#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kno n LYS 13 N 0.00 0.00 -0.80 -0.52 5.02 -1.26 -4.42 118.16 116.19 3kno n LYS 13 Ca 0.00 0.00 -0.24 0.00 -2.02 0.00 0.00 58.31 56.05 3kno n LYS 13 Cb 0.00 0.00 -0.02 0.00 -0.02 0.00 0.00 35.03 34.99 3kno n LYS 13 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3kno n GLY 14 N 0.00 3.11 2.99 0.72 0.00 -1.26 -4.79 105.19 105.96 3kno n GLY 14 Ca 0.00 -0.90 -0.13 0.00 0.00 0.00 0.00 46.02 44.99 3kno n GLY 14 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3kno s VAL 15 N 3.51 -0.02 -1.20 1.61 -7.23 -1.26 -4.38 120.40 111.43 3kno s VAL 15 Ca 0.42 0.08 -0.08 0.00 -1.81 0.00 0.00 61.98 60.58 3kno s VAL 15 Cb 0.11 -0.24 0.22 0.00 0.56 0.00 0.00 36.38 37.03 3kno s VAL 15 CO -0.02 0.03 1.63 -1.20 -0.31 0.00 0.00 175.10 175.23 3kno n SER 16 N 3.55 5.54 -3.67 4.85 7.64 -0.77 -4.91 113.62 125.85 3kno n SER 16 Ca -0.19 -3.17 -0.42 0.00 1.01 0.00 0.00 58.87 56.10 3kno n SER 16 Cb 0.56 -1.42 -0.08 0.00 -1.01 0.00 0.00 64.21 62.26 3kno n SER 16 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 3kno n VAL 17 N 2.88 1.24 -2.77 0.44 0.31 -1.26 -3.94 118.33 115.22 3kno n VAL 17 Ca 0.34 -1.10 -0.42 0.00 -0.01 0.00 0.00 64.34 63.14 3kno n VAL 17 Cb 0.37 -2.21 -0.03 0.00 -0.91 0.00 0.00 33.84 31.05 3kno n VAL 17 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 3kno s GLU 18 N 5.77 4.07 -0.55 5.55 2.02 -1.21 -4.72 118.70 129.63 3kno s GLU 18 Ca 0.62 0.93 -0.21 0.00 0.02 0.00 0.00 54.97 56.34 3kno s GLU 18 Cb 0.13 -3.71 0.06 0.00 0.10 0.00 0.00 34.13 30.72 3kno s GLU 18 CO 0.19 -0.74 0.76 0.08 0.02 0.00 0.00 175.26 175.56 3kno s VAL 19 N 3.26 4.68 0.00 2.63 1.01 -1.26 -4.02 120.40 126.69 3kno s VAL 19 Ca 0.40 -0.37 0.00 0.00 0.00 0.00 0.00 61.98 62.01 3kno s VAL 19 Cb -0.14 -4.44 0.00 0.00 0.00 0.00 0.00 36.38 31.81 3kno s VAL 19 CO 0.12 -1.02 0.00 0.00 0.00 0.00 0.00 175.10 174.20 3kno n ALA 20 N 6.71 0.00 -1.00 5.51 0.00 -1.23 -5.03 120.51 125.46 3kno n ALA 20 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.39 3kno n ALA 20 Cb 0.45 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.90 3kno n ALA 20 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3kno n PRO 21 N -0.43 0.00 -0.10 0.00 -0.02 -1.26 -4.50 135.00 128.69 3kno n PRO 21 Ca 0.00 0.01 -0.11 0.00 -2.02 0.00 0.00 63.50 61.38 3kno n PRO 21 Cb 0.00 -0.52 -0.15 0.00 -0.02 0.00 0.00 33.50 32.81 3kno n PRO 21 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3kno n GLY 22 N -0.03 -0.90 1.47 -1.23 0.00 -1.26 -4.92 105.19 98.32 3kno n GLY 22 Ca 0.00 -0.29 -0.12 0.00 0.00 0.00 0.00 46.02 45.61 3kno n GLY 22 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3kno n ARG 23 N -2.86 -1.70 0.00 1.61 5.12 -1.26 0.19 116.66 117.75 3kno n ARG 23 Ca -0.34 -0.74 0.00 0.00 -1.93 0.00 0.00 57.85 54.84 3kno n ARG 23 Cb 1.12 -0.66 0.00 0.00 -1.16 0.00 0.00 32.46 31.76 3kno n ARG 23 CO 0.00 0.00 0.00 1.33 -1.93 0.00 0.00 177.63 177.03 3kno n VAL 24 N -3.38 0.00 -0.92 1.55 0.24 -1.23 -3.57 118.33 111.02 3kno n VAL 24 Ca 0.06 0.00 -0.30 0.00 -2.04 0.00 0.00 64.34 62.06 3kno n VAL 24 Cb 0.24 0.00 -0.01 0.00 -1.47 0.00 0.00 33.84 32.61 3kno n VAL 24 CO 0.00 0.00 0.00 2.29 -2.14 0.00 0.00 176.83 176.98 3kno n LYS 25 N 0.00 0.00 -3.96 7.34 0.00 -1.26 -4.35 118.16 115.93 3kno n LYS 25 Ca 0.00 0.00 -0.31 0.00 -0.00 0.00 0.00 58.31 58.00 3kno n LYS 25 Cb 0.00 -0.69 -0.15 0.00 -0.00 0.00 0.00 35.03 34.18 3kno n LYS 25 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.40 177.48 3kno s VAL 26 N -1.07 1.64 0.37 0.58 1.01 -1.15 -3.34 120.40 118.45 3kno s VAL 26 Ca 0.42 -1.32 -0.12 0.00 0.00 0.00 0.00 61.98 60.96 3kno s VAL 26 Cb -0.49 -1.89 -0.07 0.00 0.00 0.00 0.00 36.38 33.93 3kno s VAL 26 CO 0.43 -0.11 0.75 -0.54 0.00 0.00 0.00 175.10 175.63 3kno s LYS 27 N 1.34 3.86 0.00 2.72 1.02 -1.25 -3.51 119.74 123.92 3kno s LYS 27 Ca -0.06 0.54 0.00 0.00 0.02 0.00 0.00 55.97 56.48 3kno s LYS 27 Cb -0.19 -2.41 0.00 0.00 -0.52 0.00 0.00 37.83 34.71 3kno s LYS 27 CO -0.06 0.04 0.00 0.41 -0.92 0.00 0.00 175.35 174.82 3kno n GLY 28 N -0.94 3.42 0.00 -3.33 0.00 0.98 -1.84 105.19 103.48 3kno n GLY 28 Ca 0.03 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.35 3kno n GLY 28 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3kno n PRO 29 N 0.00 0.00 0.00 1.61 -0.02 -1.26 -2.97 135.00 132.36 3kno n PRO 29 Ca 0.00 0.40 0.00 0.00 -2.02 0.00 0.00 63.50 61.88 3kno n PRO 29 Cb 0.00 -1.37 0.00 0.00 -0.02 0.00 0.00 33.50 32.11 3kno n PRO 29 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 3kno n LYS 30 N -1.67 0.00 0.00 -0.52 4.76 -1.26 -4.90 118.16 114.57 3kno n LYS 30 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 3kno n LYS 30 Cb 0.00 -1.10 0.00 0.00 -1.84 0.00 0.00 35.03 32.09 3kno n LYS 30 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3kno n GLY 31 N -0.56 0.47 3.36 0.72 0.00 -1.16 -5.04 105.19 102.98 3kno n GLY 31 Ca 0.00 -2.26 -0.28 0.00 0.00 0.00 0.00 46.02 43.47 3kno n GLY 31 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3kno s GLU 32 N -0.17 1.48 -0.09 1.61 -6.30 -1.26 -0.01 118.70 113.95 3kno s GLU 32 Ca 0.00 -1.24 -0.00 0.00 -2.50 0.00 0.00 54.97 51.23 3kno s GLU 32 Cb 0.00 -1.84 0.02 0.00 0.00 0.00 0.00 34.13 32.32 3kno s GLU 32 CO 0.00 0.45 -0.05 -0.51 0.02 0.00 0.00 175.26 175.16 3kno s LEU 33 N -1.76 1.07 -1.04 2.70 1.43 -1.23 -4.98 118.68 114.87 3kno s LEU 33 Ca 