#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d5b s LYS 13 N 0.00 3.88 -0.45 -0.52 -0.14 -1.26 -4.20 119.74 117.05 3d5b s LYS 13 Ca 0.00 -0.06 0.00 0.00 -1.36 0.00 0.00 55.97 54.55 3d5b s LYS 13 Cb 0.00 -3.31 0.00 0.00 -1.68 0.00 0.00 37.83 32.84 3d5b s LYS 13 CO 0.00 0.52 0.00 0.41 -0.76 0.00 0.00 175.35 175.52 3d5b n GLY 14 N 2.72 0.55 3.95 -3.33 0.00 -1.26 -4.99 105.19 102.83 3d5b n GLY 14 Ca -0.17 -0.11 -0.24 0.00 0.00 0.00 0.00 46.02 45.51 3d5b n GLY 14 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3d5b s VAL 15 N -1.69 2.45 -0.41 1.61 -7.23 -1.26 -4.74 120.40 109.14 3d5b s VAL 15 Ca 0.00 -0.44 0.10 0.00 -1.81 0.00 0.00 61.98 59.83 3d5b s VAL 15 Cb 0.00 -3.00 0.33 0.00 0.56 0.00 0.00 36.38 34.26 3d5b s VAL 15 CO 0.00 -0.00 0.72 -1.20 -0.31 0.00 0.00 175.10 174.31 3d5b n SER 16 N -2.67 1.26 -4.67 4.85 7.64 0.23 -4.98 113.62 115.29 3d5b n SER 16 Ca 0.08 -3.05 -0.43 0.00 1.01 0.00 0.00 58.87 56.48 3d5b n SER 16 Cb 0.60 -0.62 -0.02 0.00 -1.01 0.00 0.00 64.21 63.16 3d5b n SER 16 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 3d5b s VAL 17 N -2.46 4.10 -0.12 0.44 1.01 -1.26 -2.25 120.40 119.86 3d5b s VAL 17 Ca 0.40 1.38 0.01 0.00 0.00 0.00 0.00 61.98 63.78 3d5b s VAL 17 Cb 0.30 -3.89 0.02 0.00 0.00 0.00 0.00 36.38 32.81 3d5b s VAL 17 CO -0.09 -0.07 -0.15 -1.61 0.00 0.00 0.00 175.10 173.18 3d5b s GLU 18 N 3.07 2.24 0.03 2.72 2.02 0.45 -5.00 118.70 124.23 3d5b s GLU 18 Ca 0.59 -0.56 -0.21 0.00 0.02 0.00 0.00 54.97 54.81 3d5b s GLU 18 Cb -0.25 -1.94 -0.06 0.00 0.10 0.00 0.00 34.13 31.98 3d5b s GLU 18 CO 0.20 -0.10 0.61 0.08 0.02 0.00 0.00 175.26 176.07 3d5b s VAL 19 N 1.10 4.82 0.51 2.63 1.01 -1.26 -1.08 120.40 128.13 3d5b s VAL 19 Ca -0.04 1.28 0.02 0.00 0.00 0.00 0.00 61.98 63.25 3d5b s VAL 19 Cb -0.14 -3.94 -0.01 0.00 0.00 0.00 0.00 36.38 32.28 3d5b s VAL 19 CO -0.04 0.46 0.05 0.00 0.00 0.00 0.00 175.10 175.57 3d5b s ALA 20 N -0.49 4.09 0.00 5.51 0.00 -0.14 -4.96 121.76 125.76 3d5b s ALA 20 Ca 0.31 -0.61 0.00 0.00 0.00 0.00 0.00 51.96 51.66 3d5b s ALA 20 Cb -0.19 -0.06 0.00 0.00 0.00 0.00 0.00 23.12 22.87 3d5b s ALA 20 CO 0.19 -0.07 0.42 -2.30 0.00 0.00 0.00 175.76 173.99 3d5b n PRO 21 N -1.30 0.00 -1.13 0.00 -0.02 -1.26 -3.90 135.00 127.39 3d5b n PRO 21 Ca -0.16 0.26 -0.18 0.00 -2.02 0.00 0.00 63.50 61.40 3d5b n PRO 21 Cb 0.67 -0.92 0.17 0.00 -0.02 0.00 0.00 33.50 33.39 3d5b n PRO 21 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3d5b n GLY 22 N -0.68 4.96 3.59 -1.23 0.00 -1.26 -4.97 105.19 105.60 3d5b n GLY 22 Ca 0.00 -1.40 -0.07 0.00 0.00 0.00 0.00 46.02 44.55 3d5b n GLY 22 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3d5b s ARG 23 N -3.37 1.02 -0.07 1.61 3.03 -1.25 -2.24 118.95 117.67 3d5b s ARG 23 Ca 0.53 -0.46 0.01 0.00 2.03 0.00 0.00 55.73 57.84 3d5b s ARG 23 Cb 0.45 0.41 0.02 0.00 -1.03 0.00 0.00 34.95 34.81 3d5b s ARG 23 CO 0.04 -0.45 -0.06 0.08 -1.13 0.00 0.00 175.30 173.78 3d5b s VAL 24 N -3.26 0.74 -0.35 4.99 1.01 -1.15 -0.97 120.40 121.42 3d5b s VAL 24 Ca 0.07 -0.20 -0.14 0.00 0.00 0.00 0.00 61.98 61.71 3d5b s VAL 24 Cb -0.01 -0.76 -0.01 0.00 0.00 0.00 0.00 36.38 35.59 3d5b s VAL 24 CO -0.05 0.29 0.32 -0.54 0.00 0.00 0.00 175.10 175.12 3d5b s LYS 25 N 1.20 3.50 -0.15 2.72 1.02 -0.24 -2.87 119.74 124.92 3d5b s LYS 25 Ca -0.06 -0.52 -0.04 0.00 0.02 0.00 0.00 55.97 55.37 3d5b s LYS 25 Cb -0.14 -3.82 -0.03 0.00 -0.52 0.00 0.00 37.83 33.32 3d5b s LYS 25 CO -0.02 -0.52 -0.02 0.08 -0.92 0.00 0.00 175.35 173.95 3d5b s VAL 26 N 1.92 4.03 0.13 3.17 1.01 -1.05 -0.41 120.40 129.19 3d5b s VAL 26 Ca 0.10 -0.31 0.11 0.00 0.00 0.00 0.00 61.98 61.87 3d5b s VAL 26 Cb -0.17 -2.76 -0.04 0.00 0.00 0.00 0.00 36.38 33.41 3d5b s VAL 26 CO 0.11 0.50 -0.26 -0.54 0.00 0.00 0.00 175.10 174.92 3d5b s LYS 27 N 0.20 1.45 0.02 2.72 1.02 -0.96 -1.46 119.74 122.74 3d5b s LYS 27 Ca -0.01 -1.34 -0.01 0.00 0.02 0.00 0.00 55.97 54.62 3d5b s LYS 27 Cb -0.14 -1.92 0.01 0.00 -0.52 0.00 0.00 37.83 35.26 3d5b s LYS 27 CO 0.02 0.45 0.07 0.41 -0.92 0.00 0.00 175.35 175.39 3d5b n GLY 28 N 0.86 1.58 0.38 -3.33 0.00 0.24 -0.60 105.19 104.33 3d5b n GLY 28 Ca -0.17 -0.98 0.18 0.00 0.00 0.00 0.00 46.02 45.04 3d5b n GLY 28 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3d5b h PRO 29 N 0.00 0.52 0.00 1.61 0.11 -1.81 0.61 132.00 133.03 3d5b h PRO 29 Ca -0.02 -0.03 -0.11 0.00 0.11 0.00 0.00 66.00 65.95 3d5b h PRO 29 Cb 0.09 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 31.07 3d5b h PRO 29 CO 0.03 0.34 -0.61 0.87 -0.21 0.00 0.00 178.00 178.42 3d5b h LYS 30 N 0.53 0.00 0.00 1.05 1.79 -1.84 -3.50 116.57 114.60 3d5b h LYS 30 Ca 0.55 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 59.02 3d5b h LYS 30 Cb 1.19 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.84 3d5b h LYS 30 CO -0.30 0.46 0.00 0.41 -1.08 0.00 0.00 179.45 178.94 3d5b n GLY 31 N 1.24 0.88 3.73 3.86 0.00 0.20 -5.06 105.19 110.05 3d5b n GLY 31 Ca 0.01 -1.96 -0.29 0.00 0.00 0.00 0.00 46.02 43.77 3d5b n GLY 31 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3d5b s GLU 32 N -1.56 2.71 -0.13 1.61 2.12 -1.26 -0.59 118.70 121.59 3d5b s GLU 32 Ca 0.00 -0.83 -0.10 0.00 0.36 0.00 0.00 54.97 54.40 3d5b s GLU 32 Cb 0.00 -2.60 0.04 0.00 0.26 0.00 0.00 34.13 31.83 3d5b s GLU 32 CO 0.00 0.53 0.34 -0.51 -0.54 0.00 0.00 175.26 175.08 3d5b