -1.02 0.00 0.00 52.86 51.65 1yc8 s ASN 83 Cb -0.20 -1.47 0.02 0.00 0.02 0.00 0.00 41.25 39.62 1yc8 s ASN 83 CO -0.06 -0.35 0.55 -1.20 0.02 0.00 0.00 177.10 176.07 1yc8 n SER 84 N -1.62 -3.92 -4.73 -1.22 7.64 -1.16 -4.71 113.62 103.90 1yc8 n SER 84 Ca -0.03 -0.98 -0.42 0.00 1.01 0.00 0.00 58.87 58.45 1yc8 n SER 84 Cb 0.58 -1.38 -0.03 0.00 -1.01 0.00 0.00 64.21 62.36 1yc8 n SER 84 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1yc8 s LEU 85 N -5.69 4.41 0.43 -3.43 1.43 -1.02 -4.78 118.68 110.04 1yc8 s LEU 85 Ca 0.18 2.14 0.03 0.00 -1.03 0.00 0.00 54.13 55.45 1yc8 s LEU 85 Cb -0.10 -3.59 0.00 0.00 0.03 0.00 0.00 46.19 42.53 1yc8 s LEU 85 CO 0.81 -0.43 0.62 -1.10 0.23 0.00 0.00 176.35 176.48 1yc8 s GLN 86 N 0.42 2.95 0.31 1.70 -0.21 -1.26 -0.66 119.66 122.91 1yc8 s GLN 86 Ca 0.56 -0.80 0.03 0.00 0.02 0.00 0.00 55.36 55.18 1yc8 s GLN 86 Cb -0.31 -2.65 0.51 0.00 1.00 0.00 0.00 33.01 31.56 1yc8 s GLN 86 CO 0.33 -0.26 1.81 0.07 -2.12 0.00 0.00 175.29 175.12 1yc8 h ARG 87 N 0.51 0.54 0.00 2.91 -0.00 -1.94 -1.80 114.38 114.60 1yc8 h ARG 87 Ca -0.44 -0.14 0.00 0.00 -0.00 0.00 0.00 59.98 59.39 1yc8 h ARG 87 Cb 1.27 -0.06 0.00 0.00 -0.00 0.00 0.00 29.97 31.17 1yc8 h ARG 87 CO 0.53 0.63 0.00 -0.85 -0.00 0.00 0.00 179.97 180.28 1yc8 n GLU 88 N -4.22 0.00 0.00 0.08 0.28 -1.26 -0.89 120.64 114.63 1yc8 n GLU 88 Ca 0.01 0.42 0.14 0.00 -0.16 0.00 0.00 57.16 57.58 1yc8 n GLU 88 Cb 0.30 -1.50 0.59 0.00 1.43 0.00 0.00 31.44 32.26 1yc8 n GLU 88 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 1yc8 n ASP 89 N -1.48 0.78 -4.76 -1.84 8.00 -0.68 -4.90 116.55 111.68 1yc8 n ASP 89 Ca 0.01 -0.93 -0.41 0.00 0.71 0.00 0.00 54.79 54.16 1yc8 n ASP 89 Cb 0.04 -0.00 -0.01 0.00 -0.02 0.00 0.00 41.12 41.12 1yc8 n ASP 89 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1yc8 s THR 90 N -2.29 2.22 -5.00 -3.53 2.01 -0.07 -4.88 115.64 104.09 1yc8 s THR 90 Ca 0.33 0.19 0.00 0.00 0.31 0.00 0.00 61.69 62.52 1yc8 s THR 90 Cb 0.20 -3.12 0.00 0.00 0.01 0.00 0.00 72.50 69.59 1yc8 s THR 90 CO 0.43 0.03 0.00 0.61 -0.69 0.00 0.00 174.62 175.01 1yc8 n GLY 91 N 1.76 -0.88 3.59 4.40 0.00 0.13 -4.38 105.19 109.81 1yc8 n GLY 91 Ca 0.06 -1.52 -0.40 0.00 0.00 0.00 0.00 46.02 44.16 1yc8 n GLY 91 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1yc8 s MET 92 N -1.84 3.88 -0.23 1.61 -2.45 0.17 -0.50 119.30 119.93 1yc8 s MET 92 Ca 0.00 -0.06 -0.11 0.00 -1.25 0.00 0.00 55.69 54.27 1yc8 s MET 92 Cb 0.00 -3.71 -0.05 0.00 1.25 0.00 0.00 34.83 32.33 1yc8 s MET 92 CO 0.00 -0.38 0.18 0.71 1.05 0.00 0.00 175.02 176.58 1yc8 s TYR 93 N 2.12 3.33 0.04 4.11 1.51 0.35 -0.13 117.35 128.68 1yc8 s TYR 93 Ca 0.15 0.28 0.08 0.00 -1.01 0.00 0.00 57.07 56.57 1yc8 s TYR 93 Cb -0.16 -2.28 -0.03 0.00 -0.11 0.00 0.00 41.96 39.38 1yc8 s TYR 93 CO 0.11 0.09 -0.22 0.71 -1.11 0.00 0.00 175.55 175.12 1yc8 s TYR 94 N 1.00 1.93 -0.09 2.71 1.51 0.17 -0.73 117.35 123.84 1yc8 s TYR 94 Ca 0.09 -0.38 -0.05 0.00 -1.01 0.00 0.00 57.07 55.72 1yc8 s TYR 94 Cb -0.13 -1.16 -0.04 0.00 -0.11 0.00 0.00 41.96 40.52 1yc8 s TYR 94 CO 0.04 0.10 0.11 0.00 -1.11 0.00 0.00 175.55 174.69 1yc8 s GLN 96 N -1.18 2.05 -0.03 0.00 0.74 0.25 -1.20 119.66 120.29 1yc8 s GLN 96 Ca 0.17 -0.83 0.07 0.00 0.05 0.00 0.00 55.36 54.81 1yc8 s GLN 96 Cb -0.12 -1.89 -0.01 0.00 1.10 0.00 0.00 33.01 32.09 1yc8 s GLN 96 CO 0.06 0.45 -0.23 0.96 -0.55 0.00 0.00 175.29 175.98 1yc8 s ILE 97 N -0.39 1.83 -0.16 -2.34 -0.00 -0.20 0.64 121.20 120.58 1yc8 s ILE 97 Ca 0.05 -0.97 0.01 0.00 -0.00 0.00 0.00 60.65 59.73 1yc8 s ILE 97 Cb -0.10 -1.53 0.02 0.00 -0.00 0.00 0.00 42.46 40.84 1yc8 s ILE 97 CO 0.01 0.52 -0.18 -1.10 -0.00 0.00 0.00 174.94 174.18 1yc8 s GLN 98 N -0.39 2.70 -0.35 0.37 -0.21 -0.73 -0.94 119.66 120.11 1yc8 s GLN 98 Ca 0.05 -0.72 0.01 0.00 0.02 0.00 0.00 55.36 54.72 1yc8 s GLN 98 Cb -0.10 -2.35 0.11 0.00 1.00 0.00 0.00 33.01 31.66 1yc8 s GLN 98 CO 0.01 -0.20 0.11 0.00 -2.12 0.00 0.00 175.29 173.09 1yc8 s GLY 100 N 1.14 0.19 0.01 0.00 0.00 -1.26 -3.42 107.32 103.98 1yc8 s GLY 100 Ca 0.12 0.01 -0.21 0.00 0.00 0.00 0.00 44.72 44.64 1yc8 s GLY 100 CO -0.15 0.23 1.19 -2.08 0.00 0.00 0.00 173.10 172.29 1yc8 h VAL 101 N 5.64 1.42 -1.94 1.40 2.07 -1.97 -3.46 116.25 119.42 1yc8 h VAL 101 Ca -0.34 -1.68 -0.01 0.00 0.82 0.00 0.00 66.70 65.49 1yc8 h VAL 101 Cb 1.17 2.30 0.00 0.00 -1.52 0.00 0.00 31.29 33.24 1yc8 h VAL 101 CO 0.49 0.48 -0.01 -0.24 0.02 0.00 0.00 177.57 178.31 1yc8 n SER 103 N -4.45 -2.01 -3.97 0.57 2.88 -1.26 -5.10 113.62 100.28 1yc8 n SER 103 Ca -0.08 -0.01 -0.34 0.00 -1.33 0.00 0.00 58.87 57.11 1yc8 n SER 103 Cb 0.48 -0.59 -0.10 0.00 -0.75 0.00 0.00 64.21 63.25 1yc8 n SER 103 CO 0.00 0.00 0.00 2.30 -1.23 0.00 0.00 175.04 176.11 1yc8 n ILE 104 N -1.26 0.56 -2.68 2.46 -0.00 -1.26 -4.75 119.36 112.43 1yc8 n ILE 104 Ca -0.00 -0.53 -0.41 0.00 -0.00 0.00 0.00 62.75 61.81 1yc8 n ILE 104 Cb 0.50 -2.08 -0.05 0.00 -0.00 0.00 0.00 39.64 38.02 1yc8 n ILE 104 CO 0.00 0.00 0.00 -0.13 -0.00 0.00 0.00 176.55 176.42 1yc8 s ARG 105 N 7.04 4.71 -0.04 6.28 3.00 -1.22 -4.96 118.95 133.77 1yc8 s ARG 105 Ca 0.71 1.53 0.03 0.00 0.00 0.00 0.00 55.73 57.99 1yc8 s ARG 105 Cb 0.07 -3.32 0.01 0.00 0.00 0.00 0.00 34.95 31.70 1yc8 s ARG 105 CO 0.24 0.26 -0.10 -2.00 0.00 0.00 0.00 175.30 173.70 1yc8 s GLU 106 N -0.43 1.20 0.05 3.54 2.12 -1.26 -1.81 118.70 122.12 1yc8 s GLU 106 Ca 0.46 -0.35 0.00 0.00 0.36 0.00 0.00 54.97 55.45 1yc8 s GLU 106 Cb -0.26 -1.08 -0.03 0.00 0.26 0.00 0.00 