#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k67 h GLU 5 N 0.00 -0.07 -0.02 1.61 4.11 -2.08 -1.68 114.58 116.45 3k67 h GLU 5 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 3k67 h GLU 5 Cb 0.00 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.27 3k67 h GLU 5 CO 0.00 -0.05 -0.05 1.33 0.07 0.00 0.00 179.01 180.31 3k67 n VAL 6 N -5.10 0.00 0.04 -1.06 0.24 -1.26 -3.89 118.33 107.29 3k67 n VAL 6 Ca 0.01 -0.39 -0.17 0.00 -2.04 0.00 0.00 64.34 61.74 3k67 n VAL 6 Cb 0.26 1.15 -0.07 0.00 -1.47 0.00 0.00 33.84 33.71 3k67 n VAL 6 CO 0.00 0.00 0.00 0.50 -2.14 0.00 0.00 176.83 175.19 3k67 h LYS 7 N 3.71 0.63 -0.21 7.34 1.63 -1.92 -3.35 116.57 124.40 3k67 h LYS 7 Ca 0.00 -0.63 0.05 0.00 -0.85 0.00 0.00 60.65 59.22 3k67 h LYS 7 Cb 0.82 0.17 -0.05 0.00 -0.60 0.00 0.00 32.23 32.56 3k67 h LYS 7 CO 0.00 1.23 -0.13 1.98 -3.45 0.00 0.00 179.45 179.08 3k67 h MET 8 N 0.37 -0.11 -0.00 1.90 4.05 -1.43 0.70 114.93 120.41 3k67 h MET 8 Ca -0.10 0.01 -0.10 0.00 -0.28 0.00 0.00 59.70 59.23 3k67 h MET 8 Cb 1.58 0.03 -0.01 0.00 -0.80 0.00 0.00 31.60 32.40 3k67 h MET 8 CO 0.18 -0.08 -0.49 0.52 0.23 0.00 0.00 176.91 177.27 3k67 h MET 9 N -0.12 0.01 -0.32 0.39 2.86 -1.78 0.59 114.93 116.57 3k67 h MET 9 Ca 0.12 -0.00 -0.05 0.00 -2.06 0.00 0.00 59.70 57.70 3k67 h MET 9 Cb 0.29 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.94 3k67 h MET 9 CO -0.28 0.50 0.01 0.77 1.06 0.00 0.00 176.91 178.97 3k67 h SER 10 N 0.01 0.54 -0.48 1.22 0.02 -1.47 -1.85 113.55 111.54 3k67 h SER 10 Ca -0.00 -0.30 -0.00 0.00 -0.84 0.00 0.00 61.79 60.65 3k67 h SER 10 Cb 0.87 -0.14 -0.02 0.00 0.14 0.00 0.00 62.40 63.24 3k67 h SER 10 CO 0.06 0.71 0.30 0.25 -1.14 0.00 0.00 176.83 177.01 3k67 h LEU 11 N 0.35 0.57 -0.49 5.07 5.85 -0.34 -0.88 115.31 125.44 3k67 h LEU 11 Ca 0.09 -0.04 0.01 0.00 0.84 0.00 0.00 57.88 58.77 3k67 h LEU 11 Cb 0.42 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.28 3k67 h LEU 11 CO 0.01 0.45 0.32 0.25 -0.34 0.00 0.00 178.44 179.13 3k67 h LEU 12 N 0.65 0.55 -0.80 2.25 5.85 -0.87 0.88 115.31 123.82 3k67 h LEU 12 Ca 0.17 -0.01 -0.09 0.00 0.84 0.00 0.00 57.88 58.80 3k67 h LEU 12 Cb -0.03 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 40.85 3k67 h LEU 12 CO -0.03 0.39 -0.02 -0.08 -0.34 0.00 0.00 178.44 178.35 3k67 h GLU 13 N 0.65 0.88 -0.33 1.25 4.57 -1.03 -0.44 114.58 120.13 3k67 h GLU 13 Ca 0.18 -0.26 -0.06 0.00 -1.18 0.00 0.00 59.36 58.04 3k67 h GLU 13 Cb -0.06 -0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 28.43 3k67 h GLU 13 CO -0.05 0.89 -0.01 0.93 -1.18 0.00 0.00 179.01 179.59 3k67 h GLU 14 N 0.81 0.60 0.00 1.92 5.08 -0.84 -2.91 114.58 119.24 3k67 h GLU 14 Ca 0.15 -0.20 -0.07 0.00 -1.00 0.00 0.00 59.36 58.24 3k67 h GLU 14 Cb 0.52 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.71 3k67 h GLU 14 CO 0.03 0.73 -0.34 0.52 -1.00 0.00 0.00 179.01 178.95 3k67 h MET 15 N 0.40 0.00 -0.79 2.33 2.86 -0.57 -2.23 114.93 116.93 3k67 h MET 15 Ca 0.09 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.71 3k67 h MET 15 Cb 0.47 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 32.09 3k67 h MET 15 CO 0.02 0.34 0.41 -0.22 1.06 0.00 0.00 176.91 178.52 3k67 h LYS 16 N 0.00 1.12 -0.43 1.72 3.64 -0.89 0.98 116.57 122.71 3k67 h LYS 16 Ca -0.00 -0.14 -0.05 0.00 -1.27 0.00 0.00 60.65 59.19 3k67 h LYS 16 Cb 0.65 -0.21 -0.02 0.00 -0.41 0.00 0.00 32.23 32.24 3k67 h LYS 16 CO 0.04 0.84 0.08 0.78 -2.27 0.00 0.00 179.45 178.92 3k67 h GLY 17 N 1.15 0.75 0.93 5.01 0.00 -1.28 -0.94 103.07 108.69 3k67 h GLY 17 Ca 0.28 -0.49 -0.04 0.00 0.00 0.00 0.00 47.33 47.07 3k67 h GLY 17 CO -0.04 0.46 0.06 -2.22 0.00 0.00 0.00 176.54 174.80 3k67 h ILE 18 N 0.56 1.24 -0.27 2.60 2.04 -1.29 -1.76 117.51 120.63 3k67 h ILE 18 Ca 0.13 -0.85 0.04 0.00 1.00 0.00 0.00 64.86 65.18 3k67 h ILE 18 Cb 0.36 1.07 -0.04 0.00 -0.74 0.00 0.00 36.82 37.47 3k67 h ILE 18 CO 0.01 0.29 0.05 0.22 0.00 0.00 0.00 178.15 178.72 3k67 h TYR 19 N 0.47 0.09 -0.69 1.37 3.20 -0.76 -1.40 116.97 119.25 3k67 h TYR 19 Ca 0.11 0.02 -0.04 0.00 3.14 0.00 0.00 58.73 61.96 3k67 h TYR 19 Cb 0.36 0.00 -0.03 0.00 1.54 0.00 0.00 36.73 38.60 3k67 h TYR 19 CO 0.02 0.02 0.29 1.03 -1.64 0.00 0.00 178.16 177.89 3k67 h SER 20 N 0.16 0.94 0.15 -2.11 0.87 -1.09 -0.64 113.55 111.82 3k67 h SER 20 Ca 0.13 -0.16 -0.03 0.00 -1.23 0.00 0.00 61.79 60.50 3k67 h SER 20 Cb 0.13 -0.24 -0.00 0.00 -0.44 0.00 0.00 62.40 61.84 3k67 h SER 20 CO -0.17 0.84 -0.13 0.11 -0.53 0.00 0.00 176.83 176.96 3k67 h LYS 21 N 0.97 0.00 -0.53 2.24 1.57 -0.89 -1.33 116.57 118.60 3k67 h LYS 21 Ca 0.23 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.01 3k67 h LYS 21 Cb 0.19 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.50 3k67 h LYS 21 CO -0.02 0.13 0.00 1.63 -0.57 0.00 0.00 179.45 180.61 3k67 n LYS 22 N -4.27 2.39 -0.11 3.15 4.76 -0.57 -4.91 118.16 118.61 3k67 n LYS 22 Ca -0.03 -1.62 0.00 0.00 -2.87 0.00 0.00 58.31 53.80 3k67 n LYS 22 Cb 0.20 -1.53 0.00 0.00 -1.84 0.00 0.00 35.03 31.86 3k67 n LYS 22 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3k67 n GLY 23 N 0.91 0.74 3.79 0.72 0.00 -0.50 -4.49 105.19 106.36 3k67 n GLY 23 Ca 0.15 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.83 