0.12 -0.22 -0.23 0.00 -1.03 0.00 0.00 54.13 52.78 3kno s LEU 33 Cb -0.10 -0.68 0.02 0.00 0.03 0.00 0.00 46.19 45.47 3kno s LEU 33 CO 0.04 -0.12 1.64 -1.61 0.23 0.00 0.00 176.35 176.54 3kno s GLU 34 N 1.59 3.32 -0.54 1.70 0.41 -1.26 -2.91 118.70 121.01 3kno s GLU 34 Ca 0.01 -1.04 -0.13 0.00 -0.41 0.00 0.00 54.97 53.40 3kno s GLU 34 Cb -0.13 -5.30 0.13 0.00 -1.78 0.00 0.00 34.13 27.05 3kno s GLU 34 CO -0.05 -2.62 0.46 0.08 -0.49 0.00 0.00 175.26 172.64 3kno s VAL 35 N 6.51 4.85 0.85 2.63 1.01 -1.26 -4.93 120.40 130.06 3kno s VAL 35 Ca 0.54 -1.70 -0.11 0.00 0.00 0.00 0.00 61.98 60.72 3kno s VAL 35 Cb -0.01 -4.13 0.11 0.00 0.00 0.00 0.00 36.38 32.35 3kno s VAL 35 CO -0.04 -0.85 1.14 -2.16 0.00 0.00 0.00 175.10 173.19 3kno s PRO 36 N 1.38 1.49 -0.00 2.72 0.04 -1.26 -3.48 135.00 135.89 3kno s PRO 36 Ca 0.05 1.47 -0.10 0.00 0.04 0.00 0.00 61.00 62.46 3kno s PRO 36 Cb -0.27 -1.79 0.01 0.00 0.04 0.00 0.00 34.50 32.49 3kno s PRO 36 CO 0.01 -2.26 0.20 0.08 0.04 0.00 0.00 177.00 175.06 3kno s VAL 37 N -2.64 0.07 0.17 -0.36 1.01 0.13 -4.92 120.40 113.86 3kno s VAL 37 Ca 0.66 -0.61 -0.31 0.00 0.00 0.00 0.00 61.98 61.72 3kno s VAL 37 Cb -0.22 -0.50 -0.10 0.00 0.00 0.00 0.00 36.38 35.56 3kno s VAL 37 CO 0.56 -0.33 1.55 -0.55 0.00 0.00 0.00 175.10 176.33 3kno s SER 38 N -1.36 6.60 0.00 3.32 0.15 -1.26 -4.50 113.70 116.64 3kno s SER 38 Ca -0.14 2.61 0.00 0.00 0.70 0.00 0.00 55.95 59.12 3kno s SER 38 Cb -0.07 -2.60 0.00 0.00 -1.71 0.00 0.00 66.02 61.65 3kno s SER 38 CO 0.03 -0.81 0.60 -2.65 1.20 0.00 0.00 173.24 171.61 3kno n PRO 39 N 3.87 0.00 -1.80 5.44 -0.02 -1.26 -4.55 135.00 136.68 3kno n PRO 39 Ca 0.13 0.17 -0.31 0.00 -2.02 0.00 0.00 63.50 61.48 3kno n PRO 39 Cb 0.39 -1.56 0.03 0.00 -0.02 0.00 0.00 33.50 32.33 3kno n PRO 39 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 3kno s GLU 40 N -2.21 3.23 0.00 -0.52 0.41 -1.26 -4.20 118.70 114.15 3kno s GLU 40 Ca 0.00 0.71 0.00 0.00 -0.41 0.00 0.00 54.97 55.27 3kno s GLU 40 Cb 0.00 -2.04 0.00 0.00 -1.78 0.00 0.00 34.13 30.31 3kno s GLU 40 CO 0.00 -0.83 0.00 -1.33 -0.49 0.00 0.00 175.26 172.61 3kno n MET 41 N -2.91 0.00 -2.67 1.61 2.81 -1.26 -4.70 117.12 109.99 3kno n MET 41 Ca 0.07 0.00 -0.04 0.00 -1.81 0.00 0.00 57.70 55.91 3kno n MET 41 Cb 0.55 0.00 0.02 0.00 -0.71 0.00 0.00 33.22 33.08 3kno n MET 41 CO 0.00 0.00 0.00 -2.13 1.51 0.00 0.00 175.97 175.35 3kno n ARG 42 N 0.00 -1.21 -3.29 0.03 0.63 -1.26 -4.77 116.66 106.79 3kno n ARG 42 Ca 0.00 0.98 -0.33 0.00 -0.92 0.00 0.00 57.85 57.58 3kno n ARG 42 Cb 0.00 -4.57 -0.06 0.00 0.45 0.00 0.00 32.46 28.28 3kno n ARG 42 CO 0.00 0.00 0.00 0.14 -2.51 0.00 0.00 177.63 175.26 3kno s VAL 43 N -3.11 4.82 0.48 5.15 -7.23 -1.26 -5.01 120.40 114.23 3kno s VAL 43 Ca 0.13 0.71 0.05 0.00 -1.81 0.00 0.00 61.98 61.07 3kno s VAL 43 Cb -0.02 -3.63 -0.01 0.00 0.56 0.00 0.00 36.38 33.28 3kno s VAL 43 CO 0.53 -0.08 0.22 -0.69 -0.31 0.00 0.00 175.10 174.78 3kno s VAL 44 N -1.84 1.85 0.00 1.32 1.01 -1.26 -4.95 120.40 116.52 3kno s VAL 44 Ca 0.49 -1.69 0.00 0.00 0.00 0.00 0.00 61.98 60.78 3kno s VAL 44 Cb -0.11 -2.53 0.00 0.00 0.00 0.00 0.00 36.38 33.73 3kno s VAL 44 CO 0.20 0.00 1.51 0.52 0.00 0.00 0.00 175.10 177.33 3kno n VAL 45 N -1.43 1.51 -1.51 2.92 0.31 -1.26 -4.58 118.33 114.29 3kno n VAL 45 Ca -0.05 -0.28 -0.51 0.00 -0.01 0.00 0.00 64.34 63.49 3kno n VAL 45 Cb 0.65 -1.27 -0.05 0.00 -0.91 0.00 0.00 33.84 32.26 3kno n VAL 45 CO 0.00 0.00 0.00 -1.84 -1.32 0.00 0.00 176.83 173.67 3kno n GLU 46 N 1.09 0.53 0.00 5.55 0.00 -1.26 -4.60 120.64 121.96 3kno n GLU 46 Ca 0.00 0.19 0.00 0.00 0.00 0.00 0.00 57.16 57.35 3kno n GLU 46 Cb 0.48 -1.55 0.00 0.00 0.00 0.00 0.00 31.44 30.37 3kno n GLU 46 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.13 175.22 3kno n GLU 47 N 1.45 0.00 0.05 3.44 2.13 -1.26 -4.21 120.64 122.24 3kno n GLU 47 Ca 0.17 0.00 -0.21 0.00 0.66 0.00 0.00 57.16 57.78 3kno n GLU 47 Cb 0.20 0.00 -0.15 0.00 0.27 0.00 0.00 31.44 31.77 3kno n GLU 47 CO 0.00 0.00 0.00 0.78 -0.41 0.00 0.00 177.13 177.50 3kno h GLY 48 N 0.00 0.37 -3.25 8.31 0.00 -2.03 -3.46 103.07 103.01 3kno h GLY 48 Ca 0.00 -0.93 -0.50 0.00 0.00 0.00 0.00 47.33 45.90 3kno h GLY 48 CO 0.00 0.82 -0.30 -1.34 0.00 0.00 0.00 176.54 175.71 3kno s VAL 49 N -2.46 5.18 0.13 4.60 -7.23 -1.26 -4.70 120.40 114.67 3kno s VAL 49 Ca -0.14 -0.53 -0.04 0.00 -1.81 0.00 0.00 61.98 59.46 3kno s VAL 49 Cb 0.02 -3.80 -0.05 0.00 0.56 0.00 0.00 36.38 33.10 3kno s VAL 49 CO 0.83 -0.34 0.35 -0.69 -0.31 0.00 0.00 175.10 174.94 3kno s VAL 50 N -2.05 5.21 0.07 1.32 1.01 -1.26 -4.63 120.40 120.07 3kno s VAL 50 Ca 0.38 -0.08 0.09 0.00 0.00 0.00 0.00 61.98 62.38 3kno s VAL 50 Cb -0.10 -3.64 -0.03 0.00 0.00 0.00 0.00 36.38 32.61 3kno s VAL 50 CO 0.31 0.03 -0.25 -0.13 0.00 0.00 0.00 175.10 175.06 3kno s ARG 51 N -2.70 1.74 -0.25 2.72 0.52 -1.26 -5.09 118.95 114.63 3kno s ARG 51 Ca 0.40 -1.16 -0.09 0.00 -0.52 0.00 0.00 55.73 54.36 3kno s ARG 51 Cb -0.12 -1.99 -0.04 0.00 0.52 0.00 0.00 34.95 33.32 3kno s ARG 51 CO 0.26 0.50 0.12 0.08 0.02 0.00 0.00 175.30 176.27 3kno s VAL 52 N -0.89 4.85 0.00 3.52 1.01 -1.26 -4.75 120.40 122.88 3kno s VAL 52 Ca 0.13 0.01 0.00 0.00 0.00 0.00 0.00 61.98 62.12 3kno s VAL 52 Cb -0.10 -3.27 0.00 0.00 0.00 0.00 0.00 36.38 33.01 3kno s VAL 52 CO 0.04 0.33 0.00 -0.62 0.00 0.00 0.00 175.10 174.85 3kno n GLU 53 N 4.62 -0.35 0.00 2.72 1.02 -1.26 -5.11 120.64 