#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k67 n GLU 5 N 0.00 0.00 0.14 1.61 2.13 -1.26 0.38 120.64 123.64 3k67 n GLU 5 Ca 0.00 0.60 0.01 0.00 0.66 0.00 0.00 57.16 58.42 3k67 n GLU 5 Cb 0.00 -1.07 0.12 0.00 0.27 0.00 0.00 31.44 30.77 3k67 n GLU 5 CO 0.00 0.00 0.00 -0.24 -0.41 0.00 0.00 177.13 176.48 3k67 h VAL 6 N 0.00 1.19 -0.32 6.31 3.04 -2.05 -3.28 116.25 121.14 3k67 h VAL 6 Ca 0.00 -2.25 -0.02 0.00 -1.01 0.00 0.00 66.70 63.42 3k67 h VAL 6 Cb 0.00 2.30 -0.01 0.00 -2.01 0.00 0.00 31.29 31.57 3k67 h VAL 6 CO 0.00 0.59 0.13 0.50 -1.01 0.00 0.00 177.57 177.78 3k67 h LYS 7 N 0.00 0.47 0.42 4.17 3.64 -1.67 -2.32 116.57 121.28 3k67 h LYS 7 Ca -0.01 -0.08 -0.02 0.00 -1.27 0.00 0.00 60.65 59.27 3k67 h LYS 7 Cb 1.26 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 33.00 3k67 h LYS 7 CO 0.08 0.47 -0.20 1.98 -2.27 0.00 0.00 179.45 179.51 3k67 h MET 8 N 0.37 -0.55 0.00 1.90 4.05 0.71 0.16 114.93 121.56 3k67 h MET 8 Ca 0.11 0.04 -0.04 0.00 -0.28 0.00 0.00 59.70 59.53 3k67 h MET 8 Cb 0.18 0.12 -0.01 0.00 -0.80 0.00 0.00 31.60 31.10 3k67 h MET 8 CO -0.01 -0.27 -0.18 0.52 0.23 0.00 0.00 176.91 177.20 3k67 h MET 9 N -0.76 0.00 -0.16 0.39 2.86 -1.63 0.27 114.93 115.90 3k67 h MET 9 Ca -0.06 0.00 -0.05 0.00 -2.06 0.00 0.00 59.70 57.53 3k67 h MET 9 Cb 0.53 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.18 3k67 h MET 9 CO 0.10 0.18 -0.10 1.03 1.06 0.00 0.00 176.91 179.17 3k67 h SER 10 N 0.00 0.37 -0.44 1.22 0.87 -1.21 -1.31 113.55 113.05 3k67 h SER 10 Ca -0.00 -0.44 -0.03 0.00 -1.23 0.00 0.00 61.79 60.09 3k67 h SER 10 Cb 0.34 -0.10 -0.02 0.00 -0.44 0.00 0.00 62.40 62.18 3k67 h SER 10 CO 0.02 0.73 0.18 0.25 -0.53 0.00 0.00 176.83 177.48 3k67 h LEU 11 N 0.01 0.61 -0.47 2.23 5.85 0.07 -0.98 115.31 122.62 3k67 h LEU 11 Ca 0.03 -0.17 0.01 0.00 0.84 0.00 0.00 57.88 58.60 3k67 h LEU 11 Cb 0.60 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 41.45 3k67 h LEU 11 CO 0.03 0.61 0.30 0.25 -0.34 0.00 0.00 178.44 179.29 3k67 h LEU 12 N 0.57 0.50 -0.63 2.25 5.85 -0.50 0.24 115.31 123.59 3k67 h LEU 12 Ca 0.15 -0.01 -0.09 0.00 0.84 0.00 0.00 57.88 58.77 3k67 h LEU 12 Cb 0.19 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.08 3k67 h LEU 12 CO -0.01 0.36 0.03 -0.08 -0.34 0.00 0.00 178.44 178.40 3k67 h GLU 13 N 0.61 1.10 -0.30 1.25 4.57 -1.09 0.13 114.58 120.84 3k67 h GLU 13 Ca 0.18 -0.33 -0.01 0.00 -1.18 0.00 0.00 59.36 58.02 3k67 h GLU 13 Cb -0.03 -0.11 -0.01 0.00 -0.16 0.00 0.00 28.75 28.43 3k67 h GLU 13 CO -0.06 1.04 0.14 1.49 -1.18 0.00 0.00 179.01 180.45 3k67 h GLU 14 N 1.01 0.44 -0.05 1.92 4.81 -0.87 -2.91 114.58 118.92 3k67 h GLU 14 Ca 0.18 -0.07 -0.12 0.00 -0.13 0.00 0.00 59.36 59.23 3k67 h GLU 14 Cb 0.53 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.82 3k67 h GLU 14 CO 0.03 0.41 -0.51 0.52 -0.73 0.00 0.00 179.01 178.73 3k67 h MET 15 N 0.35 0.13 -0.68 1.92 2.86 -0.68 -2.91 114.93 115.92 3k67 h MET 15 Ca 0.10 -0.07 0.05 0.00 -2.06 0.00 0.00 59.70 57.72 3k67 h MET 15 Cb 0.12 0.01 -0.05 0.00 0.06 0.00 0.00 31.60 31.74 3k67 h MET 15 CO -0.01 0.61 0.40 -0.22 1.06 0.00 0.00 176.91 178.75 3k67 h LYS 16 N 0.10 0.73 -0.62 1.72 3.64 -0.57 0.13 116.57 121.70 3k67 h LYS 16 Ca 0.00 -0.04 -0.05 0.00 -1.27 0.00 0.00 60.65 59.28 3k67 h LYS 16 Cb 0.94 -0.17 -0.03 0.00 -0.41 0.00 0.00 32.23 32.57 3k67 h LYS 16 CO 0.07 0.48 0.17 0.78 -2.27 0.00 0.00 179.45 178.68 3k67 h GLY 17 N 0.75 1.02 0.52 5.01 0.00 -1.33 -0.88 103.07 108.17 3k67 h GLY 17 Ca 0.30 -0.60 -0.00 0.00 0.00 0.00 0.00 47.33 47.03 3k67 h GLY 17 CO -0.16 0.56 -0.01 -2.22 0.00 0.00 0.00 176.54 174.72 3k67 h ILE 18 N 0.92 1.35 -0.52 2.60 2.04 -1.38 -3.04 117.51 119.48 3k67 h ILE 18 Ca 0.20 -1.10 0.09 0.00 1.00 0.00 0.00 64.86 65.05 3k67 h ILE 18 Cb 0.30 2.10 -0.07 0.00 -0.74 0.00 0.00 36.82 38.40 3k67 h ILE 18 CO -0.00 0.28 0.09 0.22 0.00 0.00 0.00 178.15 178.74 3k67 h TYR 19 N -0.49 0.15 -0.89 1.37 3.20 -0.61 -1.55 116.97 118.15 3k67 h TYR 19 Ca -0.00 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 61.88 3k67 h TYR 19 Cb 0.48 0.01 -0.04 0.00 1.54 0.00 0.00 36.73 38.72 3k67 h TYR 19 CO 0.09 -0.02 0.48 0.77 -1.64 0.00 0.00 178.16 177.83 3k67 h SER 20 N 0.23 1.12 0.87 -2.11 0.02 -1.24 -1.31 113.55 111.12 3k67 h SER 20 Ca 0.27 -0.11 0.00 0.00 -0.84 0.00 0.00 61.79 61.11 3k67 h SER 20 Cb 0.37 -0.29 0.00 0.00 0.14 0.00 0.00 62.40 62.63 3k67 h SER 20 CO -0.35 0.90 0.00 0.11 -1.14 0.00 0.00 176.83 176.35 3k67 h LYS 