3k67 n GLY 23 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3k67 s GLY 24 N -1.54 2.42 -0.20 -0.02 0.00 -0.30 -4.91 107.32 102.78 3k67 s GLY 24 Ca 0.00 0.61 -0.13 0.00 0.00 0.00 0.00 44.72 45.20 3k67 s GLY 24 CO 0.00 0.95 0.27 0.54 0.00 0.00 0.00 173.10 174.86 3k67 s LYS 25 N -3.53 4.17 0.03 2.90 -0.14 -1.26 -4.38 119.74 117.52 3k67 s LYS 25 Ca 0.68 -0.01 0.04 0.00 -1.36 0.00 0.00 55.97 55.32 3k67 s LYS 25 Cb -0.19 -3.49 -0.02 0.00 -1.68 0.00 0.00 37.83 32.45 3k67 s LYS 25 CO 0.28 0.10 -0.13 0.08 -0.76 0.00 0.00 175.35 174.92 3k67 s VAL 26 N 0.90 1.04 0.14 3.17 1.01 -1.26 -5.05 120.40 120.35 3k67 s VAL 26 Ca 0.14 -0.87 -0.11 0.00 0.00 0.00 0.00 61.98 61.14 3k67 s VAL 26 Cb -0.13 -0.93 0.01 0.00 0.00 0.00 0.00 36.38 35.32 3k67 s VAL 26 CO 0.05 0.06 0.30 -1.59 0.00 0.00 0.00 175.10 173.92 3k67 s LYS 27 N -0.92 1.06 0.12 2.72 -2.85 -1.26 -5.12 119.74 113.49 3k67 s LYS 27 Ca 0.02 -0.98 -0.32 0.00 -1.00 0.00 0.00 55.97 53.69 3k67 s LYS 27 Cb -0.07 0.40 -0.11 0.00 -2.06 0.00 0.00 37.83 35.99 3k67 s LYS 27 CO 0.01 -0.39 1.82 -2.30 0.10 0.00 0.00 175.35 174.59 3k67 n PRO 28 N -0.18 2.74 -1.61 1.78 -0.02 -1.26 -4.93 135.00 131.52 3k67 n PRO 28 Ca -0.12 1.00 -0.44 0.00 -2.02 0.00 0.00 63.50 61.92 3k67 n PRO 28 Cb 0.63 -2.88 -0.04 0.00 -0.02 0.00 0.00 33.50 31.19 3k67 n PRO 28 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 3k67 n PHE 29 N 5.47 2.14 -4.29 6.00 7.35 -1.26 -5.01 117.46 127.86 3k67 n PHE 29 Ca 0.18 -0.16 -0.19 0.00 -0.76 0.00 0.00 57.45 56.52 3k67 n PHE 29 Cb 0.36 -2.73 -0.15 0.00 0.35 0.00 0.00 39.48 37.31 3k67 n PHE 29 CO 0.00 0.00 0.00 -1.21 -0.76 0.00 0.00 176.76 174.79 3k67 s GLU 30 N 5.53 0.79 0.40 -4.13 0.41 -1.26 -5.14 118.70 115.31 3k67 s GLU 30 Ca 0.97 -0.24 -0.24 0.00 -0.41 0.00 0.00 54.97 55.05 3k67 s GLU 30 Cb -0.44 -0.76 -0.09 0.00 -1.78 0.00 0.00 34.13 31.06 3k67 s GLU 30 CO 0.40 0.08 1.06 0.15 -0.49 0.00 0.00 175.26 176.46 3k67 s LYS 31 N 0.24 4.15 0.97 1.61 -0.14 -1.26 -4.85 119.74 120.46 3k67 s LYS 31 Ca -0.03 1.55 -0.12 0.00 -1.36 0.00 0.00 55.97 56.00 3k67 s LYS 31 Cb -0.08 -2.56 0.17 0.00 -1.68 0.00 0.00 37.83 33.68 3k67 s LYS 31 CO 0.00 -0.16 1.10 -0.06 -0.76 0.00 0.00 175.35 175.47 3k67 s PHE 32 N -1.63 2.21 0.24 3.18 2.99 0.16 -5.00 117.98 120.14 3k67 s PHE 32 Ca 0.58 0.98 0.06 0.00 0.00 0.00 0.00 56.93 58.54 3k67 s PHE 32 Cb -0.23 -3.28 -0.05 0.00 0.00 0.00 0.00 43.02 39.46 3k67 s PHE 32 CO 0.29 -2.74 -0.06 -1.21 -0.00 0.00 0.00 175.22 171.50 3k67 s GLU 33 N -5.03 1.41 0.00 0.44 2.02 -1.26 -3.79 118.70 112.48 3k67 s GLU 33 Ca 0.65 -1.70 0.00 0.00 0.02 0.00 0.00 54.97 53.94 3k67 s GLU 33 Cb -0.18 -0.93 0.00 0.00 0.10 0.00 0.00 34.13 33.12 3k67 s GLU 33 CO 0.57 0.02 0.00 0.41 0.02 0.00 0.00 175.26 176.27 3k67 n GLY 34 N -0.47 2.84 3.77 -1.39 0.00 -1.26 -4.92 105.19 103.76 3k67 n GLY 34 Ca -0.06 -1.86 -0.40 0.00 0.00 0.00 0.00 46.02 43.70 3k67 n GLY 34 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3k67 s GLU 35 N -3.41 4.23 -0.49 1.61 2.12 -1.26 -4.80 118.70 116.70 3k67 s GLU 35 Ca 0.00 2.04 -0.21 0.00 0.36 0.00 0.00 54.97 57.16 3k67 s GLU 35 Cb 0.00 -2.91 0.04 0.00 0.26 0.00 0.00 34.13 31.52 3k67 s GLU 35 CO 0.00 -0.24 0.69 -0.51 -0.54 0.00 0.00 175.26 174.67 3k67 s LEU 36 N -2.08 4.61 0.26 2.70 1.43 -1.26 -4.98 118.68 119.36 3k67 s LEU 36 Ca 0.52 -0.58 0.10 0.00 -1.03 0.00 0.00 54.13 53.14 3k67 s LEU 36 Cb -0.36 -2.63 -0.05 0.00 0.03 0.00 0.00 46.19 43.18 3k67 s LEU 36 CO 0.46 -0.91 -0.15 -0.54 0.23 0.00 0.00 176.35 175.44 3k67 s LYS 37 N 2.96 1.57 0.11 1.70 -0.14 -1.26 -5.04 119.74 119.63 3k67 s LYS 37 Ca 0.21 -1.73 -0.36 0.00 -1.36 0.00 0.00 55.97 52.73 3k67 s LYS 37 Cb -0.16 -1.46 -0.16 0.00 -1.68 0.00 0.00 37.83 34.37 3k67 s LYS 37 CO 0.16 0.22 1.40 -1.91 -0.76 0.00 0.00 175.35 174.46 3k67 n GLU 38 N -0.56 1.40 0.00 1.68 2.13 -1.26 -1.14 120.64 122.90 3k67 n GLU 38 Ca -0.06 0.51 0.00 0.00 0.66 0.00 0.00 57.16 58.27 3k67 n GLU 38 Cb 0.61 -2.18 0.00 0.00 0.27 0.00 0.00 31.44 30.14 3k67 n GLU 38 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3k67 n GLY 39 N 2.75 0.11 3.72 8.31 0.00 -0.00 -5.00 105.19 115.07 3k67 n GLY 39 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 3k67 n GLY 39 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3k67 s TYR 40 N -2.00 3.02 0.00 1.61 5.04 -0.29 -4.77 117.35 119.96 3k67 s TYR 40 Ca 0.00 0.65 0.06 0.00 -2.44 0.00 0.00 57.07 55.34 3k67 s TYR 40 Cb 0.00 -3.95 -0.02 0.00 0.35 0.00 0.00 41.96 38.35 3k67 s TYR 40 CO 0.00 -3.44 -0.18 1.03 -1.34 0.00 0.00 175.55 171.62 3k67 s ARG 41 N 0.85 1.37 0.09 4.97 0.52 -1.26 -0.56 118.95 124.92 3k67 s ARG 41 Ca 0.69 -0.70 -0.10 0.00 -0.52 0.00 0.00 55.73 55.10 3k67 s ARG 41 Cb -0.44 -1.36 0.01 0.00 0.52 0.00 0.00 34.95 33.67 3k67 s ARG 41 CO 0.34 0.36 0.23 -0.59 0.02 0.00 0.00 175.30 175.66 3k67 s PHE 42 N -0.53 0.07 0.02 -0.53 -0.12 -0.54 -5.01 117.98 111.36 3k67 s PHE 42 Ca 0.06 -0.45 0.02 0.00 -0.05 0.00 0.00 56.93 56.51 3k67 s PHE 42 Cb -0.07 0.00 -0.02 0.00 -0.63 0.00 0.00 43.02 42.30 3k67 s PHE 42 CO -0.00 -0.55 -0.06 -2.00 -0.05 0.00 0.00 175.22 172.56 3k67 s GLU 43 N -3.66 0.43 -0.20 1.99 -6.30 -1.26 -0.96 118.70 108.75 3k67 s GLU 43 Ca 0.03 -0.52 -0.15 0.00 -2.50 0.00 0.00 54.97 51.82 3k67 s GLU 43 Cb 0.04 -0.25 0.06 0.00 0.00 0.00 0.00 34.13 33.97 3k67 s GLU 43 CO -0.10 0.05 0.50 -0.47 0.02 0.00 0.00 175.26 175.26 3k67 s TYR 44 N -0.94 -0.63 0.05 5.30 5.04 -0.68 -4.99 117.35 120.51 3k67 s TYR 44 Ca -0.07 1.43 0.01 0.00 -2.44 0.00 0.00 57.07 56.00 3k67 s TYR 44 Cb -0.07 0.26 -0.03 0.00 0.35 0.00 0.00 41.96 42.47 3k67 s TYR 44 CO 0.00 -0.32 -0.05 -1.83 -1.34 0.00 0.00 175.55 172.01 3k67 s GLU 45 N 0.70 0.52 -0.18 4.97 -1.05 -1.26 0.12 118.70 122.52 3k67 s GLU 45 Ca -0.03 -0.89 -0.20 0.00 -0.15 0.00 0.00 54.97 53.70 3k67 s GLU 45 Cb -0.05 -0.06 0.05 0.00 -0.44 0.00 0.00 34.13 33.63 3k67 s GLU 45 CO -0.05 -0.02 0.54 0.21 0.95 0.00 0.00 175.26 176.89 3k67 s LYS 46 N -2.33 0.67 -0.10 -4.83 2.20 -0.62 -4.99 119.74 109.74 3k67 s LYS 46 Ca -0.05 0.67 -0.28 0.00 -0.36 0.00 0.00 55.97 55.95 3k67 s LYS 46 Cb -0.04 0.33 -0.02 0.00 -1.51 0.00 0.00 37.83 36.58 3k67 s LYS 46 CO -0.03 -0.10 0.93 0.21 -0.36 0.00 0.00 175.35 176.00 3k67 s LYS 47 N 0.08 4.42 -0.23 4.03 2.20 -1.26 -1.38 119.74 127.60 3k67 s LYS 47 Ca -0.02 1.25 -0.20 0.00 -0.36 0.00 0.00 55.97 56.65 3k67 s LYS 47 Cb -0.04 -3.53 -0.02 0.00 -1.51 0.00 0.00 37.83 32.73 3k67 s LYS 47 CO 0.02 -0.23 0.60 -0.51 -0.36 0.00 0.00 175.35 174.86 3k67 s LEU 48 N 1.75 4.09 0.43 5.43 1.43 -0.20 -4.73 118.68 126.87 3k67 s LEU 48 Ca 0.45 0.71 0.07 0.00 -1.03 0.00 0.00 54.13 54.33 3k67 s LEU 48 Cb -0.18 -2.82 -0.04 0.00 0.03 0.00 0.00 46.19 43.18 3k67 s LEU 48 CO 0.18 -0.31 0.19 0.00 0.23 0.00 0.00 176.35 176.64 3k67 h GLU 50 N 1.35 0.71 -0.26 0.00 4.81 -1.92 -0.41 114.58 118.87 3k67 h GLU 50 Ca -0.42 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 58.75 3k67 h GLU 50 Cb 1.26 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 30.47 3k67 h GLU 50 CO 0.69 0.47 0.07 0.97 -0.73 0.00 0.00 179.01 180.48 3k67 h ILE 51 N 0.73 1.12 -0.49 2.32 6.09 -1.92 -1.30 117.51 124.05 3k67 h ILE 51 Ca 0.42 -0.41 -0.07 0.00 -1.37 0.00 0.00 64.86 63.43 3k67 h ILE 51 Cb 0.46 0.85 -0.02 0.00 0.47 0.00 0.00 36.82 38.58 3k67 h ILE 51 CO -0.28 0.15 0.05 0.44 -3.07 0.00 0.00 178.15 175.43 3k67 h ASP 52 N 0.36 0.81 -0.27 2.19 3.32 -1.46 -0.18 116.42 121.20 3k67 h ASP 52 Ca 0.09 -0.28 -0.02 0.00 0.02 0.00 0.00 57.03 56.84 3k67 h ASP 52 Cb 0.13 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.45 3k67 h ASP 52 CO -0.01 0.89 0.10 0.58 -1.72 0.00 0.00 179.24 179.08 3k67 h VAL 53 N 0.71 1.18 -0.18 -1.35 2.07 -1.16 -0.38 116.25 117.14 3k67 h VAL 53 Ca 0.15 -0.57 0.00 0.00 0.82 0.00 0.00 66.70 67.10 3k67 h VAL 53 Cb 0.45 1.06 -0.01 0.00 -1.52 0.00 0.00 31.29 31.26 3k67 h VAL 53 CO 0.02 0.19 0.12 0.00 0.02 0.00 0.00 177.57 177.91 3k67 h ALA 54 N 0.94 0.22 -0.09 1.67 0.00 -1.14 -0.76 119.26 120.10 3k67 h ALA 54 Ca 0.09 -0.01 -0.15 0.00 0.00 0.00 0.00 54.91 54.84 3k67 h ALA 54 Cb 0.20 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 3k67 h ALA 54 CO -0.01 -0.30 -0.59 0.52 0.00 0.00 0.00 179.25 178.88 3k67 h MET 55 N 0.24 0.31 -0.70 0.00 2.07 -0.99 -1.40 114.93 114.46 3k67 h MET 55 Ca 0.06 -0.21 0.01 0.00 -2.07 0.00 0.00 59.70 57.49 3k67 h MET 55 Cb -0.03 0.03 -0.04 0.00 -1.87 0.00 0.00 31.60 29.70 3k67 h MET 55 CO -0.01 0.81 0.46 0.35 1.07 0.00 0.00 176.91 179.59 3k67 h PHE 56 N 0.23 0.88 -0.66 -0.22 3.04 -0.88 -0.64 116.94 118.69 3k67 h PHE 56 Ca -0.00 0.02 0.01 0.00 3.98 0.00 0.00 57.97 61.97 3k67 h PHE 56 Cb 1.10 -0.30 -0.03 0.00 2.56 0.00 0.00 35.95 39.28 3k67 h PHE 56 CO 0.03 0.55 0.44 0.78 -2.02 0.00 0.00 178.31 178.08 3k67 h GLY 57 N 0.94 0.93 0.87 2.40 0.00 -0.76 -1.72 103.07 105.74 3k67 h GLY 57 Ca 0.26 -0.34 -0.07 0.00 0.00 0.00 0.00 47.33 47.18 3k67 h GLY 57 CO -0.06 0.33 -0.09 1.41 0.00 0.00 0.00 176.54 178.14 3k67 h LEU 58 N 0.89 0.56 -0.62 3.11 3.38 -0.85 0.15 115.31 121.92 3k67 h LEU 58 Ca 0.24 -0.38 -0.14 0.00 0.09 0.00 0.00 57.88 57.69 3k67 h LEU 58 Cb -0.10 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.49 3k67 h LEU 58 CO -0.06 0.81 -0.46 0.16 0.09 0.00 0.00 178.44 178.99 3k67 h ILE 59 N 0.29 1.31 0.00 1.22 3.07 -1.03 -3.17 117.51 119.20 3k67 h ILE 59 Ca 0.07 -1.66 -0.23 0.00 1.55 0.00 0.00 64.86 64.59 3k67 h ILE 59 Cb 0.58 1.64 -0.04 0.00 -0.27 0.00 0.00 36.82 38.74 3k67 h ILE 59 CO 0.03 0.52 -1.36 0.77 -1.05 0.00 0.00 178.15 177.06 3k67 h SER 60 N 0.44 0.00 0.00 2.16 4.64 -1.34 -3.48 113.55 115.97 3k67 h SER 60 Ca 0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 3k67 h SER 60 Cb 0.97 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.06 3k67 h SER 60 CO 0.09 0.88 0.00 0.61 -0.87 0.00 0.00 176.83 177.53 3k67 n GLY 61 N 1.44 0.67 3.50 -0.77 0.00 0.50 -5.01 105.19 105.51 3k67 n GLY 61 Ca -0.09 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.50 3k67 n GLY 61 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3k67 s ASP 62 N -2.27 6.48 -0.50 1.61 -1.08 -1.03 -4.80 116.67 115.08 3k67 s ASP 62 Ca 0.00 -1.55 0.03 0.00 -0.52 0.00 0.00 52.55 50.51 3k67 s ASP 62 Cb 0.00 -2.47 0.53 0.00 -1.46 0.00 0.00 42.92 39.52 3k67 s ASP 62 CO 0.00 -1.34 1.82 0.18 0.52 0.00 0.00 175.17 176.35 3k67 n LEU 63 N 7.77 6.54 -4.63 -1.34 