122.28 3kno n GLU 53 Ca -0.15 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 56.99 3kno n GLU 53 Cb 0.52 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.94 3kno n GLU 53 CO 0.00 0.00 0.00 2.89 1.18 0.00 0.00 177.13 181.20 3kno n ARG 54 N -1.12 0.00 0.00 3.49 -4.01 -1.26 -4.88 116.66 108.88 3kno n ARG 54 Ca 0.00 0.00 0.00 0.00 -1.04 0.00 0.00 57.85 56.81 3kno n ARG 54 Cb 0.00 0.00 0.00 0.00 -3.04 0.00 0.00 32.46 29.42 3kno n ARG 54 CO 0.00 0.00 0.00 -0.35 -3.04 0.00 0.00 177.63 174.24 3kno n PRO 55 N 0.00 0.00 0.00 2.89 -0.04 -1.26 -4.91 135.00 131.68 3kno n PRO 55 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 3kno n PRO 55 Cb 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.46 3kno n PRO 55 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 3kno n SER 56 N 0.00 -0.01 -3.42 3.54 3.41 -1.26 -4.99 113.62 110.90 3kno n SER 56 Ca 0.00 -0.00 -0.26 0.00 -0.26 0.00 0.00 58.87 58.35 3kno n SER 56 Cb 0.00 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 63.87 3kno n SER 56 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 3kno n ASP 57 N -0.01 2.28 -4.81 4.04 10.43 -1.26 -4.94 116.55 122.28 3kno n ASP 57 Ca 0.00 -3.11 -0.36 0.00 2.57 0.00 0.00 54.79 53.89 3kno n ASP 57 Cb 0.00 -0.66 -0.06 0.00 1.84 0.00 0.00 41.12 42.23 3kno n ASP 57 CO 0.00 0.00 0.00 -1.61 -1.07 0.00 0.00 177.20 174.52 3kno s GLU 58 N -1.76 4.33 0.52 -1.24 2.02 -1.26 -4.79 118.70 116.52 3kno s GLU 58 Ca 0.36 0.97 0.27 0.00 0.02 0.00 0.00 54.97 56.60 3kno s GLU 58 Cb 0.12 -2.87 1.40 0.00 0.10 0.00 0.00 34.13 32.88 3kno s GLU 58 CO -0.08 0.37 1.93 -0.09 0.02 0.00 0.00 175.26 177.42 3kno h ARG 59 N 3.38 0.05 -0.00 1.61 2.43 -1.98 2.64 114.38 122.52 3kno h ARG 59 Ca -0.48 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.69 3kno h ARG 59 Cb 1.19 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.73 3kno h ARG 59 CO 0.65 0.03 0.00 0.54 -1.51 0.00 0.00 179.97 179.68 3kno n ARG 60 N -4.34 1.05 0.00 0.20 1.74 -1.26 -3.39 116.66 110.66 3kno n ARG 60 Ca 0.15 -0.07 0.00 0.00 -0.77 0.00 0.00 57.85 57.16 3kno n ARG 60 Cb 0.79 -1.49 0.00 0.00 -1.02 0.00 0.00 32.46 30.74 3kno n ARG 60 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 3kno n HIS 61 N -0.90 0.00 0.24 -1.55 8.25 0.78 -4.32 115.22 117.71 3kno n HIS 61 Ca 0.23 0.00 0.13 0.00 -0.26 0.00 0.00 57.72 57.82 3kno n HIS 61 Cb 0.12 0.00 0.66 0.00 1.12 0.00 0.00 29.99 31.89 3kno n HIS 61 CO 0.00 0.00 0.00 0.87 0.64 0.00 0.00 176.34 177.85 3kno h LYS 62 N 0.00 0.00 0.00 -0.41 1.57 0.17 -0.37 116.57 117.53 3kno h LYS 62 Ca 0.00 0.00 -0.34 0.00 -1.87 0.00 0.00 60.65 58.44 3kno h LYS 62 Cb 0.96 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 33.20 3kno h LYS 62 CO 0.00 0.00 -2.32 0.43 -0.57 0.00 0.00 179.45 176.99 3kno n SER 63 N -2.40 0.05 0.19 0.86 7.64 -1.22 -3.62 113.62 115.12 3kno n SER 63 Ca -0.01 0.02 0.04 0.00 1.01 0.00 0.00 58.87 59.94 3kno n SER 63 Cb 0.09 1.02 0.35 0.00 -1.01 0.00 0.00 64.21 64.66 3kno n SER 63 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 3kno h LEU 64 N 0.00 0.00 0.00 -3.43 3.38 -1.29 -1.02 115.31 112.95 3kno h LEU 64 Ca -0.50 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.47 3kno h LEU 64 Cb 2.14 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.89 3kno h LEU 64 CO 0.03 0.39 -0.04 -0.74 0.09 0.00 0.00 178.44 178.18 3kno h HIS 65 N 0.00 0.00 -0.96 1.13 2.76 -1.51 -2.87 115.15 113.70 3kno h HIS 65 Ca -0.00 -0.00 0.19 0.00 -2.20 0.00 0.00 60.37 58.36 3kno h HIS 65 Cb 0.82 -0.00 -0.09 0.00 1.55 0.00 0.00 27.41 29.70 3kno h HIS 65 CO 0.00 1.01 0.61 0.78 -1.30 0.00 0.00 177.93 179.03 3kno h GLY 66 N -1.00 1.33 2.00 5.26 0.00 -1.59 0.67 103.07 109.74 3kno h GLY 66 Ca -0.01 -0.28 -0.11 0.00 0.00 0.00 0.00 47.33 46.93 3kno h GLY 66 CO -0.01 -0.02 -0.51 -2.00 0.00 0.00 0.00 176.54 174.01 3kno h LEU 67 N 0.61 0.00 0.00 3.11 5.85 -1.28 -3.19 115.31 120.41 3kno h LEU 67 Ca 0.52 0.00 -0.07 0.00 0.84 0.00 0.00 57.88 59.17 3kno h LEU 67 Cb 1.00 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.02 3kno h LEU 67 CO -0.27 0.51 -1.03 0.74 -0.34 0.00 0.00 178.44 178.05 3kno h THR 68 N 0.00 0.25 0.00 1.05 2.02 -0.63 -3.29 112.91 112.31 3kno h THR 68 Ca -0.01 -1.46 0.00 0.00 0.77 0.00 0.00 66.41 65.72 3kno h THR 68 Cb 1.27 1.81 0.00 0.00 -1.74 0.00 0.00 68.15 69.49 3kno h THR 68 CO 0.07 0.14 0.10 -1.14 0.37 0.00 0.00 175.52 175.06 3kno n ARG 69 N -2.84 0.04 0.00 6.66 0.63 0.21 -4.20 116.66 117.16 3kno n ARG 69 Ca -0.03 0.48 0.00 0.00 -0.92 0.00 0.00 57.85 57.38 3kno n ARG 69 Cb 0.67 -1.74 0.00 0.00 0.45 0.00 0.00 32.46 31.84 3kno n ARG 69 CO 0.00 0.00 0.00 0.25 -2.51 0.00 0.00 177.63 175.37 3kno n THR 70 N -1.67 0.00 0.00 5.15 -2.24 -1.24 -4.55 114.28 109.73 3kno n THR 70 Ca -0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 3kno n THR 70 Cb 0.11 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.34 3kno n THR 70 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 3kno n LEU 71 N 0.00 0.00 -0.06 3.22 7.94 -1.26 -2.95 117.00 123.89 3kno n LEU 71 Ca 0.00 0.00 -0.10 0.00 -1.11 0.00 0.00 56.01 54.80 3kno n LEU 71 Cb 0.00 0.00 -0.15 0.00 0.53 0.00 0.00 43.42 43.80 3kno n LEU 71 CO 0.00 0.00 -0.82 -0.38 -1.11 0.00 0.00 177.39 175.08 3kno n ILE 72 N 0.00 1.52 0.16 1.96 5.41 -1.26 -2.81 119.36 124.35 3kno n ILE 72 Ca 0.00 -0.81 0.04 0.00 1.00 0.00 0.00 62.75 62.97 3kno n ILE 72 Cb 0.00 -0.82 0.22 