21 N 1.25 0.00 -0.42 3.45 1.79 -1.18 -1.91 116.57 119.55 3k67 h LYS 21 Ca 0.31 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.78 3k67 h LYS 21 Cb 0.04 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.69 3k67 h LYS 21 CO -0.05 0.00 0.00 1.63 -1.08 0.00 0.00 179.45 179.95 3k67 n LYS 22 N -2.88 2.11 0.00 3.15 4.76 -0.77 -4.91 118.16 119.62 3k67 n LYS 22 Ca 0.01 -1.71 0.00 0.00 -2.87 0.00 0.00 58.31 53.73 3k67 n LYS 22 Cb 0.27 -1.40 0.00 0.00 -1.84 0.00 0.00 35.03 32.05 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 1.29 0.76 3.78 0.72 0.00 -0.72 -4.55 105.19 106.47 3k67 n GLY 23 Ca 0.17 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.82 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 -1.51 2.75 -0.17 -0.02 0.00 -0.57 -4.90 107.32 102.91 3k67 s GLY 24 Ca 0.00 0.80 -0.17 0.00 0.00 0.00 0.00 44.72 45.34 3k67 s GLY 24 CO 0.00 1.24 0.46 0.54 0.00 0.00 0.00 173.10 175.33 3k67 s LYS 25 N -2.57 4.24 -0.07 2.90 -0.14 -1.26 -4.34 119.74 118.50 3k67 s LYS 25 Ca 0.60 0.35 0.03 0.00 -1.36 0.00 0.00 55.97 55.58 3k67 s LYS 25 Cb -0.25 -3.50 0.01 0.00 -1.68 0.00 0.00 37.83 32.41 3k67 s LYS 25 CO 0.31 0.01 -0.16 0.08 -0.76 0.00 0.00 175.35 174.83 3k67 s VAL 26 N 1.12 1.43 0.04 3.17 1.01 -1.26 -5.05 120.40 120.85 3k67 s VAL 26 Ca 0.23 -0.65 0.02 0.00 0.00 0.00 0.00 61.98 61.58 3k67 s VAL 26 Cb -0.15 -1.27 -0.02 0.00 0.00 0.00 0.00 36.38 34.94 3k67 s VAL 26 CO 0.09 0.42 -0.07 -0.75 0.00 0.00 0.00 175.10 174.79 3k67 s LYS 27 N 0.54 0.51 0.22 2.72 2.36 -1.26 -5.13 119.74 119.70 3k67 s LYS 27 Ca -0.16 -0.67 -0.31 0.00 -2.55 0.00 0.00 55.97 52.28 3k67 s LYS 27 Cb -0.16 -0.30 -0.10 0.00 -1.05 0.00 0.00 37.83 36.21 3k67 s LYS 27 CO 0.05 0.06 1.51 -2.14 1.55 0.00 0.00 175.35 176.38 3k67 s PRO 28 N -1.37 4.23 -0.21 4.03 0.02 -1.26 -4.93 135.00 135.51 3k67 s PRO 28 Ca -0.08 2.36 -0.29 0.00 0.02 0.00 0.00 61.00 63.01 3k67 s PRO 28 Cb -0.09 -3.12 -0.04 0.00 0.02 0.00 0.00 34.50 31.27 3k67 s PRO 28 CO 0.00 -0.53 1.99 0.12 -0.33 0.00 0.00 177.00 178.26 3k67 s PHE 29 N 0.50 1.47 -0.04 6.54 5.36 -1.26 -4.99 117.98 125.55 3k67 s PHE 29 Ca 0.64 0.42 0.00 0.00 -0.96 0.00 0.00 56.93 57.04 3k67 s PHE 29 Cb -0.43 -4.03 0.02 0.00 -0.34 0.00 0.00 43.02 38.24 3k67 s PHE 29 CO 0.38 -3.86 -0.02 -1.83 -1.46 0.00 0.00 175.22 168.43 3k67 s GLU 30 N 5.67 0.61 0.37 10.12 -1.05 -1.26 -5.14 118.70 128.03 3k67 s GLU 30 Ca 0.90 -0.01 -0.26 0.00 -0.15 0.00 0.00 54.97 55.45 3k67 s GLU 30 Cb -0.31 -0.74 -0.09 0.00 -0.44 0.00 0.00 34.13 32.55 3k67 s GLU 30 CO 0.35 -0.14 1.12 0.15 0.95 0.00 0.00 175.26 177.70 3k67 s LYS 31 N 1.13 4.23 0.93 -4.83 1.02 -1.26 -4.89 119.74 116.07 3k67 s LYS 31 Ca -0.08 1.75 -0.12 0.00 0.02 0.00 0.00 55.97 57.55 3k67 s LYS 31 Cb -0.14 -2.77 0.15 0.00 -0.52 0.00 0.00 37.83 34.55 3k67 s LYS 31 CO -0.01 -0.14 1.09 -0.06 -0.92 0.00 0.00 175.35 175.30 3k67 s PHE 32 N -1.41 2.17 0.00 3.18 2.99 0.98 -5.00 117.98 120.90 3k67 s PHE 32 Ca 0.54 1.26 0.00 0.00 0.00 0.00 0.00 56.93 58.73 3k67 s PHE 32 Cb -0.29 -3.18 0.00 0.00 0.00 0.00 0.00 43.02 39.56 3k67 s PHE 32 CO 0.37 -2.59 0.00 0.39 -0.00 0.00 0.00 175.22 173.38 3k67 n GLU 33 N -4.02 2.34 0.00 0.44 1.02 -1.26 -3.92 120.64 115.24 3k67 n GLU 33 Ca 0.07 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.21 3k67 n GLU 33 Cb 0.55 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.97 3k67 n GLU 33 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3k67 n GLY 34 N 5.00 0.24 3.60 0.62 0.00 -1.26 -4.85 105.19 108.53 3k67 n GLY 34 Ca 0.00 -1.89 -0.39 0.00 0.00 0.00 0.00 46.02 43.74 3k67 n GLY 34 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3k67 s GLU 35 N -1.64 3.96 0.03 1.61 2.02 -1.26 -4.88 118.70 118.55 3k67 s GLU 35 Ca 0.00 -0.07 -0.30 0.00 0.02 0.00 0.00 54.97 54.61 3k67 s GLU 35 Cb 0.00 -3.67 -0.06 0.00 0.10 0.00 0.00 34.13 30.50 3k67 s GLU 35 CO 0.00 -0.28 1.38 -0.51 0.02 0.00 0.00 175.26 175.86 3k67 s LEU 36 N 2.01 4.33 0.15 1.80 1.43 -1.26 -4.89 118.68 122.25 3k67 s LEU 36 Ca 0.13 2.15 -0.25 0.00 -1.03 0.00 0.00 54.13 55.13 3k67 s LEU 36 Cb -0.16 -3.57 0.06 0.00 0.03 0.00 0.00 46.19 42.56 3k67 s LEU 36 CO 0.10 -0.68 0.96 -1.59 0.23 0.00 0.00 176.35 175.37 3k67 s LYS 37 N 1.97 1.19 0.20 1.70 -2.85 -1.26 -5.07 119.74 115.62 3k67 s LYS 37 Ca 0.63 -0.65 -0.32 0.00 -1.00 0.00 0.00 55.97 54.63 3k67 s LYS 37 Cb -0.32 0.41 -0.15 0.00 -2.06 0.00 0.00 37.83 35.70 3k67 s LYS 37 CO 0.28 -0.54 1.13 -1.91 0.10 0.00 0.00 