4.77 -1.26 -4.29 117.00 124.56 3k67 n LEU 63 Ca 0.21 -4.05 -0.52 0.00 -0.03 0.00 0.00 56.01 51.62 3k67 n LEU 63 Cb 0.49 -0.81 -0.06 0.00 -2.33 0.00 0.00 43.42 40.71 3k67 n LEU 63 CO 0.60 1.38 1.05 -3.20 -1.33 0.00 0.00 177.39 175.89 3k67 n ASN 64 N -1.00 2.08 0.29 -1.43 2.85 -1.26 -4.82 115.26 111.97 3k67 n ASN 64 Ca 0.55 1.10 0.18 0.00 -0.11 0.00 0.00 54.58 56.30 3k67 n ASN 64 Cb 1.08 -1.22 0.98 0.00 1.24 0.00 0.00 39.78 41.86 3k67 n ASN 64 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 3k67 h PRO 65 N 5.49 0.00 -0.53 1.20 0.11 -1.96 -0.61 132.00 135.70 3k67 h PRO 65 Ca -0.47 0.00 0.14 0.00 0.11 0.00 0.00 66.00 65.78 3k67 h PRO 65 Cb 1.32 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.40 3k67 h PRO 65 CO 0.84 0.00 0.38 0.28 -0.21 0.00 0.00 178.00 179.28 3k67 h VAL 66 N 0.00 0.77 0.00 3.15 2.07 -1.87 -0.05 116.25 120.32 3k67 h VAL 66 Ca 0.02 -0.03 0.00 0.00 0.82 0.00 0.00 66.70 67.51 3k67 h VAL 66 Cb 0.16 0.67 0.00 0.00 -1.52 0.00 0.00 31.29 30.60 3k67 h VAL 66 CO -0.00 0.02 -1.16 1.41 0.02 0.00 0.00 177.57 177.86 3k67 n HIS 67 N -4.41 0.19 0.00 1.57 8.25 -0.24 -2.29 115.22 118.30 3k67 n HIS 67 Ca 0.10 0.06 0.00 0.00 -0.26 0.00 0.00 57.72 57.61 3k67 n HIS 67 Cb 0.54 -0.38 0.00 0.00 1.12 0.00 0.00 29.99 31.27 3k67 n HIS 67 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 3k67 n PHE 68 N -1.94 0.00 -3.58 4.41 3.72 -0.82 -4.67 117.46 114.58 3k67 n PHE 68 Ca 0.01 0.00 -0.41 0.00 -0.05 0.00 0.00 57.45 57.01 3k67 n PHE 68 Cb 0.44 0.00 -0.10 0.00 -0.94 0.00 0.00 39.48 38.88 3k67 n PHE 68 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 3k67 s ASP 69 N -3.38 5.73 0.18 4.37 -1.08 -0.09 -4.97 116.67 117.41 3k67 s ASP 69 Ca 0.00 -1.29 -0.14 0.00 -0.52 0.00 0.00 52.55 50.60 3k67 s ASP 69 Cb 0.00 -2.02 0.07 0.00 -1.46 0.00 0.00 42.92 39.51 3k67 s ASP 69 CO 0.00 -0.49 1.84 -0.08 0.52 0.00 0.00 175.17 176.96 3k67 h GLU 70 N 8.46 0.70 -0.65 4.34 4.57 -1.95 -0.20 114.58 129.84 3k67 h GLU 70 Ca -0.24 -0.04 -0.07 0.00 -1.18 0.00 0.00 59.36 57.82 3k67 h GLU 70 Cb 1.09 -0.16 -0.03 0.00 -0.16 0.00 0.00 28.75 29.50 3k67 h GLU 70 CO 0.74 0.46 0.13 -0.44 -1.18 0.00 0.00 179.01 178.72 3k67 h ASP 71 N 0.72 1.01 -0.21 1.04 5.19 -1.96 -1.49 116.42 120.72 3k67 h ASP 71 Ca 0.20 -0.25 -0.04 0.00 -0.62 0.00 0.00 57.03 56.32 3k67 h ASP 71 Cb -0.07 -0.27 -0.01 0.00 0.18 0.00 0.00 39.33 39.16 3k67 h ASP 71 CO -0.05 1.00 -0.04 0.15 -3.12 0.00 0.00 179.24 177.19 3k67 h PHE 72 N 0.98 0.44 -0.03 4.55 3.04 -1.85 -3.21 116.94 120.87 3k67 h PHE 72 Ca 0.20 -0.09 -0.10 0.00 3.98 0.00 0.00 57.97 61.96 3k67 h PHE 72 Cb 0.40 -0.11 -0.01 0.00 2.56 0.00 0.00 35.95 38.79 3k67 h PHE 72 CO 0.03 0.62 -0.45 0.00 -2.02 0.00 0.00 178.31 176.49 3k67 h ALA 73 N 0.76 1.19 0.00 2.41 0.00 -0.91 -2.19 119.26 120.52 3k67 h ALA 73 Ca 0.06 -0.42 -0.01 0.00 0.00 0.00 0.00 54.91 54.53 3k67 h ALA 73 Cb 0.47 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.18 3k67 h ALA 73 CO 0.02 0.58 -0.06 0.66 0.00 0.00 0.00 179.25 180.45 3k67 h SER 74 N 0.05 0.00 0.14 0.00 4.64 -1.27 -1.53 113.55 115.58 3k67 h SER 74 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3k67 h SER 74 Cb 0.83 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.92 3k67 h SER 74 CO 0.06 0.06 -0.04 0.29 -0.87 0.00 0.00 176.83 176.34 3k67 n LYS 75 N -4.24 1.04 -2.47 4.77 5.02 -0.82 -4.13 118.16 117.33 3k67 n LYS 75 Ca -0.03 -0.33 -0.23 0.00 -2.02 0.00 0.00 58.31 55.70 3k67 n LYS 75 Cb 0.15 -1.49 0.07 0.00 -0.02 0.00 0.00 35.03 33.73 3k67 n LYS 75 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 3k67 s THR 76 N -2.18 2.40 -0.83 -0.18 -4.23 -0.59 -4.96 115.64 105.06 3k67 s THR 76 Ca 0.38 -0.51 0.09 0.00 -1.18 0.00 0.00 61.69 60.48 3k67 s THR 76 Cb 0.21 -2.90 0.09 0.00 1.34 0.00 0.00 72.50 71.24 3k67 s THR 76 CO 0.40 0.00 1.29 -2.11 -0.54 0.00 0.00 174.62 173.66 3k67 n ARG 77 N -2.68 0.04 0.19 3.99 1.85 -1.26 -2.04 116.66 116.74 3k67 n ARG 77 Ca 0.10 0.44 0.13 0.00 -1.00 0.00 0.00 57.85 57.52 3k67 n ARG 77 Cb 0.60 -1.60 0.32 0.00 -1.05 0.00 0.00 32.46 30.73 3k67 n ARG 77 CO 0.00 0.00 0.00 0.74 -0.01 0.00 0.00 177.63 178.36 3k67 h PHE 78 N 0.00 0.00 -1.36 2.89 0.04 -1.89 -3.47 116.94 113.15 3k67 h PHE 78 Ca 0.00 0.00 -0.34 0.00 2.80 0.00 0.00 57.97 60.43 3k67 h PHE 78 Cb 0.10 0.00 -0.09 0.00 2.20 0.00 0.00 35.95 38.16 3k67 h PHE 78 CO 0.00 0.00 -0.35 0.41 -0.60 0.00 0.00 178.31 177.77 3k67 n GLY 79 N 0.97 0.95 0.00 -1.45 0.00 -0.87 -4.82 105.19 99.98 3k67 n GLY 79 Ca 0.04 -0.21 0.00 0.00 0.00 0.00 0.00 46.02 45.85 3k67 n GLY 79 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3k67 n GLY 80 N -0.96 0.78 3.77 -0.02 0.00 -1.11 -4.64 105.19 103.00 3k67 n GLY 80 Ca -0.18 -1.38 -0.35 0.00 0.00 0.00 0.00 46.02 44.12 3k67 n GLY 80 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3k67 s ARG 81 N -1.87 3.18 0.11 1.61 0.52 -1.26 -4.54 118.95 116.70 3k67 s ARG 81 Ca 0.00 1.57 0.07 0.00 -0.52 0.00 0.00 55.73 56.85 3k67 s ARG 81 Cb 0.00 -1.98 -0.04 0.00 0.52 0.00 0.00 34.95 33.45 3k67 s ARG 81 CO 0.00 -0.98 -0.16 0.14 0.02 0.00 0.00 175.30 174.32 3k67 s VAL 82 N -1.90 1.42 0.73 3.52 -7.23 -0.97 -4.74 120.40 111.23 3k67 s VAL 82 Ca 0.72 -1.61 -0.11 0.00 -1.81 0.00 0.00 61.98 59.17 3k67 s VAL 82 Cb -0.24 -1.46 0.03 0.00 0.56 0.00 0.00 36.38 35.27 3k67 s VAL 82 CO 0.31 -0.28 1.07 0.68 -0.31 0.00 0.00 175.10 176.57 3k67 s VAL 83 N -1.71 3.67 0.27 1.32 -7.23 0.30 -3.97 120.40 113.05 3k67 s VAL 83 Ca 0.07 0.54 -0.31 0.00 -1.81 0.00 0.00 61.98 60.47 3k67 s VAL 83 Cb -0.07 -3.28 -0.12 0.00 0.56 0.00 0.00 36.38 33.47 3k67 s VAL 83 CO 0.04 -0.71 1.65 -1.00 -0.31 0.00 0.00 175.10 174.77 3k67 s HIS 84 N -3.08 2.79 0.32 2.82 3.76 -1.26 -4.74 115.29 115.90 3k67 s HIS 84 Ca 0.59 0.61 0.05 0.00 -0.15 0.00 0.00 55.06 56.16 3k67 s HIS 84 Cb -0.14 -4.11 0.68 0.00 1.11 0.00 0.00 32.58 30.12 3k67 s HIS 84 CO 0.55 -3.91 1.86 0.78 -0.85 0.00 0.00 174.74 173.17 3k67 h GLY 85 N 5.50 1.39 2.00 -2.22 0.00 -1.97 -0.45 103.07 107.33 3k67 h GLY 85 Ca -0.46 -0.36 0.00 0.00 0.00 0.00 0.00 47.33 46.51 3k67 h GLY 85 CO 0.85 0.14 0.00 -0.33 0.00 0.00 0.00 176.54 177.20 3k67 h MET 86 N 0.85 0.00 -0.13 4.80 2.86 -1.98 -2.09 114.93 119.23 3k67 h MET 86 Ca 0.46 0.00 -0.05 0.00 -2.06 0.00 0.00 59.70 58.05 3k67 h MET 86 Cb 0.57 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.23 3k67 h MET 86 CO -0.22 0.00 -0.12 1.25 1.06 0.00 0.00 176.91 178.87 3k67 h LEU 87 N 0.00 0.34 -0.39 1.22 5.85 -1.45 -1.94 115.31 118.93 3k67 h LEU 87 Ca 0.00 -0.48 0.08 0.00 0.84 0.00 0.00 57.88 58.32 3k67 h LEU 87 Cb 0.64 -0.09 -0.08 0.00 0.37 0.00 0.00 40.66 41.50 3k67 h LEU 87 CO 0.00 0.74 -0.10 0.74 -0.34 0.00 0.00 178.44 179.48 3k67 h THR 88 N -0.07 0.60 -0.00 1.05 2.02 -1.08 -1.98 112.91 113.45 3k67 h THR 88 Ca 0.02 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.20 3k67 h THR 88 Cb 0.64 0.60 0.00 0.00 -1.74 0.00 0.00 68.15 67.65 3k67 h THR 88 CO 0.03 0.00 -0.06 0.35 0.37 0.00 0.00 175.52 176.21 3k67 n THR 89 N -5.31 0.00 0.27 3.16 -2.24 -0.84 -2.53 114.28 106.79 3k67 n THR 89 Ca 0.02 -0.04 0.15 0.00 -2.27 0.00 0.00 64.05 61.91 3k67 n THR 89 Cb 0.22 -0.25 0.77 0.00 -2.10 0.00 0.00 70.33 68.97 3k67 n THR 89 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 3k67 h SER 90 N 0.37 0.00 0.35 3.42 0.02 -0.54 -0.49 113.55 116.68 3k67 h SER 90 Ca 0.00 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 60.92 3k67 h SER 90 Cb 0.30 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.83 3k67 h SER 90 CO 0.00 0.09 -0.12 -0.07 -1.14 0.00 0.00 176.83 175.59 3k67 h LEU 91 N 0.00 0.00 -0.70 5.07 3.38 -1.56 -1.79 115.31 119.71 3k67 h LEU 91 Ca -0.00 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.86 3k67 h LEU 91 Cb 0.34 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.07 3k67 h LEU 91 CO 0.01 0.12 -0.17 0.58 0.09 0.00 0.00 178.44 179.07 3k67 h VAL 92 N 0.00 1.27 -0.36 1.22 2.07 -1.27 -0.85 116.25 118.31 3k67 h VAL 92 Ca -0.00 -1.28 0.04 0.00 0.82 0.00 0.00 66.70 66.28 3k67 h VAL 92 Cb 0.33 1.12 -0.04 0.00 -1.52 0.00 0.00 31.29 31.19 3k67 h VAL 92 CO 0.02 0.43 0.14 -1.28 0.02 0.00 0.00 177.57 176.90 3k67 h SER 93 N 0.72 0.17 -0.53 0.57 0.87 -1.38 -0.96 113.55 113.01 3k67 h SER 93 Ca 0.11 0.03 -0.04 0.00 -1.23 0.00 0.00 61.79 60.66 3k67 h SER 93 Cb 0.68 0.01 -0.03 0.00 -0.44 0.00 0.00 62.40 62.63 3k67 h SER 93 CO 0.05 0.13 0.19 0.00 -0.53 0.00 0.00 176.83 176.68 3k67 h ALA 94 N 1.22 1.25 0.15 6.23 0.00 -1.28 -0.42 119.26 126.43 3k67 h ALA 94 Ca 0.16 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 3k67 h ALA 94 Cb 0.12 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.68 3k67 h ALA 94 CO -0.15 0.54 -0.07 0.00 0.00 0.00 0.00 179.25 179.56 3k67 h ALA 95 N 1.37 -0.21 0.00 0.00 0.00 -0.68 -3.11 119.26 116.63 3k67 h ALA 95 Ca 0.19 -0.14 -0.08 0.00 0.00 0.00 0.00 54.91 54.88 3k67 h ALA 95 Cb 0.22 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 3k67 h ALA 95 CO -0.01 -0.49 -0.36 -0.39 0.00 0.00 0.00 179.25 177.99 3k67 h VAL 96 N -0.45 0.97 0.00 0.00 -1.51 -1.06 -2.61 116.25 111.59 3k67 h VAL 96 Ca -0.02 -1.39 -0.00 0.00 -1.23 0.00 0.00 66.70 64.05 3k67 h VAL 96 Cb 0.36 1.82 -0.00 0.00 -2.13 0.00 0.00 31.29 31.34 3k67 h VAL 96 CO 0.03 0.36 -0.02 0.00 -1.23 0.00 0.00 177.57 176.71 3k67 h ALA 97 N 1.64 1.28 -0.00 5.19 0.00 -1.01 -1.07 119.26 125.29 3k67 h ALA 97 Ca -0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3k67 h ALA 97 Cb 0.79 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.58 3k67 h ALA 97 CO 0.05 0.03 -0.16 0.54 0.00 0.00 0.00 179.25 179.70 3k67 n ARG 98 N -3.52 0.26 -1.93 0.00 1.74 -0.98 -4.81 116.66 107.43 3k67 n ARG 98 Ca -0.03 -0.08 -0.37 0.00 -0.77 0.00 0.00 57.85 56.60 3k67 n ARG 98 Cb 0.12 -1.50 0.03 0.00 -1.02 0.00 0.00 32.46 30.09 3k67 n ARG 98 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3k67 s LEU 99 N -2.79 3.77 0.45 0.55 1.43 -0.41 0.37 118.68 122.05 3k67 s LEU 99 Ca 0.19 2.55 -0.25 0.00 -1.03 0.00 0.00 54.13 55.59 3k67 s LEU 99 Cb 0.19 -4.43 -0.08 0.00 0.03 0.00 0.00 46.19 41.90 3k67 s LEU 99 CO 0.55 -1.54 1.37 -2.16 0.23 0.00 0.00 176.35 174.79 3k67 s PRO 100 N -3.08 3.72 0.00 1.29 0.04 -1.25 -4.75 135.00 130.97 3k67 s PRO 100 Ca 0.74 2.29 0.00 0.00 0.04 0.00 0.00 61.00 64.07 3k67 s PRO 100 Cb -0.35 -2.64 0.00 0.00 0.04 0.00 0.00 34.50 31.55 3k67 s PRO 100 CO 0.40 -0.74 0.00 0.41 0.04 0.00 0.00 177.00 