s LEU 33 N -2.56 0.50 0.08 2.70 1.43 -0.54 -5.00 118.68 115.29 3d5b s LEU 33 Ca 0.28 0.71 -0.20 0.00 -1.03 0.00 0.00 54.13 53.89 3d5b s LEU 33 Cb -0.11 1.15 -0.07 0.00 0.03 0.00 0.00 46.19 47.19 3d5b s LEU 33 CO 0.21 -0.14 0.60 -1.61 0.23 0.00 0.00 176.35 175.63 3d5b s GLU 34 N 0.57 4.26 -0.28 1.70 0.41 -1.26 -2.54 118.70 121.55 3d5b s GLU 34 Ca -0.03 0.80 -0.02 0.00 -0.41 0.00 0.00 54.97 55.30 3d5b s GLU 34 Cb -0.05 -3.25 0.09 0.00 -1.78 0.00 0.00 34.13 29.15 3d5b s GLU 34 CO -0.03 0.62 0.10 0.08 -0.49 0.00 0.00 175.26 175.53 3d5b s VAL 35 N -1.06 0.44 -0.54 2.63 1.01 -1.14 -5.04 120.40 116.69 3d5b s VAL 35 Ca 0.30 -0.99 -0.33 0.00 0.00 0.00 0.00 61.98 60.96 3d5b s VAL 35 Cb -0.20 -1.28 -0.13 0.00 0.00 0.00 0.00 36.38 34.77 3d5b s VAL 35 CO 0.20 -0.62 2.36 -0.81 0.00 0.00 0.00 175.10 176.23 3d5b n PRO 36 N 5.04 0.76 -3.38 2.72 -0.04 -1.26 -2.94 135.00 135.90 3d5b n PRO 36 Ca -0.05 0.14 -0.38 0.00 -0.04 0.00 0.00 63.50 63.17 3d5b n PRO 36 Cb 0.43 -2.42 -0.06 0.00 -0.04 0.00 0.00 33.50 31.41 3d5b n PRO 36 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 3d5b s VAL 37 N 8.79 4.94 0.80 0.52 1.01 -0.95 -4.97 120.40 130.54 3d5b s VAL 37 Ca 1.14 1.01 -0.15 0.00 0.00 0.00 0.00 61.98 63.98 3d5b s VAL 37 Cb -0.83 -3.80 -0.00 0.00 0.00 0.00 0.00 36.38 31.75 3d5b s VAL 37 CO 0.45 0.53 0.61 -1.20 0.00 0.00 0.00 175.10 175.48 3d5b n SER 38 N 2.07 -1.06 0.12 3.32 7.64 -1.26 -4.26 113.62 120.19 3d5b n SER 38 Ca -0.11 0.52 -0.05 0.00 1.01 0.00 0.00 58.87 60.24 3d5b n SER 38 Cb 0.52 -1.26 -0.02 0.00 -1.01 0.00 0.00 64.21 62.43 3d5b n SER 38 CO 0.00 0.00 0.00 -0.65 -3.01 0.00 0.00 175.04 171.38 3d5b h PRO 39 N -0.75 -0.32 -1.85 1.43 0.11 -1.95 -3.34 132.00 125.32 3d5b h PRO 39 Ca -0.45 0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.68 3d5b h PRO 39 Cb 1.32 0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.51 3d5b h PRO 39 CO 0.41 -0.22 0.00 -0.85 -0.21 0.00 0.00 178.00 177.13 3d5b n GLU 40 N -3.38 0.96 -4.96 1.05 0.28 -1.26 -4.81 120.64 108.52 3d5b n GLU 40 Ca -0.04 0.00 -0.28 0.00 -0.16 0.00 0.00 57.16 56.68 3d5b n GLU 40 Cb 0.13 -1.02 -0.15 0.00 1.43 0.00 0.00 31.44 31.83 3d5b n GLU 40 CO 0.00 0.00 0.00 -1.64 -0.16 0.00 0.00 177.13 175.33 3d5b s MET 41 N 0.08 1.69 -0.54 3.44 -1.94 -1.26 -4.24 119.30 116.53 3d5b s MET 41 Ca 0.00 -0.87 -0.18 0.00 -1.71 0.00 0.00 55.69 52.93 3d5b s MET 41 Cb 0.00 -1.70 0.09 0.00 2.01 0.00 0.00 34.83 35.23 3d5b s MET 41 CO 0.00 0.46 0.59 1.03 -0.01 0.00 0.00 175.02 177.09 3d5b s ARG 42 N -0.77 3.04 -1.28 2.03 1.81 -1.10 -4.99 118.95 117.69 3d5b s ARG 42 Ca 0.09 -1.28 -0.16 0.00 -1.72 0.00 0.00 55.73 52.66 3d5b s ARG 42 Cb -0.09 -4.20 0.11 0.00 -0.45 0.00 0.00 34.95 30.32 3d5b s ARG 42 CO 0.00 -1.32 1.69 1.33 -0.68 0.00 0.00 175.30 176.31 3d5b n VAL 43 N 5.45 4.04 -1.67 3.52 0.24 -1.26 -2.22 118.33 126.43 3d5b n VAL 43 Ca -0.10 -4.25 -0.34 0.00 -2.04 0.00 0.00 64.34 57.62 3d5b n VAL 43 Cb 0.43 -2.41 0.06 0.00 -1.47 0.00 0.00 33.84 30.45 3d5b n VAL 43 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 3d5b s VAL 44 N 3.01 2.87 -0.41 3.34 1.01 0.18 -4.88 120.40 125.53 3d5b s VAL 44 Ca 0.49 0.42 0.11 0.00 0.00 0.00 0.00 61.98 63.00 3d5b s VAL 44 Cb 0.03 -2.97 0.41 0.00 0.00 0.00 0.00 36.38 33.85 3d5b s VAL 44 CO 0.04 -0.23 0.95 0.52 0.00 0.00 0.00 175.10 176.38 3d5b n VAL 45 N -2.45 1.54 -1.94 2.92 0.31 -1.26 -0.90 118.33 116.56 3d5b n VAL 45 Ca 0.12 -4.36 -0.41 0.00 -0.01 0.00 0.00 64.34 59.67 3d5b n VAL 45 Cb 0.51 -0.45 -0.02 0.00 -0.91 0.00 0.00 33.84 32.97 3d5b n VAL 45 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 3d5b s GLU 46 N -3.17 4.22 3.17 5.55 0.41 -1.19 -4.75 118.70 122.94 3d5b s GLU 46 Ca 0.40 2.39 0.00 0.00 -0.41 0.00 0.00 54.97 57.35 3d5b s GLU 46 Cb 0.39 -3.06 0.00 0.00 -1.78 0.00 0.00 34.13 29.68 3d5b s GLU 46 CO -0.08 -0.45 0.00 0.39 -0.49 0.00 0.00 175.26 174.63 3d5b n GLU 47 N 1.73 0.00 -0.36 1.61 1.02 -1.26 -1.33 120.64 122.04 3d5b n GLU 47 Ca 0.05 0.00 0.08 0.00 -0.02 0.00 0.00 57.16 57.27 3d5b n GLU 47 Cb 0.40 0.00 0.25 0.00 -0.02 0.00 0.00 31.44 32.07 3d5b n GLU 47 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3d5b n GLY 48 N 0.00 1.77 1.96 0.62 0.00 -1.26 -4.92 105.19 103.35 3d5b n GLY 48 Ca 0.00 -0.60 -0.17 0.00 0.00 0.00 0.00 46.02 45.25 3d5b n GLY 48 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3d5b n VAL 49 N 0.92 0.00 -4.52 1.61 0.24 -0.45 -4.77 118.33 111.37 3d5b n VAL 49 Ca 0.18 -1.25 -0.21 0.00 -2.04 0.00 0.00 64.34 61.02 3d5b n VAL 49 Cb 0.57 0.14 -0.15 0.00 -1.47 0.00 0.00 33.84 32.92 3d5b n VAL 49 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 3d5b s VAL 50 N -1.85 0.96 0.28 3.34 1.01 -1.26 -3.16 120.40 119.71 3d5b s VAL 50 Ca 0.04 -0.49 0.09 0.00 0.00 0.00 0.00 61.98 61.62 3d5b s VAL 50 Cb -0.00 -0.82 -0.06 0.00 0.00 0.00 0.00 36.38 35.50 3d5b s VAL 50 CO 0.02 0.28 -0.11 -0.13 0.00 0.00 0.00 175.10 175.16 3d5b s ARG 51 N -0.06 1.59 -0.14 2.72 0.52 -0.07 -4.92 118.95 118.60 3d5b s ARG 51 Ca 0.01 -1.78 -0.10 0.00 -0.52 0.00 0.00 55.73 53.34 3d5b s ARG 51 Cb -0.07 -1.39 0.04 0.00 0.52 0.00 0.00 34.95 34.05 3d5b s ARG 51 CO 0.00 0.15 0.35 0.08 0.02 0.00 0.00 175.30 175.89 3d5b s VAL 52 N -2.82 -0.02 0.34 3.52 1.01 -1.26 0.48 120.40 121.66 3d5b s VAL 52 Ca 0.29 0.06 0.04 0.00 0.00 0.00 0.00 61.98 62.37 3d5b s