175.35 174.40 3k67 n GLU 38 N -0.47 1.21 -0.23 1.78 0.00 -1.26 -1.63 120.64 120.05 3k67 n GLU 38 Ca -0.06 0.43 0.00 0.00 0.00 0.00 0.00 57.16 57.53 3k67 n GLU 38 Cb 0.61 -1.90 0.00 0.00 0.00 0.00 0.00 31.44 30.15 3k67 n GLU 38 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 3k67 n GLY 39 N 1.86 1.28 3.69 8.31 0.00 0.37 -4.98 105.19 115.73 3k67 n GLY 39 Ca 0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 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 -2.78 2.31 0.03 1.61 5.04 -0.64 -4.73 117.35 118.18 3k67 s TYR 40 Ca 0.00 0.20 0.03 0.00 -2.44 0.00 0.00 57.07 54.86 3k67 s TYR 40 Cb 0.00 -4.04 -0.04 0.00 0.35 0.00 0.00 41.96 38.24 3k67 s TYR 40 CO 0.00 -4.21 -0.03 1.03 -1.34 0.00 0.00 175.55 170.99 3k67 s ARG 41 N 2.71 2.59 0.18 4.97 0.52 -1.26 -1.10 118.95 127.55 3k67 s ARG 41 Ca 0.76 -0.74 -0.15 0.00 -0.52 0.00 0.00 55.73 55.08 3k67 s ARG 41 Cb -0.42 -2.55 0.02 0.00 0.52 0.00 0.00 34.95 32.53 3k67 s ARG 41 CO 0.34 0.59 0.46 -0.59 0.02 0.00 0.00 175.30 176.11 3k67 s PHE 42 N -1.12 -0.00 -0.01 -0.53 -0.12 -0.51 -5.01 117.98 110.69 3k67 s PHE 42 Ca 0.20 -0.35 -0.04 0.00 -0.05 0.00 0.00 56.93 56.70 3k67 s PHE 42 Cb -0.11 0.28 -0.00 0.00 -0.63 0.00 0.00 43.02 42.55 3k67 s PHE 42 CO 0.11 -0.86 0.07 -2.00 -0.05 0.00 0.00 175.22 172.50 3k67 s GLU 43 N -3.89 0.30 -0.19 1.99 -6.30 -1.26 -1.02 118.70 108.32 3k67 s GLU 43 Ca 0.11 -0.27 -0.17 0.00 -2.50 0.00 0.00 54.97 52.15 3k67 s GLU 43 Cb 0.00 0.12 0.05 0.00 0.00 0.00 0.00 34.13 34.31 3k67 s GLU 43 CO -0.03 -0.06 0.51 -0.47 0.02 0.00 0.00 175.26 175.23 3k67 s TYR 44 N -0.88 -0.60 0.03 5.30 5.04 -0.57 -4.99 117.35 120.68 3k67 s TYR 44 Ca -0.10 1.41 -0.01 0.00 -2.44 0.00 0.00 57.07 55.93 3k67 s TYR 44 Cb -0.06 0.23 -0.02 0.00 0.35 0.00 0.00 41.96 42.46 3k67 s TYR 44 CO 0.00 -0.30 -0.01 -1.83 -1.34 0.00 0.00 175.55 172.08 3k67 s GLU 45 N 0.51 0.42 -0.22 4.97 1.03 -1.26 0.04 118.70 124.19 3k67 s GLU 45 Ca -0.02 -0.76 -0.19 0.00 0.03 0.00 0.00 54.97 54.03 3k67 s GLU 45 Cb -0.04 0.15 0.06 0.00 -0.80 0.00 0.00 34.13 33.50 3k67 s GLU 45 CO -0.02 -0.08 0.58 0.21 -1.33 0.00 0.00 175.26 174.62 3k67 s LYS 46 N -2.16 0.66 0.04 -4.83 2.20 -0.49 -4.98 119.74 110.17 3k67 s LYS 46 Ca -0.09 0.84 -0.30 0.00 -0.36 0.00 0.00 55.97 56.05 3k67 s LYS 46 Cb -0.05 0.29 -0.05 0.00 -1.51 0.00 0.00 37.83 36.52 3k67 s LYS 46 CO -0.03 -0.09 1.13 0.21 -0.36 0.00 0.00 175.35 176.21 3k67 s LYS 47 N 0.48 4.46 -0.37 4.03 2.20 -1.26 -1.30 119.74 127.98 3k67 s LYS 47 Ca -0.01 1.66 -0.15 0.00 -0.36 0.00 0.00 55.97 57.11 3k67 s LYS 47 Cb -0.04 -3.39 0.00 0.00 -1.51 0.00 0.00 37.83 32.89 3k67 s LYS 47 CO -0.02 -0.21 0.33 -0.51 -0.36 0.00 0.00 175.35 174.59 3k67 s LEU 48 N 1.11 4.70 0.48 5.43 1.43 -0.26 -4.73 118.68 126.84 3k67 s LEU 48 Ca 0.57 -0.52 0.07 0.00 -1.03 0.00 0.00 54.13 53.22 3k67 s LEU 48 Cb -0.27 -2.25 0.01 0.00 0.03 0.00 0.00 46.19 43.71 3k67 s LEU 48 CO 0.28 -0.38 0.44 0.00 0.23 0.00 0.00 176.35 176.92 3k67 h GLU 50 N 0.82 0.99 -0.34 0.00 5.08 -1.93 -0.76 114.58 118.44 3k67 h GLU 50 Ca -0.38 -0.06 -0.04 0.00 -1.00 0.00 0.00 59.36 57.88 3k67 h GLU 50 Cb 1.28 -0.22 -0.02 0.00 0.50 0.00 0.00 28.75 30.29 3k67 h GLU 50 CO 0.55 0.66 0.05 0.97 -1.00 0.00 0.00 179.01 180.24 3k67 h ILE 51 N 1.02 1.18 -0.48 3.13 6.09 -1.93 -0.89 117.51 125.63 3k67 h ILE 51 Ca 0.47 -0.65 -0.06 0.00 -1.37 0.00 0.00 64.86 63.25 3k67 h ILE 51 Cb 0.39 0.86 -0.02 0.00 0.47 0.00 0.00 36.82 38.52 3k67 h ILE 51 CO -0.24 0.23 0.08 0.44 -3.07 0.00 0.00 178.15 175.58 3k67 h ASP 52 N 0.50 0.77 -0.25 2.19 3.32 -1.53 -0.33 116.42 121.09 3k67 h ASP 52 Ca 0.11 -0.26 -0.01 0.00 0.02 0.00 0.00 57.03 56.89 3k67 h ASP 52 Cb 0.24 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.58 3k67 h ASP 52 CO 0.00 0.84 0.11 0.58 -1.72 0.00 0.00 179.24 179.04 3k67 h VAL 53 N 0.67 1.16 -0.06 -1.35 2.07 -0.98 -0.19 116.25 117.57 3k67 h VAL 53 Ca 0.15 -0.48 0.01 0.00 0.82 0.00 0.00 66.70 67.19 3k67 h VAL 53 Cb 0.40 1.02 -0.01 0.00 -1.52 0.00 0.00 31.29 31.18 3k67 h VAL 53 CO 0.01 0.16 0.01 0.00 0.02 0.00 0.00 177.57 177.77 3k67 h ALA 54 N 0.95 0.06 -0.40 1.67 0.00 -1.09 -0.75 119.26 119.70 3k67 h ALA 54 Ca 0.08 0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.91 3k67 h ALA 54 Cb 0.16 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 3k67 h ALA 54 CO -0.01 -0.46 -0.15 0.52 0.00 0.00 0.00 179.25 179.15 3k67 h MET 55 N 0.04 0.75 -0.70 0.00 2.07 -1.01 -1.09 114.93 114.98 3k67 h MET 