177.11 3k67 n GLY 101 N 0.62 -3.46 3.55 0.56 0.00 -1.26 -4.90 105.19 100.30 3k67 n GLY 101 Ca 0.05 -2.11 -0.41 0.00 0.00 0.00 0.00 46.02 43.55 3k67 n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3k67 s THR 102 N -0.73 5.12 -0.11 2.61 2.01 -0.22 -4.91 115.64 119.41 3k67 s THR 102 Ca 0.00 0.17 -0.03 0.00 0.31 0.00 0.00 61.69 62.14 3k67 s THR 102 Cb 0.00 -3.86 -0.03 0.00 0.01 0.00 0.00 72.50 68.62 3k67 s THR 102 CO 0.00 -0.11 0.01 -0.69 -0.69 0.00 0.00 174.62 173.13 3k67 s VAL 103 N 2.13 4.32 0.01 3.82 1.01 -1.26 -0.89 120.40 129.55 3k67 s VAL 103 Ca 0.14 -0.23 0.00 0.00 0.00 0.00 0.00 61.98 61.89 3k67 s VAL 103 Cb -0.16 -2.85 -0.01 0.00 0.00 0.00 0.00 36.38 33.36 3k67 s VAL 103 CO 0.12 0.57 -0.02 0.68 0.00 0.00 0.00 175.10 176.45 3k67 s VAL 104 N -0.50 0.10 0.02 2.92 -7.23 -0.19 -4.97 120.40 110.54 3k67 s VAL 104 Ca 0.09 -0.38 -0.30 0.00 -1.81 0.00 0.00 61.98 59.58 3k67 s VAL 104 Cb -0.12 -0.15 -0.04 0.00 0.56 0.00 0.00 36.38 36.62 3k67 s VAL 104 CO 0.02 -0.18 1.12 -0.22 -0.31 0.00 0.00 175.10 175.54 3k67 s LEU 105 N -0.58 4.35 -0.25 1.32 2.96 -1.26 -0.84 118.68 124.39 3k67 s LEU 105 Ca -0.06 1.85 0.04 0.00 -0.22 0.00 0.00 54.13 55.75 3k67 s LEU 105 Cb -0.04 -3.57 -0.18 0.00 0.50 0.00 0.00 46.19 42.90 3k67 s LEU 105 CO -0.00 -0.42 -0.19 0.18 -1.32 0.00 0.00 176.35 174.59 3k67 n LEU 106 N 4.17 2.62 -3.70 -0.68 4.77 0.17 -4.89 117.00 119.46 3k67 n LEU 106 Ca 0.08 -0.12 -0.14 0.00 -0.03 0.00 0.00 56.01 55.80 3k67 n LEU 106 Cb 0.48 -0.73 -0.08 0.00 -2.33 0.00 0.00 43.42 40.76 3k67 n LEU 106 CO 0.54 0.88 0.13 -0.70 -1.33 0.00 0.00 177.39 176.91 3k67 s GLU 107 N -2.51 0.74 -0.03 3.23 2.12 -0.82 -4.95 118.70 116.49 3k67 s GLU 107 Ca -0.31 0.01 -0.06 0.00 0.36 0.00 0.00 54.97 54.96 3k67 s GLU 107 Cb 0.08 0.34 0.01 0.00 0.26 0.00 0.00 34.13 34.82 3k67 s GLU 107 CO 0.62 -0.20 0.14 1.14 -0.54 0.00 0.00 175.26 176.42 3k67 s GLN 108 N -1.11 0.32 -0.08 4.30 -2.07 -1.26 -1.05 119.66 118.71 3k67 s GLN 108 Ca -0.11 -0.08 -0.03 0.00 -1.82 0.00 0.00 55.36 53.32 3k67 s GLN 108 Cb -0.04 0.14 0.04 0.00 -1.09 0.00 0.00 33.01 32.06 3k67 s GLN 108 CO 0.05 -0.06 0.15 -1.12 -1.32 0.00 0.00 175.29 172.99 3k67 s SER 109 N -0.61 0.66 0.01 12.60 0.01 -0.04 -5.01 113.70 121.33 3k67 s SER 109 Ca -0.07 0.30 0.01 0.00 1.31 0.00 0.00 55.95 57.50 3k67 s SER 109 Cb -0.04 0.22 -0.01 0.00 0.21 0.00 0.00 66.02 66.40 3k67 s SER 109 CO 0.01 -0.23 -0.03 -0.36 0.41 0.00 0.00 173.24 173.03 3k67 s PHE 110 N 2.12 0.29 -0.12 2.43 0.40 -1.26 -1.13 117.98 120.71 3k67 s PHE 110 Ca 0.01 -0.16 -0.04 0.00 -0.60 0.00 0.00 56.93 56.14 3k67 s PHE 110 Cb -0.12 -0.18 -0.04 0.00 0.51 0.00 0.00 43.02 43.19 3k67 s PHE 110 CO -0.05 -0.04 0.05 1.03 0.70 0.00 0.00 175.22 176.91 3k67 s ARG 111 N -0.43 3.34 -0.30 0.44 0.52 -0.23 -4.95 118.95 117.35 3k67 s ARG 111 Ca -0.03 -0.32 -0.11 0.00 -0.52 0.00 0.00 55.73 54.75 3k67 s ARG 111 Cb -0.03 -2.99 -0.03 0.00 0.52 0.00 0.00 34.95 32.41 3k67 s ARG 111 CO -0.00 0.62 0.19 0.71 0.02 0.00 0.00 175.30 176.84 3k67 s TYR 112 N -0.63 3.20 -0.10 -0.53 2.02 -1.26 -1.30 117.35 118.75 3k67 s TYR 112 Ca 0.11 -0.11 0.14 0.00 -0.37 0.00 0.00 57.07 56.84 3k67 s TYR 112 Cb -0.12 -2.39 -0.21 0.00 -0.40 0.00 0.00 41.96 38.85 3k67 s TYR 112 CO 0.02 -0.27 0.16 0.25 -1.57 0.00 0.00 175.55 174.14 3k67 n THR 113 N 5.05 0.66 -3.61 -0.71 -2.24 -0.45 -4.99 114.28 107.98 3k67 n THR 113 Ca -0.14 -0.54 -0.15 0.00 -2.27 0.00 0.00 64.05 60.95 3k67 n THR 113 Cb 0.51 -0.34 -0.07 0.00 -2.10 0.00 0.00 70.33 68.33 3k67 n THR 113 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 3k67 s SER 114 N -4.48 -0.65 0.64 3.42 0.15 -1.22 -4.99 113.70 106.57 3k67 s SER 114 Ca -0.07 1.07 -0.14 0.00 0.70 0.00 0.00 55.95 57.51 3k67 s SER 114 Cb 0.06 1.04 -0.01 0.00 -1.71 0.00 0.00 66.02 65.40 3k67 s SER 114 CO 0.63 -0.36 1.07 -2.16 1.20 0.00 0.00 173.24 173.62 3k67 s PRO 115 N -0.23 3.04 0.03 5.44 0.04 -1.26 -4.69 135.00 137.37 3k67 s PRO 115 Ca -0.04 1.19 0.05 0.00 0.04 0.00 0.00 61.00 62.24 3k67 s PRO 115 Cb -0.03 -2.00 -0.03 0.00 0.04 0.00 0.00 34.50 32.48 3k67 s PRO 115 CO 0.04 -1.03 -0.13 0.08 0.04 0.00 0.00 177.00 176.00 3k67 s VAL 116 N -2.59 3.18 0.20 -0.36 1.01 -1.26 -5.03 120.40 115.55 3k67 s VAL 116 Ca 0.63 -1.02 0.11 0.00 0.00 0.00 0.00 61.98 61.70 3k67 s VAL 116 Cb -0.17 -2.37 -0.04 0.00 0.00 0.00 0.00 36.38 33.80 3k67 s VAL 116 CO 0.43 0.35 -0.23 -0.13 0.00 0.00 0.00 175.10 175.52 3k67 s ARG 117 N -1.47 1.51 0.20 2.72 0.52 -1.26 -0.54 118.95 120.64 3k67 s ARG 117 Ca 0.16 -1.55 -0.32 0.00 -0.52 0.00 0.00 55.73 53.49 3k67 s ARG 117 Cb -0.11 -1.77 -0.14 0.00 0.52 0.00 0.00 34.95 33.45 3k67 s ARG 117 CO 0.07 0.37 1.36 -0.89 0.02 0.00 0.00 175.30 176.23 3k67 n ILE 118 N 0.12 0.74 0.00 1.52 5.41 -1.26 -1.30 119.36 124.58 3k67 n ILE 118 Ca -0.11 -0.18 0.00 0.00 1.00 0.00 0.00 62.75 63.45 3k67 n ILE 118 Cb 0.57 -1.28 0.00 0.00 -0.71 0.00 0.00 39.64 38.22 3k67 n ILE 118 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3k67 n GLY 119 N 2.32 1.09 3.76 7.39 0.00 0.58 -5.02 105.19 115.31 3k67 n GLY 119 Ca 0.14 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.76 3k67 n GLY 119 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3k67 