0.00 -0.71 0.00 0.00 39.64 38.33 3kno n ILE 72 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3kno h ALA 73 N 0.95 0.87 0.00 -1.39 0.00 -1.77 -2.62 119.26 115.31 3kno h ALA 73 Ca -0.41 -0.42 -0.10 0.00 0.00 0.00 0.00 54.91 53.97 3kno h ALA 73 Cb 2.11 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 19.81 3kno h ALA 73 CO 0.05 0.58 -0.90 -0.91 0.00 0.00 0.00 179.25 178.08 3kno h ASN 74 N 0.00 0.00 0.00 0.00 2.35 -1.82 -2.84 115.58 113.27 3kno h ASN 74 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 3kno h ASN 74 Cb 1.09 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.46 3kno h ASN 74 CO 0.06 0.41 0.00 0.00 -1.65 0.00 0.00 177.43 176.25 3kno n ALA 75 N -2.28 2.41 -0.05 -0.83 0.00 -1.00 0.03 120.51 118.80 3kno n ALA 75 Ca -0.03 -0.15 -0.05 0.00 0.00 0.00 0.00 53.44 53.21 3kno n ALA 75 Cb 0.73 -1.40 -0.02 0.00 0.00 0.00 0.00 19.45 18.77 3kno n ALA 75 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3kno n VAL 76 N -1.00 0.86 0.33 0.00 0.31 -1.14 -4.30 118.33 113.38 3kno n VAL 76 Ca 0.18 0.29 0.22 0.00 -0.01 0.00 0.00 64.34 65.02 3kno n VAL 76 Cb 0.08 -1.94 1.18 0.00 -0.91 0.00 0.00 33.84 32.25 3kno n VAL 76 CO 0.00 0.00 0.00 0.11 -1.32 0.00 0.00 176.83 175.62 3kno h LYS 77 N -0.53 0.00 -0.69 5.55 1.57 -1.45 -1.11 116.57 119.91 3kno h LYS 77 Ca 0.00 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.73 3kno h LYS 77 Cb 0.53 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.81 3kno h LYS 77 CO 0.00 0.00 0.25 0.78 -0.57 0.00 0.00 179.45 179.91 3kno h GLY 78 N 0.00 1.13 2.00 3.86 0.00 -0.61 -2.52 103.07 106.93 3kno h GLY 78 Ca 0.00 -0.64 -0.07 0.00 0.00 0.00 0.00 47.33 46.63 3kno h GLY 78 CO 0.00 0.60 -0.32 -0.39 0.00 0.00 0.00 176.54 176.43 3kno h VAL 79 N 0.99 0.59 -0.59 4.60 -1.51 -1.39 -3.09 116.25 115.85 3kno h VAL 79 Ca 0.23 -1.65 -0.22 0.00 -1.23 0.00 0.00 66.70 63.83 3kno h VAL 79 Cb 0.25 2.15 -0.13 0.00 -2.13 0.00 0.00 31.29 31.43 3kno h VAL 79 CO -0.01 0.31 0.28 -1.20 -1.23 0.00 0.00 177.57 175.71 3kno n SER 80 N -3.24 3.93 -1.17 4.19 7.64 -0.98 -4.05 113.62 119.94 3kno n SER 80 Ca 0.02 -2.96 0.00 0.00 1.01 0.00 0.00 58.87 56.94 3kno n SER 80 Cb 0.61 -0.70 0.00 0.00 -1.01 0.00 0.00 64.21 63.11 3kno n SER 80 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 3kno n GLU 81 N -0.21 0.00 -0.65 1.43 4.71 -1.01 -4.96 120.64 119.96 3kno n GLU 81 Ca 0.34 0.39 0.01 0.00 -0.01 0.00 0.00 57.16 57.89 3kno n GLU 81 Cb 1.18 -0.86 0.25 0.00 -1.01 0.00 0.00 31.44 30.99 3kno n GLU 81 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 3kno n GLY 82 N -0.08 2.71 0.00 0.62 0.00 -1.14 -4.80 105.19 102.50 3kno n GLY 82 Ca 0.00 -0.64 0.00 0.00 0.00 0.00 0.00 46.02 45.38 3kno n GLY 82 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3kno n TYR 83 N 0.24 0.00 -1.55 1.61 4.02 -0.33 -4.18 117.16 116.98 3kno n TYR 83 Ca 0.23 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 58.12 3kno n TYR 83 Cb 0.96 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 40.28 3kno n TYR 83 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 176.86 174.72 3kno n SER 84 N 0.00 -0.28 -1.77 7.72 3.41 -1.26 -2.62 113.62 118.82 3kno n SER 84 Ca 0.00 0.00 -0.01 0.00 -0.26 0.00 0.00 58.87 58.60 3kno n SER 84 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 3kno n SER 84 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 3kno n LYS 85 N 0.00 -0.51 -4.05 4.33 4.81 -1.26 -3.81 118.16 117.67 3kno n LYS 85 Ca 0.00 0.85 -0.17 0.00 -0.87 0.00 0.00 58.31 58.12 3kno n LYS 85 Cb 0.00 -2.31 -0.16 0.00 0.02 0.00 0.00 35.03 32.58 3kno n LYS 85 CO 0.00 0.00 0.00 -1.83 1.17 0.00 0.00 177.40 176.74 3kno s GLU 86 N -1.23 0.45 -0.02 1.64 1.03 -1.25 0.32 118.70 119.64 3kno s GLU 86 Ca 0.05 -0.04 0.05 0.00 0.03 0.00 0.00 54.97 55.05 3kno s GLU 86 Cb -0.01 -0.53 -0.01 0.00 -0.80 0.00 0.00 34.13 32.78 3kno s GLU 86 CO 0.16 -0.05 -0.16 -0.51 -1.33 0.00 0.00 175.26 173.37 3kno s LEU 87 N 0.65 2.00 -0.22 1.83 1.43 0.28 -4.54 118.68 120.11 3kno s LEU 87 Ca -0.07 -0.29 -0.12 0.00 -1.03 0.00 0.00 54.13 52.62 3kno s LEU 87 Cb -0.10 -0.83 -0.05 0.00 0.03 0.00 0.00 46.19 45.24 3kno s LEU 87 CO -0.01 0.18 0.21 -0.76 0.23 0.00 0.00 176.35 176.21 3kno s LEU 88 N -0.28 4.15 0.09 1.79 2.01 -1.07 -0.50 118.68 124.87 3kno s LEU 88 Ca 0.04 0.24 -0.14 0.00 0.01 0.00 0.00 54.13 54.29 3kno s LEU 88 Cb -0.07 -2.20 -0.16 0.00 0.01 0.00 0.00 46.19 43.76 3kno s LEU 88 CO -0.00 0.06 1.29 0.16 1.01 0.00 0.00 176.35 178.87 3kno h ILE 89 N 4.94 1.29 -0.24 -0.59 -0.00 -1.85 -3.06 117.51 118.01 3kno h ILE 89 Ca -0.38 -1.95 0.00 0.00 -0.00 0.00 0.00 64.86 62.52 3kno h ILE 89 Cb 1.16 2.02 0.00 0.00 -0.00 0.00 0.00 36.82 40.01 3kno h ILE 89 CO 0.69 0.61 0.00 0.29 -0.00 0.00 0.00 178.15 179.75 3kno n LYS 90 N -3.99 0.00 -1.09 0.16 4.76 -1.26 -4.39 118.16 112.35 3kno n LYS 90 Ca -0.08 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.36 3kno n LYS 90 Cb 0.73 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.92 3kno n LYS 90 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3kno n GLY 91 N 0.00 -3.80 0.00 0.72 0.00 -1.23 -4.43 105.19 96.45 3kno n GLY 91 Ca 0.00 -0.95 0.00 0.00 0.00 0.00 0.00 46.02 45.07 3kno n GLY 91 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3kno n ILE 92 N -1.91 0.00 -0.22 -0.61 5.41 -1.26 -3.45 119.36 117.32 3kno n ILE 92 Ca 0.00 0.14 -0.02 0.00 1.00 0.00 0.00 62.75 63.87 3kno n ILE 92 Cb 