VAL 52 Cb 0.01 -0.50 -0.07 0.00 0.00 0.00 0.00 36.38 35.82 3d5b s VAL 52 CO 0.13 0.02 0.05 -1.61 0.00 0.00 0.00 175.10 173.69 3d5b s GLU 53 N 0.80 1.70 0.09 2.72 2.02 -0.94 -4.99 118.70 120.11 3d5b s GLU 53 Ca -0.05 -1.95 0.10 0.00 0.02 0.00 0.00 54.97 53.09 3d5b s GLU 53 Cb -0.06 -1.00 -0.03 0.00 0.10 0.00 0.00 34.13 33.14 3d5b s GLU 53 CO -0.06 -0.16 -0.26 -0.98 0.02 0.00 0.00 175.26 173.82 3d5b s ARG 54 N -3.86 1.56 0.00 1.61 1.70 -1.26 -2.72 118.95 115.98 3d5b s ARG 54 Ca 0.36 -1.22 0.11 0.00 -0.47 0.00 0.00 55.73 54.51 3d5b s ARG 54 Cb 0.09 -1.90 0.50 0.00 -0.57 0.00 0.00 34.95 33.08 3d5b s ARG 54 CO 0.16 0.47 1.35 -0.35 -1.08 0.00 0.00 175.30 175.85 3d5b n PRO 55 N 1.33 0.03 -0.24 3.89 -0.04 -1.26 -4.87 135.00 133.84 3d5b n PRO 55 Ca -0.18 0.28 0.00 0.00 -0.04 0.00 0.00 63.50 63.57 3d5b n PRO 55 Cb 0.53 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.49 3d5b n PRO 55 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 3d5b n SER 56 N -1.46 0.00 -2.62 3.54 3.41 -1.26 -5.07 113.62 110.15 3d5b n SER 56 Ca 0.03 -0.23 -0.12 0.00 -0.26 0.00 0.00 58.87 58.29 3d5b n SER 56 Cb 0.13 0.00 0.02 0.00 -0.26 0.00 0.00 64.21 64.10 3d5b n SER 56 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 3d5b n ASP 57 N -0.22 2.08 -3.52 4.04 -0.08 -1.26 -4.90 116.55 112.68 3d5b n ASP 57 Ca 0.00 -2.91 -0.11 0.00 -1.51 0.00 0.00 54.79 50.26 3d5b n ASP 57 Cb 0.00 -0.52 0.05 0.00 2.34 0.00 0.00 41.12 42.99 3d5b n ASP 57 CO 0.00 0.00 0.00 -0.62 0.12 0.00 0.00 177.20 176.70 3d5b n GLU 58 N -0.14 0.59 0.04 -0.67 1.02 -1.26 -4.97 120.64 115.24 3d5b n GLU 58 Ca 0.15 -1.62 -0.10 0.00 -0.02 0.00 0.00 57.16 55.57 3d5b n GLU 58 Cb 0.79 -0.21 -0.07 0.00 -0.02 0.00 0.00 31.44 31.93 3d5b n GLU 58 CO 0.00 0.00 0.00 -0.09 1.18 0.00 0.00 177.13 178.22 3d5b h ARG 59 N 0.00 -0.18 0.00 3.49 9.65 -2.00 -2.70 114.38 122.64 3d5b h ARG 59 Ca -0.16 0.01 -0.01 0.00 -1.10 0.00 0.00 59.98 58.72 3d5b h ARG 59 Cb 0.67 0.04 -0.00 0.00 -1.39 0.00 0.00 29.97 29.29 3d5b h ARG 59 CO 0.20 0.24 -0.06 0.00 2.80 0.00 0.00 179.97 183.16 3d5b h ARG 60 N -0.91 0.00 0.07 0.20 3.08 -2.00 -2.68 114.38 112.14 3d5b h ARG 60 Ca -0.02 0.00 -0.26 0.00 0.07 0.00 0.00 59.98 59.77 3d5b h ARG 60 Cb 0.51 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.54 3d5b h ARG 60 CO 0.03 0.06 -1.26 0.45 -1.07 0.00 0.00 179.97 178.18 3d5b h HIS 61 N 0.00 0.26 0.17 3.04 3.86 -1.96 -1.56 115.15 118.95 3d5b h HIS 61 Ca -0.00 -0.19 -0.01 0.00 -1.16 0.00 0.00 60.37 59.02 3d5b h HIS 61 Cb 0.17 -0.01 -0.00 0.00 1.06 0.00 0.00 27.41 28.63 3d5b h HIS 61 CO 0.00 1.17 -0.09 0.87 0.86 0.00 0.00 177.93 180.74 3d5b h LYS 62 N 0.04 -0.23 -0.19 2.45 1.57 -1.14 -0.68 116.57 118.38 3d5b h LYS 62 Ca -0.13 0.02 0.03 0.00 -1.87 0.00 0.00 60.65 58.70 3d5b h LYS 62 Cb 1.91 0.05 -0.03 0.00 0.08 0.00 0.00 32.23 34.24 3d5b h LYS 62 CO 0.16 -0.16 0.00 0.77 -0.57 0.00 0.00 179.45 179.65 3d5b h SER 63 N -0.24 -0.07 -0.82 0.86 0.02 -1.53 -2.02 113.55 109.74 3d5b h SER 63 Ca -0.02 0.04 0.03 0.00 -0.84 0.00 0.00 61.79 61.01 3d5b h SER 63 Cb 0.19 0.07 -0.05 0.00 0.14 0.00 0.00 62.40 62.76 3d5b h SER 63 CO 0.03 -0.01 0.53 -0.07 -1.14 0.00 0.00 176.83 176.17 3d5b h LEU 64 N 0.07 0.87 0.58 5.07 3.38 -1.17 0.40 115.31 124.50 3d5b h LEU 64 Ca 0.09 -0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.03 3d5b h LEU 64 Cb 0.11 -0.19 0.01 0.00 0.09 0.00 0.00 40.66 40.67 3d5b h LEU 64 CO -0.15 0.60 -0.28 -0.74 0.09 0.00 0.00 178.44 177.96 3d5b h HIS 65 N 1.02 -0.72 -0.96 1.13 2.76 -0.76 -1.26 115.15 116.36 3d5b h HIS 65 Ca 0.33 -0.02 0.23 0.00 -2.20 0.00 0.00 60.37 58.71 3d5b h HIS 65 Cb 0.02 0.24 -0.07 0.00 1.55 0.00 0.00 27.41 29.14 3d5b h HIS 65 CO -0.03 -0.45 0.63 0.78 -1.30 0.00 0.00 177.93 177.57 3d5b h GLY 66 N -0.80 0.96 0.87 5.26 0.00 -1.30 0.63 103.07 108.69 3d5b h GLY 66 Ca -0.08 -0.19 -0.04 0.00 0.00 0.00 0.00 47.33 47.02 3d5b h GLY 66 CO 0.13 -0.04 -0.42 -2.00 0.00 0.00 0.00 176.54 174.21 3d5b h LEU 67 N 0.40 -0.99 -1.20 3.11 5.85 -0.71 -2.57 115.31 119.19 3d5b h LEU 67 Ca 0.51 0.03 0.01 0.00 0.84 0.00 0.00 57.88 59.28 3d5b h LEU 67 Cb 1.31 0.26 -0.04 0.00 0.37 0.00 0.00 40.66 42.56 3d5b h LEU 67 CO -0.21 -0.71 0.54 0.71 -0.34 0.00 0.00 178.44 178.43 3d5b h THR 68 N -1.17 1.20 -0.57 1.05 1.35 -0.32 -0.32 112.91 114.12 3d5b h THR 68 Ca -0.12 -0.37 0.08 0.00 -0.55 0.00 0.00 66.41 65.45 3d5b h THR 68 Cb 0.90 0.01 -0.10 0.00 -1.73 0.00 0.00 68.15 67.22 3d5b h THR 68 CO 0.20 0.20 -0.45 -0.09 -0.25 0.00 0.00 175.52 175.13 3d5b h ARG 69 N 1.09 -0.23 0.06 4.72 2.43 0.43 0.36 114.38 123.25 3d5b h ARG 69 Ca 0.30 0.02 -0.25 0.00 -0.81 0.00 0.00 59.98 59.24 3d5b h ARG 69 Cb -0.10 0.05 0.02 0.00 -0.42 0.00 0.00 29.97 29.52 3d5b h ARG 69 CO -0.07 -0.15 -1.01 1.15 -1.51 0.00 0.00 179.97 178.38 3d5b h THR 70 N -0.24 1.33 -0.64 0.20 2.02 -1.29 -3.08 112.91 111.22 3d5b h THR 70 Ca 0.17 -2.32 0.17 0.00 0.77 0.00 0.00 66.41 65.21 3d5b h THR 70 Cb 0.56 2.63 -0.03 0.00 -1.74 0.00 0.00 68.15 69.57 3d5b h THR 70 CO -0.68 0.70 0.45 0.25 0.37 0.00 0.00 175.52 176.61 3d5b h LEU 71 N 0.17 0.07 0.14 2.58 5.85 -0.33 0.16 115.31 123.95 3d5b h LEU 71 Ca -0.14 0.00 -0.30 0.00 0.84 0.00 0.00 57.88 58.29 3d5b h LEU 71 Cb 1.70 -0.01 0.03 0.00 0.37 0.00 0.00 40.66 42.75 3d5b h LEU 71 CO 0.20 0.04 -1.24 0.40 -0.34 0.00 0.00 178.44 177.49 