s ASP 120 N -1.87 7.19 -0.25 1.61 1.01 -0.42 -4.73 116.67 119.21 3k67 s ASP 120 Ca 0.00 2.19 -0.21 0.00 0.71 0.00 0.00 52.55 55.24 3k67 s ASP 120 Cb 0.00 -2.62 -0.02 0.00 1.01 0.00 0.00 42.92 41.30 3k67 s ASP 120 CO 0.00 -0.19 0.68 -0.69 0.21 0.00 0.00 175.17 175.18 3k67 s VAL 121 N -1.27 4.95 -0.20 -1.27 1.01 -1.26 -1.04 120.40 121.32 3k67 s VAL 121 Ca 0.47 1.24 -0.10 0.00 0.00 0.00 0.00 61.98 63.60 3k67 s VAL 121 Cb -0.29 -3.98 -0.05 0.00 0.00 0.00 0.00 36.38 32.06 3k67 s VAL 121 CO 0.37 0.01 0.12 -0.69 0.00 0.00 0.00 175.10 174.91 3k67 s VAL 122 N 2.53 5.31 -0.19 2.92 1.01 -0.48 -4.35 120.40 127.15 3k67 s VAL 122 Ca 0.29 0.15 -0.03 0.00 0.00 0.00 0.00 61.98 62.39 3k67 s VAL 122 Cb -0.15 -3.42 -0.01 0.00 0.00 0.00 0.00 36.38 32.79 3k67 s VAL 122 CO 0.08 0.44 -0.07 -0.60 0.00 0.00 0.00 175.10 174.96 3k67 s ARG 123 N 0.38 3.39 -0.17 2.72 3.52 0.24 -1.59 118.95 127.44 3k67 s ARG 123 Ca 0.07 -0.64 -0.16 0.00 -0.13 0.00 0.00 55.73 54.87 3k67 s ARG 123 Cb -0.11 -2.90 -0.04 0.00 -1.56 0.00 0.00 34.95 30.34 3k67 s ARG 123 CO -0.02 -0.07 0.41 0.08 -0.81 0.00 0.00 175.30 174.90 3k67 s VAL 124 N 1.11 5.21 -0.18 7.11 1.01 0.12 -0.46 120.40 134.33 3k67 s VAL 124 Ca 0.01 0.76 0.01 0.00 0.00 0.00 0.00 61.98 62.76 3k67 s VAL 124 Cb -0.15 -3.74 0.02 0.00 0.00 0.00 0.00 36.38 32.51 3k67 s VAL 124 CO -0.01 0.30 -0.19 -1.61 0.00 0.00 0.00 175.10 173.59 3k67 s GLU 125 N 0.94 3.04 0.10 2.72 0.41 0.20 -1.68 118.70 124.43 3k67 s GLU 125 Ca 0.21 -0.81 0.09 0.00 -0.41 0.00 0.00 54.97 54.05 3k67 s GLU 125 Cb -0.14 -2.59 -0.04 0.00 -1.78 0.00 0.00 34.13 29.57 3k67 s GLU 125 CO 0.08 -0.18 -0.22 0.20 -0.49 0.00 0.00 175.26 174.65 3k67 s GLY 126 N 1.23 1.60 -0.07 -1.39 0.00 -0.14 -1.45 107.32 107.12 3k67 s GLY 126 Ca 0.03 -1.35 -0.00 0.00 0.00 0.00 0.00 44.72 43.40 3k67 s GLY 126 CO -0.10 -1.30 -0.03 0.14 0.00 0.00 0.00 173.10 171.80 3k67 s VAL 127 N -1.04 0.55 -0.13 1.40 1.01 -0.24 -1.46 120.40 120.49 3k67 s VAL 127 Ca 0.15 -0.04 -0.29 0.00 0.00 0.00 0.00 61.98 61.80 3k67 s VAL 127 Cb -0.10 -0.64 -0.03 0.00 0.00 0.00 0.00 36.38 35.61 3k67 s VAL 127 CO 0.07 0.27 1.43 -0.69 0.00 0.00 0.00 175.10 176.17 3k67 s VAL 128 N 1.55 3.99 -0.17 2.92 1.01 0.27 -0.84 120.40 129.13 3k67 s VAL 128 Ca -0.01 1.19 0.18 0.00 0.00 0.00 0.00 61.98 63.35 3k67 s VAL 128 Cb -0.13 -3.78 -0.26 0.00 0.00 0.00 0.00 36.38 32.20 3k67 s VAL 128 CO -0.04 -0.12 0.46 -1.54 0.00 0.00 0.00 175.10 173.86 3k67 n SER 129 N 6.89 0.87 -3.54 3.32 3.41 0.51 -0.82 113.62 124.27 3k67 n SER 129 Ca 0.15 -0.17 -0.17 0.00 -0.26 0.00 0.00 58.87 58.42 3k67 n SER 129 Cb 0.44 1.67 -0.06 0.00 -0.26 0.00 0.00 64.21 66.00 3k67 n SER 129 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 3k67 s GLY 130 N -3.81 -0.54 -0.05 5.00 0.00 -1.06 -4.92 107.32 101.94 3k67 s GLY 130 Ca -0.04 1.17 0.01 0.00 0.00 0.00 0.00 44.72 45.86 3k67 s GLY 130 CO 0.74 0.83 -0.04 0.14 0.00 0.00 0.00 173.10 174.77 3k67 s VAL 131 N -1.39 0.50 -0.27 1.40 1.01 -1.26 -0.96 120.40 119.43 3k67 s VAL 131 Ca -0.10 -0.08 -0.01 0.00 0.00 0.00 0.00 61.98 61.79 3k67 s VAL 131 Cb -0.00 -0.54 0.08 0.00 0.00 0.00 0.00 36.38 35.92 3k67 s VAL 131 CO 0.08 0.22 0.05 -0.70 0.00 0.00 0.00 175.10 174.75 3k67 s GLU 132 N 1.06 0.95 5.77 2.72 2.56 -0.21 -5.02 118.70 126.54 3k67 s GLU 132 Ca -0.09 -0.98 0.00 0.00 0.00 0.00 0.00 54.97 53.90 3k67 s GLU 132 Cb -0.14 -2.24 0.00 0.00 2.00 0.00 0.00 34.13 33.75 3k67 s GLU 132 CO -0.01 -0.83 0.00 1.63 -0.56 0.00 0.00 175.26 175.49 3k67 n LYS 133 N 4.81 0.00 -0.66 4.30 5.02 -1.26 -1.11 118.16 129.26 3k67 n LYS 133 Ca -0.05 0.00 0.08 0.00 -2.02 0.00 0.00 58.31 56.32 3k67 n LYS 133 Cb 0.44 0.00 0.34 0.00 -0.02 0.00 0.00 35.03 35.79 3k67 n LYS 133 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 3k67 n ASN 134 N 9.06 4.83 -4.46 4.39 0.23 -1.26 -4.91 115.26 123.14 3k67 n ASN 134 Ca 0.00 -2.71 -0.35 0.00 -0.53 0.00 0.00 54.58 50.99 3k67 n ASN 134 Cb 0.00 -0.59 -0.12 0.00 -2.08 0.00 0.00 39.78 36.99 3k67 n ASN 134 CO 0.00 0.00 0.00 -0.13 -0.93 0.00 0.00 177.26 176.20 3k67 s ARG 135 N -2.32 3.64 -0.16 -3.83 0.52 -0.27 -1.01 118.95 115.53 3k67 s ARG 135 Ca 0.49 -0.51 0.01 0.00 -0.52 0.00 0.00 55.73 55.20 3k67 s ARG 135 Cb 0.35 -3.09 0.01 0.00 0.52 0.00 0.00 34.95 32.74 3k67 s ARG 135 CO 0.18 0.03 -0.18 0.71 0.02 0.00 0.00 175.30 176.05 3k67 s TYR 136 N 0.97 2.76 -0.16 -0.53 1.51 -0.03 -1.04 117.35 120.82 3k67 s TYR 136 Ca 0.02 -1.33 -0.14 0.00 -1.01 0.00 0.00 57.07 54.61 3k67 s TYR 136 Cb -0.14 -1.89 -0.05 0.00 -0.11 0.00 0.00 41.96 39.77 3k67 s TYR 136 CO 0.02 -0.63 0.32 0.99 -1.11 0.00 0.00 175.55 175.13 3k67 s THR 137 N 1.01 5.29 -0.11 -0.71 2.01 -0.13 -1.00 115.64 122.01 3k67 s THR 137 Ca -0.02 0.59 -0.01 0.00 0.31 0.00 0.00 61.69 62.57 3k67 s THR 137 Cb -0.15 -3.66 0.03 0.00 0.01 0.00 0.00 72.50 68.74 3k67 s THR 137 CO -0.05 0.37 -0.05 -0.63 -0.69 0.00 0.00 174.62 173.58 3k67 s ILE 138 N 0.53 0.81 0.15 1.82 1.01 0.45 -0.37 121.20 125.61 3k67 s ILE 138 Ca 0.17 -0.19 -0.30 0.00 0.00 0.00 0.00 60.65 60.34 3k67 s ILE 138 Cb -0.13 -0.90 -0.07 0.00 0.01 0.00 0.00 42.46 41.37 3k67 s ILE 138 CO 0.05 0.30 1.05 -1.81 0.00 0.00 0.00 174.94 