0.24 -1.02 -0.03 0.00 -0.71 0.00 0.00 39.64 38.12 3kno n ILE 92 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3kno n GLY 93 N 0.00 1.38 3.23 7.39 0.00 -1.26 -4.76 105.19 111.17 3kno n GLY 93 Ca 0.00 -0.23 -0.27 0.00 0.00 0.00 0.00 46.02 45.52 3kno n GLY 93 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3kno s TYR 94 N 2.20 1.86 -1.37 1.61 1.51 -1.22 -4.27 117.35 117.67 3kno s TYR 94 Ca 0.13 -0.36 0.00 0.00 -1.01 0.00 0.00 57.07 55.83 3kno s TYR 94 Cb 0.06 -1.19 0.00 0.00 -0.11 0.00 0.00 41.96 40.72 3kno s TYR 94 CO 0.00 -0.01 0.00 2.89 -1.11 0.00 0.00 175.55 177.32 3kno n ARG 95 N 2.46 -2.65 -3.67 -0.62 1.85 -1.26 -4.80 116.66 107.97 3kno n ARG 95 Ca -0.15 0.00 -0.10 0.00 -1.00 0.00 0.00 57.85 56.59 3kno n ARG 95 Cb 0.53 0.00 -0.09 0.00 -1.05 0.00 0.00 32.46 31.85 3kno n ARG 95 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 3kno s ALA 96 N -1.69 -1.42 0.00 2.89 0.00 -1.24 -3.35 121.76 116.96 3kno s ALA 96 Ca 0.00 1.82 0.00 0.00 0.00 0.00 0.00 51.96 53.78 3kno s ALA 96 Cb 0.00 -1.08 0.00 0.00 0.00 0.00 0.00 23.12 22.04 3kno s ALA 96 CO 0.00 -0.30 0.00 0.54 0.00 0.00 0.00 175.76 176.00 3kno n ARG 97 N 3.78 2.31 0.00 0.00 1.74 0.24 -4.65 116.66 120.08 3kno n ARG 97 Ca -0.19 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.89 3kno n ARG 97 Cb 0.57 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 32.01 3kno n ARG 97 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 3kno n LEU 98 N 0.00 0.00 -4.46 0.55 7.94 -1.26 -4.36 117.00 115.41 3kno n LEU 98 Ca 0.00 0.00 -0.46 0.00 -1.11 0.00 0.00 56.01 54.44 3kno n LEU 98 Cb 0.00 0.00 -0.09 0.00 0.53 0.00 0.00 43.42 43.86 3kno n LEU 98 CO 0.00 0.00 1.96 0.52 -1.11 0.00 0.00 177.39 178.76 3kno n VAL 99 N 0.00 0.06 -0.99 1.96 0.31 -1.10 -4.36 118.33 114.21 3kno n VAL 99 Ca 0.00 -0.29 0.00 0.00 -0.01 0.00 0.00 64.34 64.04 3kno n VAL 99 Cb 0.00 -1.50 0.00 0.00 -0.91 0.00 0.00 33.84 31.43 3kno n VAL 99 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3kno n GLY 100 N 6.51 0.34 0.82 2.92 0.00 -1.26 -2.95 105.19 111.56 3kno n GLY 100 Ca 0.48 -0.81 0.11 0.00 0.00 0.00 0.00 46.02 45.80 3kno n GLY 100 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 3kno n ARG 101 N 11.17 1.96 -3.12 1.61 0.63 -1.26 -4.94 116.66 122.71 3kno n ARG 101 Ca 0.00 -1.67 -0.20 0.00 -0.92 0.00 0.00 57.85 55.06 3kno n ARG 101 Cb 0.00 -1.43 0.06 0.00 0.45 0.00 0.00 32.46 31.54 3kno n ARG 101 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 3kno s ALA 102 N -1.96 4.71 -0.02 5.13 0.00 -1.15 -3.81 121.76 124.65 3kno s ALA 102 Ca 0.24 -2.09 0.02 0.00 0.00 0.00 0.00 51.96 50.13 3kno s ALA 102 Cb 0.18 -1.38 0.00 0.00 0.00 0.00 0.00 23.12 21.92 3kno s ALA 102 CO 0.33 -0.86 -0.08 -0.48 0.00 0.00 0.00 175.76 174.66 3kno s LEU 103 N -4.65 1.82 -0.15 0.00 2.34 -1.26 -2.70 118.68 114.08 3kno s LEU 103 Ca 0.60 -0.17 -0.12 0.00 0.06 0.00 0.00 54.13 54.50 3kno s LEU 103 Cb -0.05 -0.50 -0.05 0.00 -0.56 0.00 0.00 46.19 45.03 3kno s LEU 103 CO 0.38 0.07 0.24 -0.70 -1.06 0.00 0.00 176.35 175.27 3kno s GLU 104 N 0.13 4.06 -0.06 1.48 2.12 -1.26 -3.14 118.70 122.02 3kno s GLU 104 Ca -0.02 0.01 0.03 0.00 0.36 0.00 0.00 54.97 55.35 3kno s GLU 104 Cb -0.07 -3.36 -0.03 0.00 0.26 0.00 0.00 34.13 30.93 3kno s GLU 104 CO 0.00 0.40 -0.14 -0.51 -0.54 0.00 0.00 175.26 174.47 3kno s LEU 105 N 0.02 2.77 -0.37 2.70 2.01 -0.74 -0.59 118.68 124.47 3kno s LEU 105 Ca 0.15 -0.19 0.13 0.00 0.01 0.00 0.00 54.13 54.23 3kno s LEU 105 Cb -0.13 -1.57 0.43 0.00 0.01 0.00 0.00 46.19 44.94 3kno s LEU 105 CO 0.03 0.34 0.97 0.35 1.01 0.00 0.00 176.35 179.05 3kno n THR 106 N 2.37 1.35 -3.05 5.49 -2.24 -1.21 0.61 114.28 117.61 3kno n THR 106 Ca -0.17 -3.84 -0.45 0.00 -2.27 0.00 0.00 64.05 57.32 3kno n THR 106 Cb 0.52 -0.05 -0.03 0.00 -2.10 0.00 0.00 70.33 68.68 3kno n THR 106 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 3kno s VAL 107 N -3.78 4.97 0.00 2.28 -7.23 -1.26 -4.49 120.40 110.89 3kno s VAL 107 Ca 0.35 -1.74 0.00 0.00 -1.81 0.00 0.00 61.98 58.78 3kno s VAL 107 Cb 0.42 -4.67 0.00 0.00 0.56 0.00 0.00 36.38 32.70 3kno s VAL 107 CO -0.04 -1.34 0.00 0.61 -0.31 0.00 0.00 175.10 174.01 3kno n GLY 108 N 5.05 1.00 3.63 2.32 0.00 -1.26 -4.91 105.19 111.02 3kno n GLY 108 Ca 0.18 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.77 3kno n GLY 108 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3kno s PHE 109 N 0.00 2.78 0.24 1.61 0.08 -1.26 -4.91 117.98 116.51 3kno s PHE 109 Ca 0.00 0.90 0.04 0.00 0.12 0.00 0.00 56.93 57.99 3kno s PHE 109 Cb 0.00 -3.97 0.63 0.00 -0.57 0.00 0.00 43.02 39.12 3kno s PHE 109 CO 0.00 -1.47 1.15 -1.13 -0.10 0.00 0.00 175.22 173.67 3kno n SER 110 N 7.60 -0.03 -4.27 1.36 3.41 -1.26 -3.55 113.62 116.88 3kno n SER 110 Ca 0.14 1.25 -0.37 0.00 -0.26 0.00 0.00 58.87 59.62 3kno n SER 110 Cb 0.47 -0.48 -0.13 0.00 -0.26 0.00 0.00 64.21 63.82 3kno n SER 110 CO 0.00 0.00 0.00 -2.28 -0.16 0.00 0.00 175.04 172.60 3kno s HIS 111 N -5.56 3.22 1.00 7.33 5.65 -1.26 -5.09 115.29 120.57 3kno s HIS 111 Ca -0.09 -1.41 -0.18 0.00 0.25 0.00 0.00 55.06 53.63 3kno s HIS 111 Cb 0.22 -2.23 -0.14 0.00 -1.18 0.00 0.00 32.58 29.25 3kno s HIS 111 CO 0.57 -0.71 -0.81 -0.35 -0.65 0.00 0.00 174.74 172.80 3kno n PRO 112 N 4.79 -0.05 -4.08 2.88 -0.04 -1.23 -5.00 135.00 132.26 3kno n PRO 112 Ca -0.13 -0.01 -0.35 0.00 -0.04 0.00 0.00 63.50 62.97 3kno n PRO 112 Cb 0.45 -1.09 -0.10 