55 Ca 0.03 -0.26 -0.00 0.00 -2.07 0.00 0.00 59.70 57.39 3k67 h MET 55 Cb 0.02 -0.05 -0.03 0.00 -1.87 0.00 0.00 31.60 29.66 3k67 h MET 55 CO -0.04 0.86 0.43 0.35 1.07 0.00 0.00 176.91 179.58 3k67 h PHE 56 N 0.67 0.91 -0.65 -0.22 3.04 -0.86 -0.72 116.94 119.11 3k67 h PHE 56 Ca 0.11 0.00 0.01 0.00 3.98 0.00 0.00 57.97 62.08 3k67 h PHE 56 Cb 0.63 -0.30 -0.04 0.00 2.56 0.00 0.00 35.95 38.80 3k67 h PHE 56 CO 0.03 0.61 0.42 0.78 -2.02 0.00 0.00 178.31 178.13 3k67 h GLY 57 N 0.96 0.93 0.88 2.40 0.00 -0.72 -1.69 103.07 105.83 3k67 h GLY 57 Ca 0.25 -0.33 -0.07 0.00 0.00 0.00 0.00 47.33 47.18 3k67 h GLY 57 CO -0.05 0.31 -0.10 1.41 0.00 0.00 0.00 176.54 178.11 3k67 h LEU 58 N 0.85 0.57 -0.69 3.11 3.38 -0.80 0.21 115.31 121.95 3k67 h LEU 58 Ca 0.25 -0.39 -0.13 0.00 0.09 0.00 0.00 57.88 57.70 3k67 h LEU 58 Cb -0.06 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 3k67 h LEU 58 CO -0.07 0.83 -0.37 0.16 0.09 0.00 0.00 178.44 179.07 3k67 h ILE 59 N 0.31 1.29 0.00 1.22 3.07 -1.04 -3.18 117.51 119.18 3k67 h ILE 59 Ca 0.07 -1.52 -0.20 0.00 1.55 0.00 0.00 64.86 64.75 3k67 h ILE 59 Cb 0.59 1.50 -0.03 0.00 -0.27 0.00 0.00 36.82 38.61 3k67 h ILE 59 CO 0.03 0.48 -1.44 0.77 -1.05 0.00 0.00 178.15 176.95 3k67 h SER 60 N 0.49 0.00 0.00 2.16 4.64 -1.33 -3.48 113.55 116.03 3k67 h SER 60 Ca 0.05 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.37 3k67 h SER 60 Cb 0.87 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.96 3k67 h SER 60 CO 0.07 0.72 0.00 0.61 -0.87 0.00 0.00 176.83 177.36 3k67 n GLY 61 N 1.43 0.76 3.51 -0.77 0.00 0.69 -5.01 105.19 105.79 3k67 n GLY 61 Ca -0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.49 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 -2.52 6.56 -0.51 1.61 -1.08 -0.98 -4.80 116.67 114.96 3k67 s ASP 62 Ca 0.00 -1.73 0.02 0.00 -0.52 0.00 0.00 52.55 50.32 3k67 s ASP 62 Cb 0.00 -2.48 0.53 0.00 -1.46 0.00 0.00 42.92 39.51 3k67 s ASP 62 CO 0.00 -1.29 1.84 0.18 0.52 0.00 0.00 175.17 176.41 3k67 n LEU 63 N 7.73 6.62 -4.65 -1.34 4.77 -1.26 -4.25 117.00 124.62 3k67 n LEU 63 Ca 0.28 -4.05 -0.52 0.00 -0.03 0.00 0.00 56.01 51.70 3k67 n LEU 63 Cb 0.50 -0.82 -0.06 0.00 -2.33 0.00 0.00 43.42 40.71 3k67 n LEU 63 CO 0.58 1.37 1.17 -3.20 -1.33 0.00 0.00 177.39 175.99 3k67 n ASN 64 N -1.00 2.44 0.28 -1.43 2.85 -1.26 -4.82 115.26 112.31 3k67 n ASN 64 Ca 0.56 1.08 0.18 0.00 -0.11 0.00 0.00 54.58 56.29 3k67 n ASN 64 Cb 1.08 -1.26 0.97 0.00 1.24 0.00 0.00 39.78 41.81 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 6.31 0.00 0.00 1.20 0.11 -1.96 -1.11 132.00 136.55 3k67 h PRO 65 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 3k67 h PRO 65 Cb 1.30 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.41 3k67 h PRO 65 CO 0.88 0.00 0.00 -0.24 -0.21 0.00 0.00 178.00 178.43 3k67 h VAL 66 N 0.00 0.00 0.00 3.15 3.04 -1.87 0.58 116.25 121.15 3k67 h VAL 66 Ca 0.03 -0.15 0.00 0.00 -1.01 0.00 0.00 66.70 65.57 3k67 h VAL 66 Cb 0.27 1.07 0.00 0.00 -2.01 0.00 0.00 31.29 30.62 3k67 h VAL 66 CO -0.00 0.00 -1.07 1.41 -1.01 0.00 0.00 177.57 176.90 3k67 n HIS 67 N -2.94 0.09 0.00 3.17 8.25 -0.42 -2.21 115.22 121.17 3k67 n HIS 67 Ca -0.02 0.03 0.00 0.00 -0.26 0.00 0.00 57.72 57.47 3k67 n HIS 67 Cb 0.14 -0.25 0.00 0.00 1.12 0.00 0.00 29.99 31.00 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 -1.76 0.00 -3.64 4.41 3.72 -0.65 -4.71 117.46 114.82 3k67 n PHE 68 Ca 0.02 0.00 -0.40 0.00 -0.05 0.00 0.00 57.45 57.03 3k67 n PHE 68 Cb 0.40 0.00 -0.12 0.00 -0.94 0.00 0.00 39.48 38.82 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 -3.19 5.60 0.14 4.37 -1.08 0.11 -4.99 116.67 117.62 3k67 s ASP 69 Ca 0.00 -0.91 -0.18 0.00 -0.52 0.00 0.00 52.55 50.94 3k67 s ASP 69 Cb 0.00 -1.99 -0.00 0.00 -1.46 0.00 0.00 42.92 39.47 3k67 s ASP 69 CO 0.00 -0.33 1.74 -0.08 0.52 0.00 0.00 175.17 177.02 3k67 h GLU 70 N 8.38 0.15 -0.22 4.34 4.57 -1.96 -0.39 114.58 129.45 3k67 h GLU 70 Ca -0.27 -0.01 -0.02 0.00 -1.18 0.00 0.00 59.36 57.88 3k67 h GLU 70 Cb 1.11 -0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 29.66 3k67 h GLU 70 CO 0.64 0.10 0.06 0.22 -1.18 0.00 0.00 179.01 178.85 3k67 h ASP 71 N 0.16 0.33 0.00 1.04 1.82 -1.96 -0.10 116.42 117.71 3k67 h ASP 71 Ca 0.12 -0.22 0.02 0.00 -0.39 0.00 0.00 57.03 56.55 3k67 h ASP 71 Cb 0.11 -0.09 -0.02 0.00 0.68 0.00 0.00 39.33 40.01 3k67 h ASP 71 CO -0.15 0.46 -0.10 0.15 -1.61 0.00 0.00 179.24 177.99 3k67 h PHE 72 N 0.18 -0.26 -0.18 0.28 3.04 -1.87 -2.63 116.94 115.50 3k67 h PHE 72 Ca 0.07 0.01 -0.12 0.00 3.98 0.00 0.00 57.97 61.91 3k67 h PHE 72 Cb 0.26 0.12 -0.01 0.00 2.56 0.00 0.00 35.95 38.88 3k67 h PHE 72 CO 0.01 -0.16 -0.39 0.00 -2.02 0.00 0.00 178.31 175.75 3k67 h ALA 73 N 0.79 1.00 -0.10 2.41 0.00 -0.94 -2.55 119.26 119.87 3k67 h ALA 73 Ca 0.04 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.53 3k67 h ALA 73 Cb 0.23 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.91 3k67 h ALA 73 CO -0.10 0.61 0.06 0.77 0.00 0.00 0.00 179.25 180.59 3k67 h SER 74 N 0.33 0.11 1.38 0.00 0.02 -0.67 -1.77 113.55 112.96 3k67 h SER 74 Ca 0.03 -0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.96 3k67 h SER 74 Cb 0.84 -0.03 -0.00 0.00 0.14 0.00 0.00 62.40 63.35 3k67 h SER 74 CO 0.07 0.08 -0.08 0.11 -1.14 0.00 0.00 176.83 175.88 3k67 h LYS 75 N 0.13 0.00 -7.64 3.45 1.57 -1.12 -3.36 116.57 109.61 3k67 h LYS 75 Ca 0.04 0.00 -0.46 0.00 -1.87 0.00 0.00 60.65 58.36 3k67 h LYS 75 Cb -0.01 0.00 0.12 0.00 0.08 0.00 0.00 32.23 32.42 3k67 h LYS 75 CO -0.01 0.08 0.38 0.95 -0.57 0.00 0.00 179.45 180.28 3k67 s THR 76 N -3.45 2.04 0.62 -0.16 -4.23 -0.69 -4.91 115.64 104.85 3k67 s THR 76 Ca 0.03 -0.05 0.41 0.00 -1.18 0.00 0.00 61.69 60.90 3k67 s THR 76 Cb 0.08 -2.98 0.43 0.00 1.34 0.00 0.00 72.50 71.36 3k67 s THR 76 CO 0.62 0.00 2.33 -0.09 -0.54 0.00 0.00 174.62 176.94 3k67 h ARG 77 N -1.19 0.00 0.00 3.99 2.43 -1.88 -0.84 114.38 116.88 3k67 h ARG 77 Ca -0.45 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.72 3k67 h ARG 77 Cb 1.29 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.84 3k67 h ARG 77 CO 0.55 0.00 0.00 0.74 -1.51 0.00 0.00 179.97 179.75 3k67 h PHE 78 N 0.00 0.00 -1.78 2.20 0.04 -1.91 -3.47 116.94 112.02 3k67 h PHE 78 Ca -0.00 0.00 -0.36 0.00 2.80 0.00 0.00 57.97 60.41 3k67 h PHE 78 Cb 0.03 0.00 -0.07 0.00 2.20 0.00 0.00 35.95 38.11 3k67 h PHE 78 CO 0.00 0.00 -0.40 0.41 -0.60 0.00 0.00 178.31 177.72 3k67 n GLY 79 N 0.73 0.57 0.00 -1.45 0.00 -0.32 -4.84 105.19 99.88 3k67 n GLY 79 Ca 0.03 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.90 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 -0.92 2.27 3.75 -0.02 0.00 -1.04 -4.62 105.19 104.62 3k67 n GLY 80 Ca -0.20 -1.03 -0.34 0.00 0.00 0.00 0.00 46.02 44.46 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 -2.00 2.67 0.07 1.61 0.52 -1.26 -4.54 118.95 116.01 3k67 s ARG 81 Ca 0.00 1.56 0.06 0.00 -0.52 0.00 0.00 55.73 56.83 3k67 s ARG 81 Cb 0.00 -1.92 -0.03 0.00 0.52 0.00 0.00 34.95 33.52 3k67 s ARG 81 CO 0.00 -1.38 -0.16 0.14 0.02 0.00 0.00 175.30 173.92 3k67 s VAL 82 N -2.11 1.25 0.64 3.52 -7.23 -0.94 -4.61 120.40 110.92 3k67 s VAL 82 Ca 0.71 -1.28 -0.13 0.00 -1.81 0.00 0.00 61.98 59.47 3k67 s VAL 82 Cb -0.24 -1.17 -0.02 0.00 0.56 0.00 0.00 36.38 35.51 3k67 s VAL 82 CO 0.40 -0.12 1.05 0.68 -0.31 0.00 0.00 175.10 176.80 3k67 s VAL 83 N -1.14 4.13 0.27 1.32 -7.23 0.12 -4.03 120.40 113.84 3k67 s VAL 83 Ca 0.01 0.79 -0.31 0.00 -1.81 0.00 0.00 61.98 60.67 3k67 s VAL 83 Cb -0.09 -3.50 -0.13 0.00 0.56 0.00 0.00 36.38 33.22 3k67 s VAL 83 CO 0.02 -0.80 1.48 1.41 -0.31 0.00 0.00 175.10 176.90 3k67 n HIS 84 N -2.66 2.46 -0.34 2.82 8.25 -1.26 -4.75 115.22 119.75 3k67 n HIS 84 Ca 0.07 0.36 0.04 0.00 -0.26 0.00 0.00 57.72 57.94 3k67 n HIS 84 Cb 0.53 -2.52 0.21 0.00 1.12 0.00 0.00 29.99 29.34 3k67 n HIS 84 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 3k67 h GLY 85 N 4.37 1.44 2.00 -1.41 0.00 -1.97 -0.46 103.07 107.03 3k67 h GLY 85 Ca -0.46 -0.44 0.00 0.00 0.00 0.00 0.00 47.33 46.43 3k67 h GLY 85 CO 0.76 0.31 0.00 -0.33 0.00 0.00 0.00 176.54 177.28 3k67 h MET 86 N 1.09 0.00 -0.10 4.80 2.86 -1.98 -1.97 114.93 119.62 3k67 h MET 86 Ca 0.42 0.00 -0.08 0.00 -2.06 0.00 0.00 59.70 57.98 3k67 h MET 86 Cb 0.21 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.87 3k67 h MET 86 CO -0.17 0.00 -0.24 1.25 1.06 0.00 0.00 176.91 178.81 3k67 h LEU 87 N 0.00 0.39 -0.40 1.22 5.85 -1.46 -1.95 115.31 118.97 3k67 h LEU 87 Ca 0.00 -0.58 0.08 0.00 0.84 0.00 0.00 57.88 58.23 3k67 h LEU 87 Cb 0.56 -0.11 -0.08 0.00 0.37 0.00 0.00 40.66 41.40 3k67 h LEU 87 CO 0.00 0.89 -0.17 0.74 -0.34 0.00 0.00 178.44 179.56 3k67 h THR 88 N -0.10 0.46 -0.00 1.05 2.02 -0.98 -1.93 112.91 113.44 3k67 h THR 88 Ca -0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 3k67 h THR 88 Cb 0.84 0.46 0.00 0.00 -1.74 0.00 0.00 68.15 67.71 3k67 h THR 88 CO 0.05 0.00 -0.05 0.35 0.37 0.00 0.00 175.52 