174.52 3k67 s ASP 139 N 1.79 7.36 -0.02 3.58 1.01 -0.02 -0.88 116.67 129.49 3k67 s ASP 139 Ca 0.05 1.98 0.01 0.00 0.71 0.00 0.00 52.55 55.29 3k67 s ASP 139 Cb -0.13 -2.60 0.01 0.00 1.01 0.00 0.00 42.92 41.22 3k67 s ASP 139 CO -0.07 -0.16 -0.03 -0.69 0.21 0.00 0.00 175.17 174.43 3k67 s VAL 140 N -0.14 0.32 -0.02 -1.27 1.01 -0.27 -1.08 120.40 118.94 3k67 s VAL 140 Ca 0.48 -0.07 0.05 0.00 0.00 0.00 0.00 61.98 62.44 3k67 s VAL 140 Cb -0.27 -0.33 -0.01 0.00 0.00 0.00 0.00 36.38 35.77 3k67 s VAL 140 CO 0.33 0.14 -0.17 -0.54 0.00 0.00 0.00 175.10 174.85 3k67 s LYS 141 N 0.49 1.50 -0.10 2.72 1.02 -0.53 -0.85 119.74 124.00 3k67 s LYS 141 Ca -0.05 -0.62 -0.01 0.00 0.02 0.00 0.00 55.97 55.30 3k67 s LYS 141 Cb -0.09 -1.42 -0.03 0.00 -0.52 0.00 0.00 37.83 35.78 3k67 s LYS 141 CO -0.01 0.35 -0.05 0.00 -0.92 0.00 0.00 175.35 174.72 3k67 s TYR 143 N -0.44 1.72 -0.29 0.00 2.02 0.39 -0.39 117.35 120.36 3k67 s TYR 143 Ca 0.07 -0.44 0.00 0.00 -0.37 0.00 0.00 57.07 56.33 3k67 s TYR 143 Cb -0.12 -0.92 0.06 0.00 -0.40 0.00 0.00 41.96 40.58 3k67 s TYR 143 CO 0.02 0.22 -0.03 0.95 -1.57 0.00 0.00 175.55 175.14 3k67 s THR 144 N -1.44 2.67 0.00 -0.71 -4.23 -0.09 -0.59 115.64 111.25 3k67 s THR 144 Ca 0.08 -1.55 0.00 0.00 -1.18 0.00 0.00 61.69 59.04 3k67 s THR 144 Cb -0.09 -2.58 0.00 0.00 1.34 0.00 0.00 72.50 71.17 3k67 s THR 144 CO 0.05 -0.13 0.00 0.61 -0.54 0.00 0.00 174.62 174.61 3k67 n GLY 145 N 4.53 3.52 0.85 3.99 0.00 -1.26 -1.77 105.19 115.05 3k67 n GLY 145 Ca -0.12 -0.08 0.12 0.00 0.00 0.00 0.00 46.02 45.94 3k67 n GLY 145 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3k67 n ASP 146 N 7.84 2.62 -4.66 1.61 5.68 -1.26 -4.93 116.55 123.45 3k67 n ASP 146 Ca 0.00 -1.86 -0.39 0.00 -0.50 0.00 0.00 54.79 52.04 3k67 n ASP 146 Cb 0.00 -0.04 -0.07 0.00 -1.14 0.00 0.00 41.12 39.87 3k67 n ASP 146 CO 0.00 0.00 0.00 -0.75 -1.33 0.00 0.00 177.20 175.12 3k67 s LYS 147 N -1.92 4.16 0.02 0.11 2.20 -0.73 -5.04 119.74 118.55 3k67 s LYS 147 Ca 0.32 0.27 -0.30 0.00 -0.36 0.00 0.00 55.97 55.90 3k67 s LYS 147 Cb 0.20 -3.56 -0.05 0.00 -1.51 0.00 0.00 37.83 32.91 3k67 s LYS 147 CO 0.31 -0.11 1.31 0.08 -0.36 0.00 0.00 175.35 176.58 3k67 s VAL 148 N 1.52 3.84 -0.01 4.02 1.01 -1.26 -0.91 120.40 128.60 3k67 s VAL 148 Ca 0.21 1.26 0.10 0.00 0.00 0.00 0.00 61.98 63.54 3k67 s VAL 148 Cb -0.15 -3.81 -0.15 0.00 0.00 0.00 0.00 36.38 32.27 3k67 s VAL 148 CO 0.09 0.04 0.21 1.33 0.00 0.00 0.00 175.10 176.77 3k67 n VAL 149 N 4.35 0.01 -3.64 2.92 0.24 0.48 -4.31 118.33 118.38 3k67 n VAL 149 Ca 0.11 -0.22 -0.16 0.00 -2.04 0.00 0.00 64.34 62.03 3k67 n VAL 149 Cb 0.45 0.27 -0.07 0.00 -1.47 0.00 0.00 33.84 33.01 3k67 n VAL 149 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3k67 s ALA 150 N -2.67 -1.30 -0.06 2.33 0.00 -1.11 -1.34 121.76 117.61 3k67 s ALA 150 Ca -0.04 0.90 -0.16 0.00 0.00 0.00 0.00 51.96 52.66 3k67 s ALA 150 Cb 0.06 -0.03 0.03 0.00 0.00 0.00 0.00 23.12 23.18 3k67 s ALA 150 CO 0.40 -0.31 0.37 -1.83 0.00 0.00 0.00 175.76 174.39 3k67 s GLU 151 N -1.14 0.64 0.00 0.00 -1.05 -0.42 -0.51 118.70 116.21 3k67 s GLU 151 Ca -0.11 0.09 0.00 0.00 -0.15 0.00 0.00 54.97 54.80 3k67 s GLU 151 Cb -0.03 0.29 0.00 0.00 -0.44 0.00 0.00 34.13 33.96 3k67 s GLU 151 CO 0.07 -0.16 0.00 0.41 0.95 0.00 0.00 175.26 176.53 3k67 n GLY 152 N 1.75 -0.77 3.26 -3.83 0.00 -0.03 -1.06 105.19 104.51 3k67 n GLY 152 Ca -0.19 -0.32 -0.13 0.00 0.00 0.00 0.00 46.02 45.38 3k67 n GLY 152 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3k67 s VAL 153 N -4.00 0.03 0.19 1.61 0.11 -0.28 -1.11 120.40 116.95 3k67 s VAL 153 Ca 0.00 -0.28 0.07 0.00 -2.93 0.00 0.00 61.98 58.84 3k67 s VAL 153 Cb 0.00 -0.59 -0.05 0.00 -1.53 0.00 0.00 36.38 34.21 3k67 s VAL 153 CO 0.00 -0.15 -0.14 0.68 -3.33 0.00 0.00 175.10 172.16 3k67 s VAL 154 N -0.76 1.63 -0.06 2.04 -7.23 -0.06 -0.86 120.40 115.10 3k67 s VAL 154 Ca -0.08 -2.18 0.03 0.00 -1.81 0.00 0.00 61.98 57.93 3k67 s VAL 154 Cb -0.04 -2.01 0.00 0.00 0.56 0.00 0.00 36.38 34.90 3k67 s VAL 154 CO 0.03 -0.62 -0.15 -0.75 -0.31 0.00 0.00 175.10 173.29 3k67 s LYS 155 N -3.66 1.85 0.09 4.82 2.20 -0.21 -0.41 119.74 124.41 3k67 s LYS 155 Ca 0.21 -0.54 0.09 0.00 -0.36 0.00 0.00 55.97 55.37 3k67 s LYS 155 Cb -0.00 -1.54 -0.03 0.00 -1.51 0.00 0.00 37.83 34.74 3k67 s LYS 155 CO 0.06 0.14 -0.23 0.14 -0.36 0.00 0.00 175.35 175.10 3k67 s VAL 156 N 0.33 1.85 -0.18 4.02 -7.23 -0.17 -0.66 120.40 118.37 3k67 s VAL 156 Ca -0.10 -1.47 -0.13 0.00 -1.81 0.00 0.00 61.98 58.47 3k67 s VAL 156 Cb -0.14 -1.64 -0.05 0.00 0.56 0.00 0.00 36.38 35.11 3k67 s VAL 156 CO 0.03 0.09 0.24 -0.22 -0.31 0.00 0.00 175.10 174.94 3k67 s LEU 157 N -1.66 4.23 -0.13 1.32 2.96 -0.02 -0.85 118.68 124.52 3k67 s LEU 157 Ca 0.09 0.41 -0.00 0.00 -0.22 0.00 0.00 54.13 54.41 3k67 s LEU 157 Cb -0.10 -2.29 0.03 0.00 0.50 0.00 0.00 46.19 44.33 3k67 s LEU 157 CO 0.04 0.11 -0.08 -0.63 -1.32 0.00 0.00 176.35 174.47 3k67 s ILE 158 N 0.49 1.14 -2.72 6.68 1.01 -0.18 -1.02 121.20 126.60 3k67 s ILE 158 Ca 0.14 -0.43 0.26 0.00 0.00 0.00 0.00 60.65 60.62 3k67 s ILE 158 Cb -0.12 -1.18 0.40 0.00 0.01 0.00 0.00 42.46 41.56 3k67 s ILE 158 CO 0.02 0.33 1.54 0.79 0.00 0.00 0.00 174.94 177.61