0.00 -0.04 0.00 0.00 33.50 32.73 3kno n PRO 112 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 3kno s VAL 113 N -2.04 4.70 -1.17 0.52 1.01 0.20 -4.92 120.40 118.71 3kno s VAL 113 Ca 0.41 -0.07 -0.05 0.00 0.00 0.00 0.00 61.98 62.27 3kno s VAL 113 Cb -0.14 -3.09 0.24 0.00 0.00 0.00 0.00 36.38 33.39 3kno s VAL 113 CO 0.79 0.49 1.81 0.52 0.00 0.00 0.00 175.10 178.71 3kno n VAL 114 N 3.27 5.20 -0.13 2.92 0.31 -1.26 -1.79 118.33 126.85 3kno n VAL 114 Ca -0.17 -5.25 -0.03 0.00 -0.01 0.00 0.00 64.34 58.88 3kno n VAL 114 Cb 0.53 -2.06 -0.01 0.00 -0.91 0.00 0.00 33.84 31.39 3kno n VAL 114 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 3kno n VAL 115 N 1.69 0.41 -1.50 2.52 0.31 -1.19 -4.88 118.33 115.69 3kno n VAL 115 Ca 0.40 -0.23 -0.48 0.00 -0.01 0.00 0.00 64.34 64.02 3kno n VAL 115 Cb 0.31 -1.60 -0.03 0.00 -0.91 0.00 0.00 33.84 31.62 3kno n VAL 115 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 3kno n GLU 116 N 4.22 0.63 -3.10 5.55 0.00 -1.26 -4.10 120.64 122.58 3kno n GLU 116 Ca 0.07 0.22 -0.39 0.00 0.00 0.00 0.00 57.16 57.06 3kno n GLU 116 Cb 0.05 -1.45 -0.05 0.00 0.00 0.00 0.00 31.44 29.98 3kno n GLU 116 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.13 175.88 3kno s PRO 117 N -1.05 4.40 1.02 5.31 0.04 -1.26 -5.00 135.00 138.45 3kno s PRO 117 Ca 0.65 0.89 -0.17 0.00 0.04 0.00 0.00 61.00 62.41 3kno s PRO 117 Cb -0.86 -3.35 0.22 0.00 0.04 0.00 0.00 34.50 30.55 3kno s PRO 117 CO 0.57 0.34 1.27 -1.25 0.04 0.00 0.00 177.00 177.97 3kno s PRO 118 N -0.18 0.22 0.38 0.56 0.04 -1.26 -5.05 135.00 129.71 3kno s PRO 118 Ca 0.34 -0.31 -0.10 0.00 0.04 0.00 0.00 61.00 60.97 3kno s PRO 118 Cb -0.19 -1.79 -0.06 0.00 0.04 0.00 0.00 34.50 32.50 3kno s PRO 118 CO 0.20 -2.71 0.73 -2.00 0.04 0.00 0.00 177.00 173.26 3kno s GLU 119 N -5.77 3.75 0.00 4.56 2.12 -1.26 -4.24 118.70 117.87 3kno s GLU 119 Ca 0.73 0.39 0.00 0.00 0.36 0.00 0.00 54.97 56.44 3kno s GLU 119 Cb -0.05 -2.44 0.00 0.00 0.26 0.00 0.00 34.13 31.90 3kno s GLU 119 CO 0.54 0.01 0.00 0.41 -0.54 0.00 0.00 175.26 175.68 3kno n GLY 120 N -1.21 0.77 3.57 -1.50 0.00 -1.26 -5.04 105.19 100.52 3kno n GLY 120 Ca 0.02 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.94 3kno n GLY 120 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3kno s ILE 121 N -2.27 0.00 0.20 -0.61 1.01 -1.26 -4.21 121.20 114.07 3kno s ILE 121 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 60.65 60.73 3kno s ILE 121 Cb 0.00 -1.00 -0.05 0.00 0.01 0.00 0.00 42.46 41.42 3kno s ILE 121 CO 0.00 0.00 -0.15 -0.89 0.00 0.00 0.00 174.94 173.90 3kno s THR 122 N -1.41 1.78 -0.07 2.92 2.01 -1.11 -4.71 115.64 115.04 3kno s THR 122 Ca 0.00 -2.15 -0.04 0.00 0.31 0.00 0.00 61.69 59.81 3kno s THR 122 Cb -0.01 -2.00 -0.04 0.00 0.01 0.00 0.00 72.50 70.46 3kno s THR 122 CO -0.00 -0.53 0.10 -0.36 -0.69 0.00 0.00 174.62 173.14 3kno s PHE 123 N -2.76 3.43 0.17 4.92 0.40 -1.25 -0.16 117.98 122.74 3kno s PHE 123 Ca 0.21 0.37 0.11 0.00 -0.60 0.00 0.00 56.93 57.02 3kno s PHE 123 Cb -0.02 -1.85 -0.04 0.00 0.51 0.00 0.00 43.02 41.62 3kno s PHE 123 CO 0.07 0.63 -0.24 -1.21 0.70 0.00 0.00 175.22 175.17 3kno s GLU 124 N -1.28 1.44 -0.42 0.44 2.02 0.33 -4.90 118.70 116.33 3kno s GLU 124 Ca 0.18 -1.45 0.05 0.00 0.02 0.00 0.00 54.97 53.77 3kno s GLU 124 Cb -0.12 -1.77 0.19 0.00 0.10 0.00 0.00 34.13 32.54 3kno s GLU 124 CO 0.08 0.39 0.40 0.28 0.02 0.00 0.00 175.26 176.43 3kno n VAL 125 N 0.45 -0.90 -2.14 2.63 0.31 -1.26 -1.45 118.33 115.97 3kno n VAL 125 Ca -0.14 -3.67 -0.39 0.00 -0.01 0.00 0.00 64.34 60.13 3kno n VAL 125 Cb 0.55 -1.76 -0.03 0.00 -0.91 0.00 0.00 33.84 31.69 3kno n VAL 125 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 3kno s PRO 126 N -0.38 2.75 0.00 5.55 0.04 -1.24 -4.67 135.00 137.06 3kno s PRO 126 Ca 0.33 0.47 0.00 0.00 0.04 0.00 0.00 61.00 61.85 3kno s PRO 126 Cb 0.07 -4.34 0.00 0.00 0.04 0.00 0.00 34.50 30.27 3kno s PRO 126 CO -0.17 -2.60 0.00 0.39 0.04 0.00 0.00 177.00 174.66 3kno n GLU 127 N 9.19 0.00 -0.45 4.56 1.02 -1.26 -3.81 120.64 129.89 3kno n GLU 127 Ca 0.17 0.00 -0.08 0.00 -0.02 0.00 0.00 57.16 57.23 3kno n GLU 127 Cb 0.51 0.00 0.05 0.00 -0.02 0.00 0.00 31.44 31.98 3kno n GLU 127 CO 0.00 0.00 0.00 -0.35 1.18 0.00 0.00 177.13 177.96 3kno n PRO 128 N -1.30 1.41 0.00 3.49 -0.04 -1.26 -4.47 135.00 132.83 3kno n PRO 128 Ca 0.00 -0.93 0.00 0.00 -0.04 0.00 0.00 63.50 62.53 3kno n PRO 128 Cb 0.00 -1.36 0.00 0.00 -0.04 0.00 0.00 33.50 32.10 3kno n PRO 128 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 3kno n THR 129 N 0.16 0.00 -1.16 0.52 -2.24 -1.26 -3.59 114.28 106.72 3kno n THR 129 Ca 0.18 0.00 -0.34 0.00 -2.27 0.00 0.00 64.05 61.62 3kno n THR 129 Cb 0.79 -0.17 0.11 0.00 -2.10 0.00 0.00 70.33 68.97 3kno n THR 129 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 3kno n ARG 130 N -0.91 0.24 -3.68 -0.78 0.63 -1.25 -3.99 116.66 106.91 3kno n ARG 130 Ca 0.00 0.15 -0.13 0.00 -0.92 0.00 0.00 57.85 56.95 3kno n ARG 130 Cb 0.00 -2.28 -0.13 0.00 0.45 0.00 0.00 32.46 30.50 3kno n ARG 130 CO 0.00 0.00 0.00 0.08 -2.51 0.00 0.00 177.63 175.20 3kno s VAL 131 N -2.05 -0.31 0.39 5.15 1.01 0.35 -3.70 120.40 121.24 3kno s VAL 131 Ca 0.71 0.23 0.08 0.00 0.00 0.00 0.00 61.98 63.00 3kno s VAL 131 Cb -0.30 -0.44 -0.03 0.00 0.00 0.00 0.00 36.38 35.60 3kno s VAL 131 CO 0.53 0.10 0.30 -0.13 0.00 0.00 0.00 175.10 175.89 3kno s ARG 132 N 2.07 2.50 -0.41 2.72 