3d5b h ILE 72 N 0.08 1.30 0.00 4.05 1.08 -0.35 -3.17 117.51 120.50 3d5b h ILE 72 Ca 0.31 -2.49 -0.03 0.00 -0.39 0.00 0.00 64.86 62.26 3d5b h ILE 72 Cb 1.12 2.78 -0.00 0.00 -3.07 0.00 0.00 36.82 37.64 3d5b h ILE 72 CO -0.03 0.75 -0.13 0.00 -0.69 0.00 0.00 178.15 178.06 3d5b h ALA 73 N 0.25 1.33 -0.12 1.87 0.00 -0.72 -2.81 119.26 119.06 3d5b h ALA 73 Ca -0.20 -0.12 -0.08 0.00 0.00 0.00 0.00 54.91 54.52 3d5b h ALA 73 Cb 1.93 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.70 3d5b h ALA 73 CO 0.24 0.16 -0.24 -0.91 0.00 0.00 0.00 179.25 178.50 3d5b h ASN 74 N 0.00 0.42 -0.82 0.00 2.35 -0.87 -1.80 115.58 114.87 3d5b h ASN 74 Ca -0.00 -0.56 0.09 0.00 -0.55 0.00 0.00 56.30 55.28 3d5b h ASN 74 Cb 0.33 -0.12 -0.06 0.00 0.05 0.00 0.00 38.32 38.52 3d5b h ASN 74 CO 0.02 0.90 0.53 0.00 -1.65 0.00 0.00 177.43 177.23 3d5b h ALA 75 N 0.53 1.71 0.42 -0.83 0.00 -1.47 0.19 119.26 119.81 3d5b h ALA 75 Ca 0.00 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 3d5b h ALA 75 Cb 0.83 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.44 3d5b h ALA 75 CO 0.05 0.13 -0.20 0.28 0.00 0.00 0.00 179.25 179.51 3d5b h VAL 76 N 0.79 0.00 -0.92 0.00 2.07 -1.43 -3.08 116.25 113.68 3d5b h VAL 76 Ca 0.37 -0.21 0.24 0.00 0.82 0.00 0.00 66.70 67.92 3d5b h VAL 76 Cb 0.40 0.00 -0.06 0.00 -1.52 0.00 0.00 31.29 30.11 3d5b h VAL 76 CO -0.14 0.00 0.63 0.11 0.02 0.00 0.00 177.57 178.19 3d5b h LYS 77 N -0.78 0.21 -0.53 1.57 1.79 -1.13 -1.24 116.57 116.46 3d5b h LYS 77 Ca -0.06 -0.01 0.01 0.00 -2.18 0.00 0.00 60.65 58.41 3d5b h LYS 77 Cb 0.44 -0.05 -0.03 0.00 -1.58 0.00 0.00 32.23 31.01 3d5b h LYS 77 CO 0.10 0.14 0.35 0.78 -1.08 0.00 0.00 179.45 179.73 3d5b h GLY 78 N 0.22 0.75 -2.08 3.86 0.00 -0.61 -1.75 103.07 103.45 3d5b h GLY 78 Ca 0.47 -0.27 0.00 0.00 0.00 0.00 0.00 47.33 47.52 3d5b h GLY 78 CO -0.11 0.26 0.00 3.33 0.00 0.00 0.00 176.54 180.02 3d5b n VAL 79 N -4.72 0.73 0.00 4.60 0.24 -0.64 -3.70 118.33 114.84 3d5b n VAL 79 Ca 0.03 -0.75 0.00 0.00 -2.04 0.00 0.00 64.34 61.58 3d5b n VAL 79 Cb 0.03 0.43 0.00 0.00 -1.47 0.00 0.00 33.84 32.83 3d5b n VAL 79 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 3d5b n SER 80 N 1.18 0.00 -0.00 -1.34 7.64 -0.57 -2.81 113.62 117.72 3d5b n SER 80 Ca 0.19 0.00 0.09 0.00 1.01 0.00 0.00 58.87 60.16 3d5b n SER 80 Cb 0.49 0.00 -0.11 0.00 -1.01 0.00 0.00 64.21 63.58 3d5b n SER 80 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 3d5b n GLU 81 N -0.96 0.88 0.00 1.43 1.02 -0.99 -4.77 120.64 117.26 3d5b n GLU 81 Ca 0.00 -0.03 0.00 0.00 -0.02 0.00 0.00 57.16 57.11 3d5b n GLU 81 Cb 0.00 -1.38 0.00 0.00 -0.02 0.00 0.00 31.44 30.04 3d5b n GLU 81 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3d5b n GLY 82 N 1.43 -0.86 3.21 0.62 0.00 -1.02 -4.98 105.19 103.60 3d5b n GLY 82 Ca 0.02 -1.69 -0.28 0.00 0.00 0.00 0.00 46.02 44.08 3d5b n GLY 82 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3d5b s TYR 83 N -1.31 1.98 -0.19 1.61 4.12 -1.20 -4.84 117.35 117.53 3d5b s TYR 83 Ca 0.00 -0.50 -0.07 0.00 0.02 0.00 0.00 57.07 56.52 3d5b s TYR 83 Cb 0.00 -1.30 0.08 0.00 -1.52 0.00 0.00 41.96 39.22 3d5b s TYR 83 CO 0.00 -0.12 0.41 -1.54 0.02 0.00 0.00 175.55 174.32 3d5b s SER 84 N -0.24 -0.30 0.17 2.29 1.04 -1.25 -1.35 113.70 114.06 3d5b s SER 84 Ca 0.01 0.95 0.09 0.00 0.48 0.00 0.00 55.95 57.48 3d5b s SER 84 Cb -0.11 1.16 -0.04 0.00 0.10 0.00 0.00 66.02 67.14 3d5b s SER 84 CO 0.01 -0.22 -0.11 -0.54 0.98 0.00 0.00 173.24 173.36 3d5b s LYS 85 N 2.28 2.02 0.28 4.02 -0.14 -1.16 -4.84 119.74 122.20 3d5b s LYS 85 Ca -0.04 -1.24 0.07 0.00 -1.36 0.00 0.00 55.97 53.40 3d5b s LYS 85 Cb -0.11 -2.16 -0.03 0.00 -1.68 0.00 0.00 37.83 33.85 3d5b s LYS 85 CO -0.13 0.45 0.28 -1.83 -0.76 0.00 0.00 175.35 173.36 3d5b s GLU 86 N -2.69 3.00 -0.11 1.68 1.03 -1.26 0.97 118.70 121.31 3d5b s GLU 86 Ca 0.24 -1.05 -0.04 0.00 0.03 0.00 0.00 54.97 54.15 3d5b s GLU 86 Cb -0.09 -2.63 0.05 0.00 -0.80 0.00 0.00 34.13 30.66 3d5b s GLU 86 CO 0.14 0.30 0.15 -0.51 -1.33 0.00 0.00 175.26 174.02 3d5b s LEU 87 N -3.94 -0.01 0.36 1.83 1.43 0.23 -4.51 118.68 114.07 3d5b s LEU 87 Ca 0.36 0.10 0.00 0.00 -1.03 0.00 0.00 54.13 53.56 3d5b s LEU 87 Cb -0.08 0.18 -0.03 0.00 0.03 0.00 0.00 46.19 46.29 3d5b s LEU 87 CO 0.27 -0.27 0.56 -0.76 0.23 0.00 0.00 176.35 176.38 3d5b s LEU 88 N 2.27 3.99 -0.03 1.79 2.01 0.16 -0.94 118.68 127.92 3d5b s LEU 88 Ca 0.04 0.47 0.00 0.00 0.01 0.00 0.00 54.13 54.65 3d5b s LEU 88 Cb -0.13 -3.34 0.03 0.00 0.01 0.00 0.00 46.19 42.76 3d5b s LEU 88 CO -0.07 -0.32 0.01 -0.63 1.01 0.00 0.00 176.35 176.35 3d5b s ILE 89 N -2.35 0.16 0.15 -0.59 1.01 -1.21 -0.20 121.20 118.18 3d5b s ILE 89 Ca 0.40 0.11 0.09 0.00 0.00 0.00 0.00 60.65 61.26 3d5b s ILE 89 Cb -0.10 -0.27 -0.04 0.00 0.01 0.00 0.00 42.46 42.06 3d5b s ILE 89 CO 0.37 0.15 -0.16 -0.54 0.00 0.00 0.00 174.94 174.75 3d5b s LYS 90 N 1.15 1.83 0.00 2.79 -0.14 -1.06 -4.89 119.74 119.42 3d5b s LYS 90 Ca -0.08 -1.28 0.00 0.00 -1.36 0.00 0.00 55.97 53.25 3d5b s LYS 90 Cb -0.13 -2.08 0.00 0.00 -1.68 0.00 0.00 37.83 33.94 3d5b s LYS 90 CO -0.02 0.45 0.00 0.41 -0.76 0.00 0.00 175.35 175.43 3d5b n GLY 91 N 0.44 3.00 0.00 -3.33 0.00 -1.24 -3.22 105.19 100.84 3d5b n GLY 91 Ca -0.13 -1.87 0.00 0.00 0.00 0.00 0.00 46.02 44.02 3d5b n GLY 91 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3d5b