176.25 3k67 n THR 89 N -5.36 0.00 0.29 3.16 -2.24 -0.79 -2.48 114.28 106.86 3k67 n THR 89 Ca 0.02 -0.01 0.16 0.00 -2.27 0.00 0.00 64.05 61.96 3k67 n THR 89 Cb 0.27 -0.40 0.86 0.00 -2.10 0.00 0.00 70.33 68.96 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 0.08 0.00 0.42 3.42 0.02 -0.52 -0.35 113.55 116.62 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 0.38 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.92 3k67 h SER 90 CO 0.00 0.06 -0.15 -0.07 -1.14 0.00 0.00 176.83 175.53 3k67 h LEU 91 N 0.00 0.00 -0.77 5.07 3.38 -1.54 -1.78 115.31 119.67 3k67 h LEU 91 Ca -0.00 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.88 3k67 h LEU 91 Cb 0.25 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.98 3k67 h LEU 91 CO 0.01 0.15 -0.09 0.58 0.09 0.00 0.00 178.44 179.18 3k67 h VAL 92 N 0.00 1.26 -0.37 1.22 2.07 -1.24 -0.75 116.25 118.43 3k67 h VAL 92 Ca -0.00 -1.17 0.04 0.00 0.82 0.00 0.00 66.70 66.39 3k67 h VAL 92 Cb 0.40 1.00 -0.04 0.00 -1.52 0.00 0.00 31.29 31.13 3k67 h VAL 92 CO 0.02 0.40 0.15 -1.28 0.02 0.00 0.00 177.57 176.88 3k67 h SER 93 N 0.76 0.19 -0.69 0.57 0.87 -1.37 -0.97 113.55 112.91 3k67 h SER 93 Ca 0.13 0.03 -0.02 0.00 -1.23 0.00 0.00 61.79 60.71 3k67 h SER 93 Cb 0.58 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 62.52 3k67 h SER 93 CO 0.04 0.15 0.38 0.00 -0.53 0.00 0.00 176.83 176.86 3k67 h ALA 94 N 1.22 1.33 -0.03 6.23 0.00 -1.24 -0.55 119.26 126.22 3k67 h ALA 94 Ca 0.17 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 3k67 h ALA 94 Cb 0.12 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.62 3k67 h ALA 94 CO -0.15 0.54 0.00 0.00 0.00 0.00 0.00 179.25 179.64 3k67 h ALA 95 N 1.43 0.04 0.00 0.00 0.00 -0.68 -3.12 119.26 116.92 3k67 h ALA 95 Ca 0.25 -0.16 -0.08 0.00 0.00 0.00 0.00 54.91 54.91 3k67 h ALA 95 Cb 0.04 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 3k67 h ALA 95 CO -0.04 -0.29 -0.40 -0.39 0.00 0.00 0.00 179.25 178.12 3k67 h VAL 96 N -0.24 1.08 0.00 0.00 -1.51 -1.04 -2.44 116.25 112.10 3k67 h VAL 96 Ca 0.01 -1.49 -0.01 0.00 -1.23 0.00 0.00 66.70 63.98 3k67 h VAL 96 Cb 0.32 1.85 -0.00 0.00 -2.13 0.00 0.00 31.29 31.34 3k67 h VAL 96 CO 0.00 0.40 -0.03 0.00 -1.23 0.00 0.00 177.57 176.71 3k67 h ALA 97 N 1.60 1.27 -0.00 5.19 0.00 -1.04 -1.49 119.26 124.79 3k67 h ALA 97 Ca -0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3k67 h ALA 97 Cb 0.82 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.61 3k67 h ALA 97 CO 0.05 0.03 -0.09 0.54 0.00 0.00 0.00 179.25 179.78 3k67 n ARG 98 N -3.51 0.65 -2.08 0.00 1.74 -0.92 -4.85 116.66 107.70 3k67 n ARG 98 Ca -0.03 -0.19 -0.36 0.00 -0.77 0.00 0.00 57.85 56.50 3k67 n ARG 98 Cb 0.13 -1.50 0.02 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 -2.48 3.74 0.40 0.55 1.43 -0.56 -0.01 118.68 121.75 3k67 s LEU 99 Ca 0.29 2.37 -0.27 0.00 -1.03 0.00 0.00 54.13 55.49 3k67 s LEU 99 Cb 0.20 -4.52 -0.10 0.00 0.03 0.00 0.00 46.19 41.80 3k67 s LEU 99 CO 0.47 -1.43 1.41 -2.16 0.23 0.00 0.00 176.35 174.87 3k67 s PRO 100 N -3.20 3.97 0.00 1.29 0.04 -1.25 -4.76 135.00 131.09 3k67 s PRO 100 Ca 0.74 2.40 0.00 0.00 0.04 0.00 0.00 61.00 64.18 3k67 s PRO 100 Cb -0.30 -2.84 0.00 0.00 0.04 0.00 0.00 34.50 31.40 3k67 s PRO 100 CO 0.33 -0.57 0.00 0.41 0.04 0.00 0.00 177.00 177.21 3k67 n GLY 101 N 0.58 -3.63 3.57 0.56 0.00 -1.26 -4.92 105.19 100.09 3k67 n GLY 101 Ca 0.03 -2.14 -0.40 0.00 0.00 0.00 0.00 46.02 43.50 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 -0.94 5.12 -0.14 2.61 2.01 -0.30 -4.92 115.64 119.08 3k67 s THR 102 Ca 0.00 0.36 -0.03 0.00 0.31 0.00 0.00 61.69 62.32 3k67 s THR 102 Cb 0.00 -3.82 -0.03 0.00 0.01 0.00 0.00 72.50 68.66 3k67 s THR 102 CO 0.00 -0.04 -0.02 -0.69 -0.69 0.00 0.00 174.62 173.18 3k67 s VAL 103 N 2.17 4.03 -0.00 3.82 1.01 -1.26 -1.03 120.40 129.14 3k67 s VAL 103 Ca 0.15 -0.32 0.01 0.00 0.00 0.00 0.00 61.98 61.83 3k67 s VAL 103 Cb -0.16 -2.75 -0.00 0.00 0.00 0.00 0.00 36.38 33.47 3k67 s VAL 103 CO 0.11 0.52 -0.04 0.68 0.00 0.00 0.00 175.10 176.37 3k67 s VAL 104 N 0.07 0.31 0.06 2.92 -7.23 -0.13 -4.97 120.40 111.43 3k67 s VAL 104 Ca 0.01 -0.21 -0.30 0.00 -1.81 0.00 0.00 61.98 59.66 3k67 s VAL 104 Cb -0.13 -0.27 -0.05 0.00 0.56 0.00 0.00 36.38 36.48 3k67 s VAL 104 CO 0.02 0.06 1.12 -0.22 -0.31 0.00 0.00 175.10 175.77 3k67 s LEU 105 N -0.17 4.39 -0.15 1.32 2.96 -1.26 -0.67 118.68 125.09 3k67 s LEU 105 Ca 0.01 1.92 0.11 0.00 -0.22 0.00 0.00 54.13 55.95 3k67 s