0.52 -0.53 0.10 118.95 125.91 3kno s ARG 132 Ca -0.02 -1.53 0.07 0.00 -0.52 0.00 0.00 55.73 53.72 3kno s ARG 132 Cb -0.11 -2.31 0.17 0.00 0.52 0.00 0.00 34.95 33.22 3kno s ARG 132 CO -0.09 -0.08 0.57 0.08 0.02 0.00 0.00 175.30 175.80 3kno s VAL 133 N -2.45 -0.79 -0.17 3.52 1.01 0.15 0.12 120.40 121.79 3kno s VAL 133 Ca 0.44 -0.45 -0.42 0.00 0.00 0.00 0.00 61.98 61.55 3kno s VAL 133 Cb -0.03 -0.20 -0.20 0.00 0.00 0.00 0.00 36.38 35.95 3kno s VAL 133 CO 0.26 -0.19 1.29 -1.20 0.00 0.00 0.00 175.10 175.27 3kno n SER 134 N 4.15 0.61 -4.15 3.32 7.64 0.77 -4.59 113.62 121.37 3kno n SER 134 Ca 0.12 1.16 -0.28 0.00 1.01 0.00 0.00 58.87 60.89 3kno n SER 134 Cb 0.54 -0.94 -0.16 0.00 -1.01 0.00 0.00 64.21 62.63 3kno n SER 134 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 3kno s GLY 135 N 1.16 1.05 -0.13 0.23 0.00 -1.08 -2.76 107.32 105.79 3kno s GLY 135 Ca 0.95 -0.75 -0.21 0.00 0.00 0.00 0.00 44.72 44.71 3kno s GLY 135 CO 0.65 -0.29 0.57 -2.22 0.00 0.00 0.00 173.10 171.81 3kno h ILE 136 N 5.49 1.25 0.00 0.90 2.04 -1.81 -0.83 117.51 124.56 3kno h ILE 136 Ca -0.29 -2.35 0.00 0.00 1.00 0.00 0.00 64.86 63.22 3kno h ILE 136 Cb 1.19 2.82 0.00 0.00 -0.74 0.00 0.00 36.82 40.10 3kno h ILE 136 CO 0.47 0.59 0.00 -0.67 0.00 0.00 0.00 178.15 178.54 3kno n ASP 137 N -4.23 0.00 0.05 1.72 -0.08 -1.26 -4.45 116.55 108.29 3kno n ASP 137 Ca -0.22 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.06 3kno n ASP 137 Cb 0.74 0.00 0.00 0.00 2.34 0.00 0.00 41.12 44.20 3kno n ASP 137 CO 0.00 0.00 0.00 1.17 0.12 0.00 0.00 177.20 178.49 3kno n LYS 138 N 0.00 0.00 0.10 -0.67 3.00 -1.26 -4.72 118.16 114.61 3kno n LYS 138 Ca 0.00 0.00 -0.19 0.00 -0.00 0.00 0.00 58.31 58.12 3kno n LYS 138 Cb 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 35.03 34.88 3kno n LYS 138 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 177.40 176.84 3kno h GLN 139 N 0.00 0.33 0.00 1.64 -0.00 -1.98 -2.55 115.11 112.55 3kno h GLN 139 Ca 0.00 -0.57 0.00 0.00 -0.00 0.00 0.00 58.65 58.08 3kno h GLN 139 Cb 0.00 0.21 0.00 0.00 -0.00 0.00 0.00 27.48 27.69 3kno h GLN 139 CO 0.00 1.24 0.00 -0.22 -0.00 0.00 0.00 178.83 179.85 3kno h LYS 140 N 0.09 0.00 0.00 0.06 3.64 -1.98 -0.07 116.57 118.31 3kno h LYS 140 Ca -0.22 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.16 3kno h LYS 140 Cb 2.04 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.86 3kno h LYS 140 CO 0.20 0.00 0.00 0.28 -2.27 0.00 0.00 179.45 177.66 3kno n VAL 141 N -3.01 0.00 0.32 2.00 0.31 -1.14 -3.26 118.33 113.56 3kno n VAL 141 Ca 0.01 0.31 0.05 0.00 -0.01 0.00 0.00 64.34 64.70 3kno n VAL 141 Cb 0.29 -0.71 0.25 0.00 -0.91 0.00 0.00 33.84 32.76 3kno n VAL 141 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 3kno h GLY 142 N 0.00 0.00 0.00 2.92 0.00 -1.51 -1.81 103.07 102.67 3kno h GLY 142 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3kno h GLY 142 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 176.54 176.36 3kno n GLN 143 N -2.55 0.00 -0.34 4.80 -0.06 -0.04 -2.47 117.38 116.72 3kno n GLN 143 Ca -0.01 0.08 0.21 0.00 -2.00 0.00 0.00 57.00 55.28 3kno n GLN 143 Cb 0.79 -1.05 0.45 0.00 -4.06 0.00 0.00 30.24 26.37 3kno n GLN 143 CO 0.00 0.00 0.00 0.28 -0.20 0.00 0.00 177.06 177.14 3kno h VAL 144 N 0.00 0.53 -0.26 1.69 2.07 -1.31 -1.30 116.25 117.67 3kno h VAL 144 Ca 0.00 -0.16 0.00 0.00 0.82 0.00 0.00 66.70 67.36 3kno h VAL 144 Cb 0.00 0.01 -0.01 0.00 -1.52 0.00 0.00 31.29 29.76 3kno h VAL 144 CO 0.00 0.09 0.17 0.00 0.02 0.00 0.00 177.57 177.85 3kno h ALA 145 N 1.67 0.33 -0.44 1.67 0.00 -1.61 -1.81 119.26 119.07 3kno h ALA 145 Ca 0.62 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 55.43 3kno h ALA 145 Cb 1.39 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 19.05 3kno h ALA 145 CO -0.38 -0.19 -0.05 0.00 0.00 0.00 0.00 179.25 178.63 3kno h ALA 146 N 1.09 1.08 0.00 0.00 0.00 -0.95 -1.41 119.26 119.07 3kno h ALA 146 Ca 0.10 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.72 3kno h ALA 146 Cb -0.04 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.57 3kno h ALA 146 CO -0.02 0.57 0.00 -0.91 0.00 0.00 0.00 179.25 178.89 3kno h ASN 147 N 0.70 0.00 0.07 0.00 -0.26 -0.47 0.44 115.58 116.05 3kno h ASN 147 Ca 0.13 0.00 -0.37 0.00 -0.56 0.00 0.00 56.30 55.50 3kno h ASN 147 Cb 0.50 0.00 -0.06 0.00 -1.06 0.00 0.00 38.32 37.70 3kno h ASN 147 CO 0.03 0.00 -2.31 -0.38 -1.06 0.00 0.00 177.43 173.71 3kno n ILE 148 N -2.61 1.51 -0.29 2.81 2.08 -0.71 -3.90 119.36 118.26 3kno n ILE 148 Ca -0.02 -0.69 -0.06 0.00 0.56 0.00 0.00 62.75 62.54 3kno n ILE 148 Cb 0.05 -1.13 0.06 0.00 -0.75 0.00 0.00 39.64 37.88 3kno n ILE 148 CO 0.00 0.00 0.00 -0.09 0.56 0.00 0.00 176.55 177.02 3kno h ARG 149 N 0.01 1.19 0.00 0.38 2.43 0.06 0.02 114.38 118.46 3kno h ARG 149 Ca -0.52 -0.22 0.00 0.00 -0.81 0.00 0.00 59.98 58.43 3kno h ARG 149 Cb 2.04 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 31.40 3kno h ARG 149 CO -0.01 0.97 0.00 0.00 -1.51 0.00 0.00 179.97 179.42 3kno h ALA 150 N 1.16 1.00 -0.00 2.80 0.00 -0.42 -2.36 119.26 121.45 3kno h ALA 150 Ca 0.26 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.17 3kno h ALA 150 Cb 0.24 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.03 3kno h ALA 150 CO -0.02 0.00 0.00 0.82 0.00 0.00 0.00 179.25 180.05 3kno h ILE 151 N 0.00 0.30 -1.92 0.00 1.08 -1.10 -3.36 117.51 112.51 3kno h ILE 151 Ca 0.00 0.00 -0.19 0.00 -0.39 0.00 0.00 64.86 64.28 3kno h ILE 151 Cb 0.31 1.00 -0.30 0.00 -3.07 0.00 0.00 36.82 34.75 3kno h ILE 151 CO 0.00 0.00 -0.52 -0.13 -0.69 0.00 0.00 178.15 176.81 3kno s ARG 152 N -4.42 0.35 -0.41 2.37 1.81 -0.89 -5.06 118.95 112.69 3kno s ARG 152 Ca -0.05 0.36 -0.39 0.00 -1.72 0.00 0.00 55.73 53.93 3kno s ARG 152 Cb 0.14 -0.52 -0.17 0.00 -0.45 0.00 0.00 34.95 33.96 3kno s ARG 152 CO 0.49 -0.76 1.33 0.36 -0.68 0.00 0.00 175.30 176.04 3kno n LYS 153 N 5.35 0.00 -0.31 3.54 0.00 -1.26 -3.04 118.16 122.45 3kno n LYS 153 Ca -0.03 0.00 0.12 0.00 -0.00 0.00 0.00 58.31 58.40 3kno n LYS 153 Cb 0.50 -1.26 0.23 0.00 -0.00 0.00 0.00 35.03 34.50 3kno n LYS 153 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.40 175.10 3kno n PRO 154 N 3.33 -0.07 -1.78 -1.58 -0.02 -1.26 -4.32 135.00 129.29 3kno n PRO 154 Ca 0.26 1.35 -0.05 0.00 -2.02 0.00 0.00 63.50 63.04 3kno n PRO 154 Cb -0.05 -2.12 0.01 0.00 -0.02 0.00 0.00 33.50 31.32 3kno n PRO 154 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3kno n SER 155 N -5.34 1.00 0.00 2.55 2.88 -1.26 -4.21 113.62 109.23 3kno n SER 155 Ca 0.20 -1.40 0.00 0.00 -1.33 0.00 0.00 58.87 56.33 3kno n SER 155 Cb 0.63 -0.05 0.00 0.00 -0.75 0.00 0.00 64.21 64.05 3kno n SER 155 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3kno n ALA 156 N -2.78 0.00 -2.99 -1.46 0.00 -1.26 -4.74 120.51 107.28 3kno n ALA 156 Ca -0.04 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.19 3kno n ALA 156 Cb 0.14 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.60 3kno n ALA 156 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 3kno n TYR 157 N 0.00 -1.74 -0.28 0.00 4.19 -1.26 -4.66 117.16 113.42 3kno n TYR 157 Ca 0.00 0.38 0.03 0.00 3.31 0.00 0.00 57.90 61.62 3kno n TYR 157 Cb 0.00 -3.69 -0.02 0.00 0.49 0.00 0.00 39.34 36.13 3kno n TYR 157 CO 0.00 0.00 0.00 0.72 0.91 0.00 0.00 176.86 178.49 3kno n HIS 158 N -4.11 -0.75 0.00 2.98 8.25 -1.26 -5.04 115.22 115.29 3kno n HIS 158 Ca -0.10 0.41 0.00 0.00 -0.26 0.00 0.00 57.72 57.77 3kno n HIS 158 Cb 0.60 -0.68 0.00 0.00 1.12 0.00 0.00 29.99 31.03 3kno n HIS 158 CO 0.00 0.00 0.00 -1.91 0.64 0.00 0.00 176.34 175.07 3kno n GLU 159 N -2.59 0.00 -1.01 -0.41 4.07 -1.26 -5.03 120.64 114.40 3kno n GLU 159 Ca -0.01 0.00 -0.29 0.00 -0.06 0.00 0.00 57.16 56.79 3kno n GLU 159 Cb 0.13 0.00 0.22 0.00 -0.06 0.00 0.00 31.44 31.73 3kno n GLU 159 CO 0.00 0.00 0.00 0.15 -0.06 0.00 0.00 177.13 177.22 3kno s LYS 160 N 0.00 -0.74 0.00 5.31 1.02 -1.26 -3.51 119.74 120.56 3kno s LYS 160 Ca 0.00 0.24 0.00 0.00 0.02 0.00 0.00 55.97 56.23 3kno s LYS 160 Cb 0.00 -1.63 0.00 0.00 -0.52 0.00 0.00 37.83 35.68 3kno s LYS 160 CO 0.00 -3.45 0.00 0.41 -0.92 0.00 0.00 175.35 171.39 3kno n GLY 161 N -0.67 1.35 3.86 -3.33 0.00 -1.26 -4.50 105.19 100.63 3kno n GLY 161 Ca 0.09 -2.07 -0.29 0.00 0.00 0.00 0.00 46.02 43.75 3kno n GLY 161 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3kno s ILE 162 N -1.75 4.95 0.26 -0.61 1.01 -1.17 -4.46 121.20 119.43 3kno s ILE 162 Ca 0.00 -0.68 -0.02 0.00 0.00 0.00 0.00 60.65 59.95 3kno s ILE 162 Cb 0.00 -3.45 -0.02 0.00 0.01 0.00 0.00 42.46 39.00 3kno s ILE 162 CO 0.00 0.05 0.29 -0.31 0.00 0.00 0.00 174.94 174.97 3kno s TYR 163 N -1.56 1.12 0.00 3.97 1.51 -1.15 -4.20 117.35 117.03 3kno s TYR 163 Ca 0.32 -1.30 0.00 0.00 -1.01 0.00 0.00 57.07 55.08 3kno s TYR 163 Cb -0.12 -0.37 0.00 0.00 -0.11 0.00 0.00 41.96 41.36 3kno s TYR 163 CO 0.25 -0.84 0.00 0.66 -1.11 0.00 0.00 175.55 174.51 3kno n TYR 164 N -0.42 0.00 -0.94 2.71 4.02 -1.26 -2.61 117.16 118.67 3kno n TYR 164 Ca 0.02 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.91 3kno n TYR 164 Cb 0.64 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.96 3kno n TYR 164 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 3kno n ALA 165 N -2.07 0.00 -1.00 -0.72 0.00 -1.26 -4.51 120.51 110.95 3kno n ALA 165 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3kno n ALA 165 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 3kno n ALA 165 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3kno n GLY 166 N 0.00 -0.56 3.31 0.00 0.00 -1.26 -5.10 105.19 101.58 3kno n GLY 166 Ca 0.00 -1.19 -0.11 0.00 0.00 0.00 0.00 46.02 44.72 3kno n GLY 166 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3kno s GLU 167 N 0.00 0.98 -0.84 1.61 2.02 -1.26 -5.12 118.70 116.09 3kno s GLU 167 Ca 0.00 -0.55 -0.26 0.00 0.02 0.00 0.00 54.97 54.18 3kno s GLU 167 Cb 0.00 0.43 0.04 0.00 0.10 0.00 0.00 34.13 34.70 3kno s GLU 167 CO 0.00 -0.36 1.35 -1.25 0.02 0.00 0.00 175.26 175.03 3kno s PRO 168 N -3.14 3.32 -0.78 0.39 0.04 -1.26 -4.96 135.00 128.62 3kno s PRO 168 Ca -0.01 -0.54 -0.25 0.00 0.04 0.00 0.00 61.00 60.24 3kno s PRO 168 Cb 0.01 -4.60 -0.15 0.00 0.04 0.00 0.00 34.50 29.80 3kno s PRO 168 CO -0.07 -2.19 2.41 1.55 0.04 0.00 0.00 177.00 178.74 3kno n VAL 169 N 6.58 -0.01 -0.11 -0.36 3.14 -1.26 -4.82 118.33 121.49 3kno n VAL 169 Ca 0.14 -0.52 -0.01 0.00 -2.96 0.00 0.00 64.34 60.99 3kno n VAL 169 Cb 0.50 -1.95 0.01 0.00 -1.06 0.00 0.00 33.84 31.33 3kno n VAL 169 CO 0.00 0.00 0.00 -2.11 -6.46 0.00 0.00 176.83 168.26 3kno n ARG 170 N 8.65 -0.07 0.00 1.45 0.00 -1.26 -4.99 116.66 120.44 3kno n ARG 170 Ca 0.47 0.44 0.00 0.00 -0.00 0.00 0.00 57.85 58.76 3kno n ARG 170 Cb 0.42 -0.65 0.00 0.00 -0.00 0.00 0.00 32.46 32.23 3kno n ARG 170 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.63 179.10