n ILE 92 N -0.14 0.00 0.22 -0.61 -0.00 -1.26 -3.62 119.36 113.96 3d5b n ILE 92 Ca 0.00 0.51 0.18 0.00 -0.00 0.00 0.00 62.75 63.44 3d5b n ILE 92 Cb 0.00 -1.51 0.84 0.00 -0.00 0.00 0.00 39.64 38.97 3d5b n ILE 92 CO 0.00 0.00 0.00 1.23 -0.00 0.00 0.00 176.55 177.78 3d5b h GLY 93 N 0.00 0.00 -7.34 7.39 0.00 -1.95 -3.41 103.07 97.76 3d5b h GLY 93 Ca 0.00 0.00 -0.51 0.00 0.00 0.00 0.00 47.33 46.82 3d5b h GLY 93 CO 0.00 0.00 1.61 -1.72 0.00 0.00 0.00 176.54 176.43 3d5b n TYR 94 N -3.45 1.37 -3.41 5.60 4.02 -1.24 -4.70 117.16 115.35 3d5b n TYR 94 Ca 0.02 0.15 0.00 0.00 -0.01 0.00 0.00 57.90 58.06 3d5b n TYR 94 Cb 0.40 -2.59 0.00 0.00 -0.02 0.00 0.00 39.34 37.13 3d5b n TYR 94 CO 0.00 0.00 0.00 2.89 -1.01 0.00 0.00 176.86 178.74 3d5b n ARG 95 N 8.79 0.00 -3.66 -0.72 1.85 -0.93 -4.70 116.66 117.28 3d5b n ARG 95 Ca 0.42 0.00 -0.10 0.00 -1.00 0.00 0.00 57.85 57.17 3d5b n ARG 95 Cb 0.41 0.00 -0.08 0.00 -1.05 0.00 0.00 32.46 31.73 3d5b n ARG 95 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 3d5b s ALA 96 N -1.56 -1.57 -0.27 2.89 0.00 -0.93 -3.62 121.76 116.70 3d5b s ALA 96 Ca 0.00 2.00 0.03 0.00 0.00 0.00 0.00 51.96 53.99 3d5b s ALA 96 Cb 0.00 -1.18 0.06 0.00 0.00 0.00 0.00 23.12 22.00 3d5b s ALA 96 CO 0.00 -0.33 -0.10 1.03 0.00 0.00 0.00 175.76 176.37 3d5b s ARG 97 N 1.20 2.25 0.12 0.00 0.52 0.24 -4.54 118.95 118.74 3d5b s ARG 97 Ca -0.07 -1.35 -0.31 0.00 -0.52 0.00 0.00 55.73 53.48 3d5b s ARG 97 Cb -0.06 -2.93 -0.10 0.00 0.52 0.00 0.00 34.95 32.39 3d5b s ARG 97 CO -0.12 -0.58 1.66 -1.17 0.02 0.00 0.00 175.30 175.11 3d5b s LEU 98 N 1.11 4.37 -0.59 2.53 2.96 -1.26 -1.88 118.68 125.93 3d5b s LEU 98 Ca -0.08 2.61 0.03 0.00 -0.22 0.00 0.00 54.13 56.47 3d5b s LEU 98 Cb -0.20 -3.58 0.15 0.00 0.50 0.00 0.00 46.19 43.06 3d5b s LEU 98 CO -0.05 -0.89 0.35 -0.69 -1.32 0.00 0.00 176.35 173.75 3d5b s VAL 99 N 2.03 2.85 0.00 1.68 1.01 -0.56 -4.90 120.40 122.50 3d5b s VAL 99 Ca 0.74 -3.52 0.00 0.00 0.00 0.00 0.00 61.98 59.20 3d5b s VAL 99 Cb -0.43 -2.93 0.00 0.00 0.00 0.00 0.00 36.38 33.02 3d5b s VAL 99 CO 0.33 -0.87 0.00 0.61 0.00 0.00 0.00 175.10 175.17 3d5b n GLY 100 N 2.86 1.07 0.00 4.51 0.00 -1.26 -3.16 105.19 109.20 3d5b n GLY 100 Ca 0.09 0.47 0.00 0.00 0.00 0.00 0.00 46.02 46.58 3d5b n GLY 100 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3d5b n ARG 101 N 0.00 0.00 -1.02 1.61 3.00 -1.26 -4.92 116.66 114.07 3d5b n ARG 101 Ca 0.00 0.13 -0.33 0.00 -0.01 0.00 0.00 57.85 57.64 3d5b n ARG 101 Cb 0.00 -0.59 0.12 0.00 0.00 0.00 0.00 32.46 31.99 3d5b n ARG 101 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 3d5b n ALA 102 N -1.03 -0.77 -3.48 7.54 0.00 -1.19 -4.84 120.51 116.74 3d5b n ALA 102 Ca 0.00 -0.39 -0.29 0.00 0.00 0.00 0.00 53.44 52.76 3d5b n ALA 102 Cb 0.00 -2.11 -0.17 0.00 0.00 0.00 0.00 19.45 17.17 3d5b n ALA 102 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 177.50 177.02 3d5b s LEU 103 N -4.23 1.83 -0.25 0.00 2.34 -1.09 -1.50 118.68 115.78 3d5b s LEU 103 Ca 0.69 -0.44 -0.10 0.00 0.06 0.00 0.00 54.13 54.33 3d5b s LEU 103 Cb -0.28 -1.13 -0.05 0.00 -0.56 0.00 0.00 46.19 44.17 3d5b s LEU 103 CO 0.56 0.07 0.15 -0.70 -1.06 0.00 0.00 176.35 175.36 3d5b s GLU 104 N 0.70 3.98 -0.07 1.48 -6.30 -0.79 -1.92 118.70 115.78 3d5b s GLU 104 Ca -0.12 -0.32 -0.01 0.00 -2.50 0.00 0.00 54.97 52.02 3d5b s GLU 104 Cb -0.16 -3.52 0.03 0.00 0.00 0.00 0.00 34.13 30.48 3d5b s GLU 104 CO 0.03 -0.02 -0.00 -0.48 0.02 0.00 0.00 175.26 174.81 3d5b s LEU 105 N 1.26 0.61 -0.24 2.70 -0.00 -0.54 -0.60 118.68 121.87 3d5b s LEU 105 Ca 0.07 -0.09 -0.24 0.00 -0.00 0.00 0.00 54.13 53.86 3d5b s LEU 105 Cb -0.14 -0.45 -0.01 0.00 -0.00 0.00 0.00 46.19 45.59 3d5b s LEU 105 CO 0.06 -0.19 0.82 0.42 -0.00 0.00 0.00 176.35 177.46 3d5b s THR 106 N 1.96 4.84 -0.20 5.48 -4.23 -1.24 -3.05 115.64 119.21 3d5b s THR 106 Ca 0.05 1.55 0.20 0.00 -1.18 0.00 0.00 61.69 62.30 3d5b s THR 106 Cb -0.12 -4.11 0.47 0.00 1.34 0.00 0.00 72.50 70.08 3d5b s THR 106 CO -0.05 -0.08 1.15 1.33 -0.54 0.00 0.00 174.62 176.43 3d5b n VAL 107 N 5.26 1.29 0.00 2.29 0.24 -1.26 -2.20 118.33 123.95 3d5b n VAL 107 Ca 0.05 -2.73 0.00 0.00 -2.04 0.00 0.00 64.34 59.62 3d5b n VAL 107 Cb 0.48 0.62 0.00 0.00 -1.47 0.00 0.00 33.84 33.46 3d5b n VAL 107 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3d5b n GLY 108 N -0.40 1.94 3.10 7.63 0.00 -1.26 -4.87 105.19 111.32 3d5b n GLY 108 Ca 0.15 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.98 3d5b n GLY 108 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3d5b s PHE 109 N -2.00 1.07 0.50 1.61 0.40 -1.26 -5.02 117.98 113.28 3d5b s PHE 109 Ca 0.00 -0.29 0.41 0.00 -0.60 0.00 0.00 56.93 56.45 3d5b s PHE 109 Cb 0.00 -0.66 2.19 0.00 0.51 0.00 0.00 43.02 45.06 3d5b s PHE 109 CO 0.00 0.00 2.24 0.66 0.70 0.00 0.00 175.22 178.82 3d5b h SER 110 N 5.31 0.00 -3.30 1.36 4.64 -2.03 -3.39 113.55 116.14 3d5b h SER 110 Ca -0.35 0.00 -0.66 0.00 -0.47 0.00 0.00 61.79 60.31 3d5b h SER 110 Cb 1.18 0.00 -0.29 0.00 -0.31 0.00 0.00 62.40 62.98 3d5b h SER 110 CO 0.46 0.00 -0.77 -2.28 -0.87 0.00 0.00 176.83 173.37 3d5b s HIS 111 N -4.03 2.86 0.19 4.77 5.65 -1.26 -5.09 115.29 118.37 3d5b s HIS 111 Ca -0.04 -1.00 -0.33 0.00 0.25 0.00 0.00 55.06 53.94 3d5b s HIS 111 Cb 0.12 -1.97 -0.13 0.00 -1.18 0.00 0.00 32.58 29.42 3d5b s HIS 111 CO 0.38 -0.49 1.68 -0.35 -0.65 0.00 0.00 174.74 175.30 3d5b n PRO 112 N 4.30 2.54 -2.70 2.88 -0.04 -1.26 -4.92 135.00 135.80 3d5b n PRO 112 Ca -0.19 0.92 -0.43 0.00 -0.04 0.00 0.00 63.50 63.76 3d5b n PRO 112 Cb 0.51 -2.74 -0.02 0.00 -0.04 0.00 0.00 33.50 31.21 3d5b n PRO 112 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 3d5b s VAL 113 N 1.16 4.64 -0.30 0.52 1.01 -1.17 -4.91 120.40 121.35 3d5b s VAL 113 Ca 0.77 1.82 -0.12 0.00 0.00 0.00 0.00 61.98 64.45 3d5b s VAL 113 Cb -0.57 -4.32 -0.03 0.00 0.00 0.00 0.00 36.38 31.46 3d5b s VAL 113 CO 0.35 -0.29 0.20 -0.69 0.00 0.00 0.00 175.10 174.68 3d5b s VAL 114 N 3.31 5.23 -0.39 2.92 1.01 -1.26 -1.46 120.40 129.76 3d5b s VAL 114 Ca 0.43 -0.03 -0.09 0.00 0.00 0.00 0.00 61.98 62.29 3d5b s VAL 114 Cb -0.14 -3.58 0.06 0.00 0.00 0.00 0.00 36.38 32.72 3d5b s VAL 114 CO 0.10 0.14 0.20 -0.69 0.00 0.00 0.00 175.10 174.85 3d5b s VAL 115 N 1.73 4.17 0.48 2.92 1.01 -0.81 -4.99 120.40 124.90 3d5b s VAL 115 Ca 0.06 -1.21 -0.24 0.00 0.00 0.00 0.00 61.98 60.59 3d5b s VAL 115 Cb -0.17 -3.45 -0.08 0.00 0.00 0.00 0.00 36.38 32.69 3d5b s VAL 115 CO 0.10 -0.36 1.31 1.21 0.00 0.00 0.00 175.10 177.37 3d5b n GLU 116 N 4.90 1.87 -3.24 2.72 2.13 -1.26 -2.68 120.64 125.08 3d5b n GLU 116 Ca -0.11 0.67 -0.46 0.00 0.66 0.00 0.00 57.16 57.93 3d5b n GLU 116 Cb 0.44 -2.48 -0.04 0.00 0.27 0.00 0.00 31.44 29.63 3d5b n GLU 116 CO 0.00 0.00 0.00 -1.25 -0.41 0.00 0.00 177.13 175.47 3d5b s PRO 117 N -2.49 3.11 0.97 5.31 0.04 -1.26 -4.93 135.00 135.75 3d5b s PRO 117 Ca 0.65 -1.70 -0.11 0.00 0.04 0.00 0.00 61.00 59.88 3d5b s PRO 117 Cb -0.46 -4.33 0.15 0.00 0.04 0.00 0.00 34.50 29.90 3d5b s PRO 117 CO 0.55 -1.40 0.96 -0.35 0.04 0.00 0.00 177.00 176.79 3d5b n PRO 118 N 5.44 -0.75 -2.53 0.56 -0.04 -1.26 -4.94 135.00 131.48 3d5b n PRO 118 Ca -0.08 -0.16 -0.41 0.00 -0.04 0.00 0.00 63.50 62.81 3d5b n PRO 118 Cb 0.42 -2.23 -0.04 0.00 -0.04 0.00 0.00 33.50 31.61 3d5b n PRO 118 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 3d5b s GLU 119 N -4.39 4.57 0.00 0.54 2.12 -1.26 -3.03 118.70 117.26 3d5b s GLU 119 Ca 0.65 1.68 0.00 0.00 0.36 0.00 0.00 54.97 57.66 3d5b s GLU 119 Cb -0.23 -3.32 0.00 0.00 0.26 0.00 0.00 34.13 30.85 3d5b s GLU 119 CO 0.61 0.01 0.00 0.41 -0.54 0.00 0.00 175.26 175.75 3d5b n GLY 120 N 2.39 0.75 2.94 -1.50 0.00 -1.26 -5.05 105.19 103.46 3d5b n GLY 120 Ca 0.04 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.90 3d5b n GLY 120 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3d5b s ILE 121 N -2.40 0.40 -0.43 -0.61 1.09 -1.17 -3.25 121.20 114.84 3d5b s ILE 121 Ca 0.00 -0.19 0.04 0.00 -1.10 0.00 0.00 60.65 59.41 3d5b s ILE 121 Cb 0.00 -0.36 0.17 0.00 -1.06 0.00 0.00 42.46 41.21 3d5b s ILE 121 CO 0.00 0.13 0.41 0.42 -0.10 0.00 0.00 174.94 175.80 3d5b s THR 122 N 0.08 0.03 0.44 2.92 -4.23 0.14 -4.56 115.64 110.45 3d5b s THR 122 Ca -0.00 -2.20 -0.25 0.00 -1.18 0.00 0.00 61.69 58.06 3d5b s THR 122 Cb -0.04 -0.97 -0.09 0.00 1.34 0.00 0.00 72.50 72.73 3d5b s THR 122 CO -0.00 -0.96 1.27 2.22 -0.54 0.00 0.00 174.62 176.61 3d5b n PHE 123 N 2.99 2.11 -4.39 3.99 1.16 -1.26 -3.41 117.46 118.65 3d5b n PHE 123 Ca 0.26 0.49 -0.28 0.00 -1.87 0.00 0.00 57.45 56.05 3d5b n PHE 123 Cb 0.49 -2.37 -0.12 0.00 -1.61 0.00 0.00 39.48 35.87 3d5b n PHE 123 CO 0.00 0.00 0.00 -2.00 -1.87 0.00 0.00 176.76 172.89 3d5b s GLU 124 N -2.30 1.54 -0.46 3.97 -6.30 -0.36 -4.87 118.70 109.92 3d5b s GLU 124 Ca 0.63 -1.43 0.03 0.00 -2.50 0.00 0.00 54.97 51.69 3d5b s GLU 124 Cb -0.49 -1.91 0.14 0.00 0.00 0.00 0.00 34.13 31.87 3d5b s GLU 124 CO 0.57 0.42 0.25 0.08 0.02 0.00 0.00 175.26 176.60 3d5b s VAL 125 N -1.45 1.65 0.25 3.70 1.01 -1.26 -0.69 120.40 123.61 3d5b s VAL 125 Ca 0.19 -2.75 0.03 0.00 0.00 0.00 0.00 61.98 59.45 3d5b s VAL 125 Cb -0.09 -2.15 -0.00 0.00 0.00 0.00 0.00 36.38 34.14 3d5b s VAL 125 CO 0.09 -0.89 1.62 1.55 0.00 0.00 0.00 175.10 177.47 3d5b h PRO 126 N 6.62 0.33 -4.20 2.72 0.13 -1.99 -3.46 132.00 132.15 3d5b h PRO 126 Ca -0.01 -0.18 -0.13 0.00 -0.87 0.00 0.00 66.00 64.80 3d5b h PRO 126 Cb 0.91 0.01 -0.15 0.00 0.13 0.00 0.00 31.00 31.91 3d5b h PRO 126 CO 0.53 0.74 -0.60 -1.21 -0.23 0.00 0.00 178.00 177.23 3d5b s GLU 127 N -4.03 0.78 0.66 0.86 2.02 -1.22 -5.03 118.70 112.73 3d5b s GLU 127 Ca -0.05 -1.24 0.41 0.00 0.02 0.00 0.00 54.97 54.11 3d5b s GLU 127 Cb 0.13 0.25 2.25 0.00 0.10 0.00 0.00 34.13 36.86 3d5b s GLU 127 CO 0.80 -0.20 2.27 -1.00 0.02 0.00 0.00 175.26 177.14 3d5b h PRO 128 N 2.96 0.00 0.00 0.39 0.13 -1.90 -3.17 132.00 130.42 3d5b h PRO 128 Ca -0.34 0.00 -0.25 0.00 -0.87 0.00 0.00 66.00 64.53 3d5b h PRO 128 Cb 1.17 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.26 3d5b h PRO 128 CO 0.61 0.00 -1.83 0.25 -0.23 0.00 0.00 178.00 176.80 3d5b n THR 129 N -3.01 1.48 -2.64 1.56 -2.24 -1.26 -2.20 114.28 105.97 3d5b n THR 129 Ca -0.03 -0.15 -0.41 0.00 -2.27 0.00 0.00 64.05 61.20 3d5b n THR 129 Cb 0.12 -2.07 -0.05 0.00 -2.10 0.00 0.00 70.33 66.24 3d5b n THR 129 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 3d5b s ARG 130 N -2.66 4.71 -0.15 -0.78 0.52 -1.20 -3.36 118.95 116.02 3d5b s ARG 130 Ca -0.33 1.58 -0.04 0.00 -0.52 0.00 0.00 55.73 56.42 3d5b s ARG 130 Cb 0.10 -3.30 0.07 0.00 0.52 0.00 0.00 34.95 32.34 3d5b s ARG 130 CO 0.45 0.26 0.18 0.08 0.02 0.00 0.00 175.30 176.29 3d5b s VAL 131 N -0.53 -0.27 0.62 3.52 1.01 -0.11 -3.44 120.40 121.20 3d5b s VAL 131 Ca 0.46 0.08 -0.07 0.00 0.00 0.00 0.00 61.98 62.45 3d5b s VAL 131 Cb -0.27 -0.50 0.02 0.00 0.00 0.00 0.00 36.38 35.63 3d5b s VAL 131 CO 0.33 -0.06 0.95 -0.13 0.00 0.00 0.00 175.10 176.19 3d5b s ARG 132 N 2.29 2.80 -0.49 2.72 1.81 0.13 -0.60 118.95 127.61 3d5b s ARG 132 Ca 0.04 0.02 0.03 0.00 -1.72 0.00 0.00 55.73 54.11 3d5b s ARG 132 Cb -0.14 -2.22 0.15 0.00 -0.45 0.00 0.00 34.95 32.29 3d5b s ARG 132 CO -0.09 -0.83 0.31 0.08 -0.68 0.00 0.00 175.30 174.09 3d5b s VAL 133 N -3.08 1.54 0.29 3.52 1.01 0.27 -1.22 120.40 122.73 3d5b s VAL 133 Ca 0.55 -2.95 -0.29 0.00 0.00 0.00 0.00 61.98 59.30 3d5b s VAL 133 Cb -0.11 -2.06 -0.10 0.00 0.00 0.00 0.00 36.38 34.12 3d5b s VAL 133 CO 0.46 -0.98 1.10 -0.44 0.00 0.00 0.00 175.10 175.24 3d5b s SER 134 N -0.09 7.24 0.00 3.32 0.01 -1.22 -2.98 113.70 119.98 3d5b s SER 134 Ca 0.22 2.26 0.00 0.00 1.31 0.00 0.00 55.95 59.74 3d5b s SER 134 Cb -0.15 -2.62 0.00 0.00 0.21 0.00 0.00 66.02 63.46 3d5b s SER 134 CO -0.07 -0.16 0.00 0.61 0.41 0.00 0.00 173.24 174.03 3d5b n GLY 135 N 1.15 2.03 0.03 3.44 0.00 -0.46 -0.68 105.19 110.70 3d5b n GLY 135 Ca -0.01 -0.78 0.00 0.00 0.00 0.00 0.00 46.02 45.23 3d5b n GLY 135 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 3d5b n ILE 136 N 0.00 0.00 -3.69 -0.61 -6.64 -1.20 -3.25 119.36 103.97 3d5b n ILE 136 Ca 0.00 0.00 -0.10 0.00 -1.77 0.00 0.00 62.75 60.88 3d5b n ILE 136 Cb 0.00 0.87 -0.10 0.00 -1.44 0.00 0.00 39.64 38.97 3d5b n ILE 136 CO 0.00 0.00 0.00 -0.62 -1.77 0.00 0.00 176.55 174.16 3d5b s ASP 137 N -0.06 -0.60 0.10 7.28 -1.08 -1.26 -4.59 116.67 116.46 3d5b s ASP 137 Ca 0.00 1.01 -0.20 0.00 -0.52 0.00 0.00 52.55 52.84 3d5b s ASP 137 Cb 0.00 0.90 -0.09 0.00 -1.46 0.00 0.00 42.92 42.26 3d5b s ASP 137 CO 0.00 -0.20 1.69 0.11 0.52 0.00 0.00 175.17 177.28 3d5b h LYS 138 N 7.04 0.24 -0.86 4.34 1.57 -1.98 0.34 116.57 127.25 3d5b h LYS 138 Ca -0.35 -0.03 0.17 0.00 -1.87 0.00 0.00 60.65 58.56 3d5b h LYS 138 Cb 1.19 -0.04 -0.10 0.00 0.08 0.00 0.00 32.23 33.36 3d5b h LYS 138 CO 0.27 0.25 0.43 0.37 -0.57 0.00 0.00 179.45 180.20 3d5b h GLN 139 N 0.16 0.55 0.22 3.15 5.75 -1.98 0.64 115.11 123.61 3d5b h GLN 139 Ca 0.06 -0.03 -0.01 0.00 -0.15 0.00 0.00 58.65 58.51 3d5b h GLN 139 Cb 0.09 -0.12 0.00 0.00 1.07 0.00 0.00 27.48 28.51 3d5b h GLN 139 CO -0.01 0.37 -0.11 0.87 -2.65 0.00 0.00 178.83 177.30 3d5b h LYS 140 N 0.57 -0.29 -0.96 1.69 1.57 -1.84 -2.38 116.57 114.93 3d5b h LYS 140 Ca 0.49 0.02 0.23 0.00 -1.87 0.00 0.00 60.65 59.52 3d5b h LYS 140 Cb 0.76 0.07 -0.08 0.00 0.08 0.00 0.00 32.23 33.06 3d5b h LYS 140 CO -0.40 -0.19 0.63 0.28 -0.57 0.00 0.00 179.45 179.20 3d5b h VAL 141 N -0.42 0.62 -0.22 0.50 2.07 -0.83 0.17 116.25 118.14 3d5b h VAL 141 Ca -0.03 -0.14 0.01 0.00 0.82 0.00 0.00 66.70 67.36 3d5b h VAL 141 Cb 0.23 0.18 -0.02 0.00 -1.52 0.00 0.00 31.29 30.16 3d5b h VAL 141 CO 0.05 0.07 0.11 1.23 0.02 0.00 0.00 177.57 179.05 3d5b h GLY 142 N 0.40 0.29 0.75 2.17 0.00 0.29 0.22 103.07 107.18 3d5b h GLY 142 Ca 0.52 -0.08 -0.08 0.00 0.00 0.00 0.00 47.33 47.69 3d5b h GLY 142 CO -0.22 0.07 -0.22 1.46 0.00 0.00 0.00 176.54 177.63 3d5b h GLN 143 N 0.23 0.38 -0.63 4.80 1.08 -0.36 -2.86 115.11 117.76 3d5b h GLN 143 Ca 0.09 -0.23 0.07 0.00 -1.45 0.00 0.00 58.65 57.12 3d5b h GLN 143 Cb 0.02 0.02 -0.06 0.00 -0.05 0.00 0.00 27.48 27.41 3d5b h GLN 143 CO -0.06 0.82 0.32 0.28 -0.95 0.00 0.00 178.83 179.24 3d5b h VAL 144 N -0.02 0.91 -0.27 -0.54 2.07 -0.69 0.72 116.25 118.43 3d5b h VAL 144 Ca 0.01 -0.20 0.02 0.00 0.82 0.00 0.00 66.70 67.35 3d5b h VAL 144 Cb 0.79 0.28 -0.02 0.00 -1.52 0.00 0.00 31.29 30.82 3d5b h VAL 144 CO 0.05 0.11 0.13 0.00 0.02 0.00 0.00 177.57 177.88 3d5b h ALA 145 N 1.36 0.32 -0.44 1.67 0.00 -0.98 -2.29 119.26 118.90 3d5b h ALA 145 Ca 0.29 0.01 -0.07 0.00 0.00 0.00 0.00 54.91 55.14 3d5b h ALA 145 Cb 0.25 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 3d5b h ALA 145 CO -0.22 -0.26 0.01 0.00 0.00 0.00 0.00 179.25 178.78 3d5b h ALA 146 N 1.14 0.60 -0.90 0.00 0.00 -1.11 -2.78 119.26 116.20 3d5b h ALA 146 Ca 0.11 -0.27 0.22 0.00 0.00 0.00 0.00 54.91 54.97 3d5b h ALA 146 Cb 0.04 -0.16 -0.06 0.00 0.00 0.00 0.00 17.79 17.60 3d5b h ALA 146 CO -0.08 0.38 0.61 -0.91 0.00 0.00 0.00 179.25 179.25 3d5b h ASN 147 N 0.62 0.29 0.11 0.00 -0.26 0.76 0.31 115.58 117.42 3d5b h ASN 147 Ca 0.13 0.03 -0.01 0.00 -0.56 0.00 0.00 56.30 55.89 3d5b h ASN 147 Cb 0.48 -0.02 0.00 0.00 -1.06 0.00 0.00 38.32 37.73 3d5b h ASN 147 CO 0.02 0.11 -0.05 0.40 -1.06 0.00 0.00 177.43 176.85 3d5b h ILE 148 N 0.29 1.08 0.00 2.81 1.08 -1.15 -3.09 117.51 118.52 3d5b h ILE 148 Ca 0.46 -1.26 -0.01 0.00 -0.39 0.00 0.00 64.86 63.66 3d5b h ILE 148 Cb 1.32 1.81 -0.00 0.00 -3.07 0.00 0.00 36.82 36.88 3d5b h ILE 148 CO -0.14 0.28 -0.04 -0.09 -0.69 0.00 0.00 178.15 177.48 3d5b h ARG 149 N -0.78 0.00 -0.07 2.37 2.43 -1.19 -1.42 114.38 115.71 3d5b h ARG 149 Ca -0.01 0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 59.11 3d5b h ARG 149 Cb 0.57 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.11 3d5b h ARG 149 CO 0.02 0.04 -0.16 0.00 -1.51 0.00 0.00 179.97 178.37 3d5b h ALA 150 N 1.96 1.62 0.07 2.80 0.00 -0.39 -2.52 119.26 122.80 3d5b h ALA 150 Ca -0.00 -0.18 0.02 0.00 0.00 0.00 0.00 54.91 54.74 3d5b h ALA 150 Cb 0.07 