LEU 105 Cb -0.02 -3.58 -0.17 0.00 0.50 0.00 0.00 46.19 42.92 3k67 s LEU 105 CO -0.00 -0.36 0.01 0.18 -1.32 0.00 0.00 176.35 174.86 3k67 n LEU 106 N 3.65 0.52 -3.58 -0.68 4.77 0.34 -4.88 117.00 117.13 3k67 n LEU 106 Ca 0.07 -0.02 -0.16 0.00 -0.03 0.00 0.00 56.01 55.87 3k67 n LEU 106 Cb 0.48 0.19 -0.06 0.00 -2.33 0.00 0.00 43.42 41.69 3k67 n LEU 106 CO 0.54 0.45 0.33 -0.70 -1.33 0.00 0.00 177.39 176.67 3k67 s GLU 107 N -2.36 0.97 -0.07 3.23 -6.30 -0.85 -4.94 118.70 108.37 3k67 s GLU 107 Ca -0.11 0.09 -0.09 0.00 -2.50 0.00 0.00 54.97 52.36 3k67 s GLU 107 Cb 0.05 0.45 0.02 0.00 0.00 0.00 0.00 34.13 34.65 3k67 s GLU 107 CO 0.58 -0.31 0.25 1.14 0.02 0.00 0.00 175.26 176.94 3k67 s GLN 108 N -1.41 0.37 -0.05 4.30 -2.07 -1.26 -1.49 119.66 118.05 3k67 s GLN 108 Ca -0.11 0.19 -0.01 0.00 -1.82 0.00 0.00 55.36 53.61 3k67 s GLN 108 Cb -0.01 0.17 0.03 0.00 -1.09 0.00 0.00 33.01 32.11 3k67 s GLN 108 CO 0.07 -0.06 0.03 -1.12 -1.32 0.00 0.00 175.29 172.88 3k67 s SER 109 N -0.24 1.03 0.01 12.60 0.01 0.22 -5.00 113.70 122.33 3k67 s SER 109 Ca -0.04 0.01 0.01 0.00 1.31 0.00 0.00 55.95 57.24 3k67 s SER 109 Cb -0.03 -0.24 -0.01 0.00 0.21 0.00 0.00 66.02 65.95 3k67 s SER 109 CO 0.01 -0.19 -0.04 -0.36 0.41 0.00 0.00 173.24 173.07 3k67 s PHE 110 N 1.77 0.31 -0.10 2.43 0.40 -1.26 -1.02 117.98 120.52 3k67 s PHE 110 Ca 0.01 -0.23 -0.01 0.00 -0.60 0.00 0.00 56.93 56.10 3k67 s PHE 110 Cb -0.12 -0.20 -0.03 0.00 0.51 0.00 0.00 43.02 43.17 3k67 s PHE 110 CO -0.03 -0.06 -0.04 0.50 0.70 0.00 0.00 175.22 176.29 3k67 s ARG 111 N -0.63 3.09 -0.27 0.44 3.52 -0.26 -4.95 118.95 119.89 3k67 s ARG 111 Ca -0.05 -0.50 -0.12 0.00 -0.13 0.00 0.00 55.73 54.94 3k67 s ARG 111 Cb -0.05 -2.74 -0.05 0.00 -1.56 0.00 0.00 34.95 30.56 3k67 s ARG 111 CO -0.00 0.55 0.23 0.71 -0.81 0.00 0.00 175.30 175.98 3k67 s TYR 112 N -0.49 3.25 -0.08 5.12 2.02 -1.26 -1.24 117.35 124.67 3k67 s TYR 112 Ca 0.08 0.22 0.13 0.00 -0.37 0.00 0.00 57.07 57.12 3k67 s TYR 112 Cb -0.12 -2.41 -0.19 0.00 -0.40 0.00 0.00 41.96 38.85 3k67 s TYR 112 CO 0.02 -0.13 0.17 0.25 -1.57 0.00 0.00 175.55 174.29 3k67 n THR 113 N 4.92 0.47 -3.61 -0.71 -2.24 -0.37 -4.98 114.28 107.76 3k67 n THR 113 Ca -0.13 -0.44 -0.15 0.00 -2.27 0.00 0.00 64.05 61.06 3k67 n THR 113 Cb 0.52 -0.26 -0.07 0.00 -2.10 0.00 0.00 70.33 68.41 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 -4.12 -0.65 0.65 3.42 0.15 -1.23 -4.98 113.70 106.95 3k67 s SER 114 Ca -0.06 1.02 -0.15 0.00 0.70 0.00 0.00 55.95 57.47 3k67 s SER 114 Cb 0.06 0.98 -0.00 0.00 -1.71 0.00 0.00 66.02 65.35 3k67 s SER 114 CO 0.55 -0.39 1.09 -2.16 1.20 0.00 0.00 173.24 173.54 3k67 s PRO 115 N -0.34 2.88 -0.14 5.44 0.04 -1.26 -4.64 135.00 136.98 3k67 s PRO 115 Ca -0.05 1.31 -0.04 0.00 0.04 0.00 0.00 61.00 62.25 3k67 s PRO 115 Cb -0.03 -1.97 -0.03 0.00 0.04 0.00 0.00 34.50 32.51 3k67 s PRO 115 CO 0.05 -1.17 0.02 0.08 0.04 0.00 0.00 177.00 176.01 3k67 s VAL 116 N -2.44 4.41 0.12 -0.36 1.01 -1.26 -5.03 120.40 116.85 3k67 s VAL 116 Ca 0.65 -0.19 0.02 0.00 0.00 0.00 0.00 61.98 62.47 3k67 s VAL 116 Cb -0.19 -2.93 -0.04 0.00 0.00 0.00 0.00 36.38 33.23 3k67 s VAL 116 CO 0.42 0.53 0.25 -0.13 0.00 0.00 0.00 175.10 176.17 3k67 s ARG 117 N -0.12 3.40 0.22 2.72 1.81 -1.26 -0.70 118.95 125.01 3k67 s ARG 117 Ca 0.05 -0.57 -0.32 0.00 -1.72 0.00 0.00 55.73 53.17 3k67 s ARG 117 Cb -0.12 -2.97 -0.13 0.00 -0.45 0.00 0.00 34.95 31.28 3k67 s ARG 117 CO 0.02 0.55 1.60 -0.89 -0.68 0.00 0.00 175.30 175.90 3k67 n ILE 118 N -0.26 0.38 -0.00 1.52 5.41 -1.26 -1.44 119.36 123.71 3k67 n ILE 118 Ca -0.06 -0.10 0.00 0.00 1.00 0.00 0.00 62.75 63.59 3k67 n ILE 118 Cb 0.53 -1.77 0.00 0.00 -0.71 0.00 0.00 39.64 37.69 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 3.11 0.54 3.77 7.39 0.00 0.98 -5.01 105.19 115.97 3k67 n GLY 119 Ca 0.14 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.78 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 -2.37 6.58 -0.23 1.61 1.01 -0.52 -4.70 116.67 118.05 3k67 s ASP 120 Ca 0.00 2.27 -0.21 0.00 0.71 0.00 0.00 52.55 55.32 3k67 s ASP 120 Cb 0.00 -2.61 -0.02 0.00 1.01 0.00 0.00 42.92 41.30 3k67 s ASP 120 CO 0.00 -0.63 0.63 -0.69 0.21 0.00 0.00 175.17 174.69 3k67 s VAL 121 N -1.47 5.00 -0.17 -1.27 1.01 -1.26 -1.10 120.40 121.14 3k67 s VAL 121 Ca 0.57 1.16 -0.08 0.00 0.00 0.00 0.00 61.98 63.63 3k67 s VAL 121 Cb -0.29 -3.94 -0.04 0.00 0.00 0.00 0.00 36.38 32.11 3k67 s VAL 121 CO 0.36 0.07 0.10 -0.69 0.00 0.00 0.00 