34.13 33.02 1yc8 s GLU 106 CO 0.32 0.09 -0.04 0.71 -0.54 0.00 0.00 175.26 175.80 1yc8 s TYR 107 N 0.34 0.53 0.05 5.30 1.51 -0.12 -4.98 117.35 119.99 1yc8 s TYR 107 Ca -0.06 -0.77 0.03 0.00 -1.01 0.00 0.00 57.07 55.25 1yc8 s TYR 107 Cb -0.11 -0.35 -0.03 0.00 -0.11 0.00 0.00 41.96 41.36 1yc8 s TYR 107 CO 0.01 -0.23 -0.09 -1.58 -1.11 0.00 0.00 175.55 172.55 1yc8 s TRP 108 N -2.66 0.80 0.00 2.71 0.52 -1.26 -1.03 118.94 118.01 1yc8 s TRP 108 Ca -0.02 -0.50 0.00 0.00 0.02 0.00 0.00 56.10 55.59 1yc8 s TRP 108 Cb -0.01 -0.47 0.00 0.00 -1.15 0.00 0.00 33.47 31.84 1yc8 s TRP 108 CO -0.04 -0.05 0.00 0.41 0.02 0.00 0.00 176.95 177.28 1yc8 n GLY 109 N 1.37 -1.27 0.64 0.98 0.00 -0.34 -4.69 105.19 101.88 1yc8 n GLY 109 Ca -0.22 -1.59 0.08 0.00 0.00 0.00 0.00 46.02 44.29 1yc8 n GLY 109 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1yc8 n GLN 110 N -0.49 1.24 0.00 1.61 -0.06 -1.26 -4.88 117.38 113.55 1yc8 n GLN 110 Ca 0.00 -1.47 0.00 0.00 -2.00 0.00 0.00 57.00 53.53 1yc8 n GLN 110 Cb 0.00 -1.30 0.00 0.00 -4.06 0.00 0.00 30.24 24.88 1yc8 n GLN 110 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1yc8 n GLY 111 N 0.89 -0.48 3.23 1.69 0.00 -1.26 -5.02 105.19 104.24 1yc8 n GLY 111 Ca 0.09 -1.68 -0.11 0.00 0.00 0.00 0.00 46.02 44.32 1yc8 n GLY 111 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1yc8 s THR 112 N -2.54 -0.02 -0.02 2.61 -1.32 0.09 -4.80 115.64 109.64 1yc8 s THR 112 Ca 0.00 0.08 -0.25 0.00 -1.21 0.00 0.00 61.69 60.31 1yc8 s THR 112 Cb 0.00 -0.54 -0.04 0.00 -1.51 0.00 0.00 72.50 70.41 1yc8 s THR 112 CO 0.00 0.03 0.78 -1.58 -2.21 0.00 0.00 174.62 171.64 1yc8 s GLN 113 N 1.06 4.48 -0.20 7.08 2.00 -1.26 -0.49 119.66 132.33 1yc8 s GLN 113 Ca -0.07 1.05 0.01 0.00 -2.00 0.00 0.00 55.36 54.35 1yc8 s GLN 113 Cb -0.07 -3.43 0.02 0.00 0.80 0.00 0.00 33.01 30.34 1yc8 s GLN 113 CO -0.08 0.10 -0.17 0.08 -0.50 0.00 0.00 175.29 174.71 1yc8 s VAL 114 N 0.61 2.17 -0.10 1.34 1.01 0.35 0.12 120.40 125.89 1yc8 s VAL 114 Ca 0.41 -1.03 0.03 0.00 0.00 0.00 0.00 61.98 61.40 1yc8 s VAL 114 Cb -0.19 -1.98 -0.00 0.00 0.00 0.00 0.00 36.38 34.21 1yc8 s VAL 114 CO 0.22 0.44 -0.22 -0.89 0.00 0.00 0.00 175.10 174.65 1yc8 s THR 115 N 1.27 2.28 -0.28 3.92 2.01 -0.69 0.19 115.64 124.36 1yc8 s THR 115 Ca 0.03 -0.95 -0.00 0.00 0.31 0.00 0.00 61.69 61.08 1yc8 s THR 115 Cb -0.14 -1.89 0.08 0.00 0.01 0.00 0.00 72.50 70.56 1yc8 s THR 115 CO -0.11 0.55 0.04 -0.69 -0.69 0.00 0.00 174.62 173.73 1yc8 s VAL 116 N 0.25 1.18 -2.00 3.82 1.01 -1.26 -4.41 120.40 118.99 1yc8 s VAL 116 Ca -0.15 -1.35 0.07 0.00 0.00 0.00 0.00 61.98 60.55 1yc8 s VAL 116 Cb -0.17 -1.74 0.20 0.00 0.00 0.00 0.00 36.38 34.67 1yc8 s VAL 116 CO 0.07 -0.44 0.87 -1.54 0.00 0.00 0.00 175.10 174.06