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 3d5b h ALA 150 CO 0.00 0.28 -0.16 0.82 0.00 0.00 0.00 179.25 180.20 3d5b h ILE 151 N 0.10 0.63 -2.00 0.00 1.08 -1.17 -3.39 117.51 112.77 3d5b h ILE 151 Ca 0.02 0.00 -0.44 0.00 -0.39 0.00 0.00 64.86 64.05 3d5b h ILE 151 Cb 0.34 0.63 -0.32 0.00 -3.07 0.00 0.00 36.82 34.41 3d5b h ILE 151 CO 0.02 0.00 -0.79 -0.60 -0.69 0.00 0.00 178.15 176.09 3d5b s ARG 152 N -6.13 0.84 0.74 2.37 6.06 -1.13 -5.11 118.95 116.58 3d5b s ARG 152 Ca -0.15 -1.50 -0.16 0.00 -2.50 0.00 0.00 55.73 51.42 3d5b s ARG 152 Cb 0.08 -0.94 -0.01 0.00 0.06 0.00 0.00 34.95 34.13 3d5b s ARG 152 CO 0.66 -1.31 0.68 1.63 -2.50 0.00 0.00 175.30 174.46 3d5b n LYS 153 N 3.34 0.32 -1.77 5.12 5.02 -0.96 -2.39 118.16 126.83 3d5b n LYS 153 Ca 0.21 0.15 -0.41 0.00 -2.02 0.00 0.00 58.31 56.24 3d5b n LYS 153 Cb 0.48 -1.97 -0.01 0.00 -0.02 0.00 0.00 35.03 33.51 3d5b n LYS 153 CO 0.00 0.00 0.00 -2.30 -0.52 0.00 0.00 177.40 174.58 3d5b n PRO 154 N -1.25 2.72 -2.11 1.97 -0.02 -1.26 -4.50 135.00 130.55 3d5b n PRO 154 Ca 0.11 0.96 -0.43 0.00 -2.02 0.00 0.00 63.50 62.12 3d5b n PRO 154 Cb 0.50 -2.72 -0.03 0.00 -0.02 0.00 0.00 33.50 31.23 3d5b n PRO 154 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3d5b s SER 155 N 0.17 6.18 0.00 2.55 0.15 -1.12 -4.86 113.70 116.76 3d5b s SER 155 Ca 0.58 1.36 0.09 0.00 0.70 0.00 0.00 55.95 58.68 3d5b s SER 155 Cb -0.48 -2.53 0.52 0.00 -1.71 0.00 0.00 66.02 61.82 3d5b s SER 155 CO 0.57 -1.47 1.02 0.00 1.20 0.00 0.00 173.24 174.56 3d5b n ALA 156 N 9.23 1.78 -0.05 5.45 0.00 -1.26 -2.30 120.51 133.37 3d5b n ALA 156 Ca 0.20 -0.05 -0.03 0.00 0.00 0.00 0.00 53.44 53.56 3d5b n ALA 156 Cb 0.46 -1.15 -0.11 0.00 0.00 0.00 0.00 19.45 18.66 3d5b n ALA 156 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3d5b n TYR 157 N -1.06 0.00 0.00 0.00 4.01 -1.26 -4.71 117.16 114.14 3d5b n TYR 157 Ca 0.06 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.80 3d5b n TYR 157 Cb 0.04 -0.58 0.00 0.00 -0.31 0.00 0.00 39.34 38.49 3d5b n TYR 157 CO 0.00 0.00 0.00 -2.39 -0.46 0.00 0.00 176.86 174.01 3d5b n HIS 158 N -2.37 0.00 -4.04 -0.72 1.44 -0.97 -4.99 115.22 103.56 3d5b n HIS 158 Ca -0.17 0.00 -0.32 0.00 -2.01 0.00 0.00 57.72 55.23 3d5b n HIS 158 Cb 0.79 0.00 -0.15 0.00 0.12 0.00 0.00 29.99 30.75 3d5b n HIS 158 CO 0.00 0.00 0.00 -1.21 -2.81 0.00 0.00 176.34 172.32 3d5b s GLU 159 N 4.94 1.90 0.31 -1.40 2.02 -1.26 -4.50 118.70 120.71 3d5b s GLU 159 Ca 0.00 -1.59 -0.14 0.00 0.02 0.00 0.00 54.97 53.26 3d5b s GLU 159 Cb 0.00 -3.04 0.02 0.00 0.10 0.00 0.00 34.13 31.21 3d5b s GLU 159 CO 0.00 -0.74 0.63 0.15 0.02 0.00 0.00 175.26 175.32 3d5b s LYS 160 N 1.01 1.86 0.25 1.61 1.02 -1.26 -3.68 119.74 120.55 3d5b s LYS 160 Ca 0.00 -1.32 0.00 0.00 0.02 0.00 0.00 55.97 54.67 3d5b s LYS 160 Cb -0.20 0.55 0.00 0.00 -0.52 0.00 0.00 37.83 37.66 3d5b s LYS 160 CO -0.06 -0.83 0.00 0.41 -0.92 0.00 0.00 175.35 173.95 3d5b n GLY 161 N -0.47 -2.43 3.62 -3.33 0.00 -1.20 -2.80 105.19 98.58 3d5b n GLY 161 Ca -0.04 -1.60 -0.35 0.00 0.00 0.00 0.00 46.02 44.04 3d5b n GLY 161 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3d5b s ILE 162 N -0.71 4.82 0.22 -0.61 -0.00 -1.01 -2.56 121.20 121.36 3d5b s ILE 162 Ca 0.00 -0.02 0.07 0.00 -0.00 0.00 0.00 60.65 60.70 3d5b s ILE 162 Cb 0.00 -3.19 -0.04 0.00 -0.00 0.00 0.00 42.46 39.24 3d5b s ILE 162 CO 0.00 0.44 0.15 -0.31 -0.00 0.00 0.00 174.94 175.22 3d5b s TYR 163 N 0.56 3.08 0.00 1.37 1.51 0.72 -4.58 117.35 120.01 3d5b s TYR 163 Ca 0.04 -0.09 0.00 0.00 -1.01 0.00 0.00 57.07 56.01 3d5b s TYR 163 Cb -0.13 -1.42 0.00 0.00 -0.11 0.00 0.00 41.96 40.30 3d5b s TYR 163 CO 0.01 0.53 0.24 0.66 -1.11 0.00 0.00 175.55 175.88 3d5b n TYR 164 N -0.81 0.00 -1.00 2.71 4.02 -1.26 0.38 117.16 121.19 3d5b n TYR 164 Ca -0.08 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.81 3d5b n TYR 164 Cb 0.57 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.89 3d5b n TYR 164 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 3d5b n ALA 165 N -0.83 0.52 -1.97 -0.72 0.00 -1.26 -2.98 120.51 113.27 3d5b n ALA 165 Ca 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.23 3d5b n ALA 165 Cb 0.00 0.00 0.04 0.00 0.00 0.00 0.00 19.45 19.49 3d5b n ALA 165 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3d5b s GLY 166 N 0.00 1.83 0.64 0.00 0.00 -1.26 -5.04 107.32 103.48 3d5b s GLY 166 Ca 0.00 -1.32 -0.17 0.00 0.00 0.00 0.00 44.72 43.22 3d5b s GLY 166 CO 0.00 -1.04 -0.08 1.18 0.00 0.00 0.00 173.10 173.17 3d5b n GLU 167 N -2.36 0.10 -2.53 2.90 1.02 -1.26 -4.92 120.64 113.60 3d5b n GLU 167 Ca 0.08 0.04 -0.38 0.00 -0.02 0.00 0.00 57.16 56.88 3d5b n GLU 167 Cb 0.60 -1.21 -0.04 0.00 -0.02 0.00 0.00 31.44 30.76 3d5b n GLU 167 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 3d5b s PRO 168 N -1.60 4.43 0.41 3.49 0.04 -1.26 -4.94 135.00 135.57 3d5b s PRO 168 Ca 0.56 1.64 0.29 0.00 0.04 0.00 0.00 61.00 63.53 3d5b s PRO 168 Cb -0.41 -2.88 1.31 0.00 0.04 0.00 0.00 34.50 32.56 3d5b s PRO 168 CO 0.67 0.07 1.87 -0.24 0.04 0.00 0.00 177.00 179.40 3d5b h VAL 169 N 2.67 0.00 0.00 -0.36 3.04 -1.91 -3.54 116.25 116.15 3d5b h VAL 169 Ca -0.47 -0.24 0.00 0.00 -1.01 0.00 0.00 66.70 64.97 3d5b h VAL 169 Cb 1.21 1.05 0.00 0.00 -2.01 0.00 0.00 31.29 31.54 3d5b h VAL 169 CO 0.65 0.00 0.00 0.54 -1.01 0.00 0.00 177.57 177.75