175.10 174.94 3k67 s VAL 122 N 2.19 5.14 -0.18 2.92 1.01 -0.42 -4.31 120.40 126.76 3k67 s VAL 122 Ca 0.27 0.09 -0.02 0.00 0.00 0.00 0.00 61.98 62.32 3k67 s VAL 122 Cb -0.16 -3.31 -0.01 0.00 0.00 0.00 0.00 36.38 32.91 3k67 s VAL 122 CO 0.09 0.49 -0.08 -0.60 0.00 0.00 0.00 175.10 175.00 3k67 s ARG 123 N 0.06 3.40 -0.17 2.72 3.52 0.09 -1.40 118.95 127.16 3k67 s ARG 123 Ca 0.08 -0.64 -0.14 0.00 -0.13 0.00 0.00 55.73 54.89 3k67 s ARG 123 Cb -0.12 -2.83 -0.04 0.00 -1.56 0.00 0.00 34.95 30.40 3k67 s ARG 123 CO -0.00 0.01 0.31 0.08 -0.81 0.00 0.00 175.30 174.89 3k67 s VAL 124 N 0.90 5.29 -0.20 7.11 1.01 0.11 -0.36 120.40 134.25 3k67 s VAL 124 Ca -0.02 0.56 0.00 0.00 0.00 0.00 0.00 61.98 62.53 3k67 s VAL 124 Cb -0.15 -3.65 0.02 0.00 0.00 0.00 0.00 36.38 32.61 3k67 s VAL 124 CO 0.00 0.36 -0.16 -1.61 0.00 0.00 0.00 175.10 173.69 3k67 s GLU 125 N 0.70 2.93 0.14 2.72 0.41 0.26 -1.51 118.70 124.34 3k67 s GLU 125 Ca 0.16 -0.88 0.10 0.00 -0.41 0.00 0.00 54.97 53.94 3k67 s GLU 125 Cb -0.13 -2.69 -0.04 0.00 -1.78 0.00 0.00 34.13 29.48 3k67 s GLU 125 CO 0.05 -0.27 -0.21 0.20 -0.49 0.00 0.00 175.26 174.54 3k67 s GLY 126 N 1.29 1.66 -0.03 -1.39 0.00 -0.19 -1.45 107.32 107.21 3k67 s GLY 126 Ca 0.03 -1.44 -0.01 0.00 0.00 0.00 0.00 44.72 43.31 3k67 s GLY 126 CO -0.10 -1.42 0.04 0.14 0.00 0.00 0.00 173.10 171.75 3k67 s VAL 127 N -1.22 -0.03 0.05 1.40 1.01 -0.39 -1.42 120.40 119.79 3k67 s VAL 127 Ca 0.17 0.28 -0.31 0.00 0.00 0.00 0.00 61.98 62.13 3k67 s VAL 127 Cb -0.10 -0.15 -0.07 0.00 0.00 0.00 0.00 36.38 36.06 3k67 s VAL 127 CO 0.09 0.14 1.54 -0.69 0.00 0.00 0.00 175.10 176.17 3k67 s VAL 128 N 1.51 3.29 -0.01 2.92 1.01 -0.26 -1.03 120.40 127.82 3k67 s VAL 128 Ca -0.03 0.74 0.08 0.00 0.00 0.00 0.00 61.98 62.77 3k67 s VAL 128 Cb -0.13 -3.48 -0.12 0.00 0.00 0.00 0.00 36.38 32.66 3k67 s VAL 128 CO -0.03 0.00 0.16 -1.20 0.00 0.00 0.00 175.10 174.04 3k67 n SER 129 N 5.34 3.21 -3.69 3.32 7.64 0.10 -0.48 113.62 129.07 3k67 n SER 129 Ca 0.14 0.00 -0.14 0.00 1.01 0.00 0.00 58.87 59.88 3k67 n SER 129 Cb 0.42 1.31 -0.08 0.00 -1.01 0.00 0.00 64.21 64.85 3k67 n SER 129 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 3k67 s GLY 130 N -2.97 -0.31 -0.03 0.23 0.00 -0.96 -4.92 107.32 98.35 3k67 s GLY 130 Ca -0.03 0.86 -0.01 0.00 0.00 0.00 0.00 44.72 45.54 3k67 s GLY 130 CO 0.32 0.63 0.05 0.14 0.00 0.00 0.00 173.10 174.24 3k67 s VAL 131 N -0.81 -0.09 -0.16 1.40 1.01 -1.26 -0.67 120.40 119.82 3k67 s VAL 131 Ca -0.09 0.33 -0.03 0.00 0.00 0.00 0.00 61.98 62.19 3k67 s VAL 131 Cb -0.03 -0.12 0.05 0.00 0.00 0.00 0.00 36.38 36.28 3k67 s VAL 131 CO 0.05 0.14 0.04 -1.61 0.00 0.00 0.00 175.10 173.71 3k67 s GLU 132 N 1.65 0.51 5.38 2.72 2.02 -0.33 -5.01 118.70 125.65 3k67 s GLU 132 Ca -0.02 -0.21 0.00 0.00 0.02 0.00 0.00 54.97 54.76 3k67 s GLU 132 Cb -0.12 -1.75 0.00 0.00 0.10 0.00 0.00 34.13 32.36 3k67 s GLU 132 CO -0.03 -0.56 0.00 1.63 0.02 0.00 0.00 175.26 176.32 3k67 n LYS 133 N 5.12 0.00 -0.31 1.61 5.02 -1.26 -0.83 118.16 127.51 3k67 n LYS 133 Ca -0.08 0.00 0.11 0.00 -2.02 0.00 0.00 58.31 56.32 3k67 n LYS 133 Cb 0.48 0.00 0.28 0.00 -0.02 0.00 0.00 35.03 35.78 3k67 n LYS 133 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 3k67 n ASN 134 N 7.09 3.43 -4.51 4.39 3.02 -1.26 -4.92 115.26 122.50 3k67 n ASN 134 Ca 0.00 -1.99 -0.36 0.00 -0.03 0.00 0.00 54.58 52.20 3k67 n ASN 134 Cb 0.00 -0.41 -0.12 0.00 -0.61 0.00 0.00 39.78 38.64 3k67 n ASN 134 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 3k67 s ARG 135 N -1.17 3.77 -0.17 3.52 0.52 -0.01 -1.23 118.95 124.18 3k67 s ARG 135 Ca 0.43 -0.43 -0.01 0.00 -0.52 0.00 0.00 55.73 55.20 3k67 s ARG 135 Cb 0.22 -3.30 -0.00 0.00 0.52 0.00 0.00 34.95 32.39 3k67 s ARG 135 CO 0.30 -0.03 -0.12 0.71 0.02 0.00 0.00 175.30 176.17 3k67 s TYR 136 N 1.21 2.85 -0.08 -0.53 1.51 0.21 -1.18 117.35 121.33 3k67 s TYR 136 Ca 0.05 -0.97 -0.12 0.00 -1.01 0.00 0.00 57.07 55.01 3k67 s TYR 136 Cb -0.14 -1.95 -0.05 0.00 -0.11 0.00 0.00 41.96 39.71 3k67 s TYR 136 CO 0.04 -0.47 0.29 0.99 -1.11 0.00 0.00 175.55 175.29 3k67 s THR 137 N 0.95 5.25 -0.06 -0.71 2.01 0.15 -1.01 115.64 122.23 3k67 s THR 137 Ca -0.02 0.57 -0.00 0.00 0.31 0.00 0.00 61.69 62.54 3k67 s THR 137 Cb -0.15 -3.60 0.03 0.00 0.01 0.00 0.00 72.50 68.79 3k67 s THR 137 CO -0.01 0.53 -0.02 -0.63 -0.69 0.00 0.00 174.62 173.80 3k67 s ILE 138 N -0.59 0.45 0.06 1.82 1.01 0.37 0.02 121.20 124.33 3k67 s ILE 138 Ca 0.19 0.01 -0.29 0.00 0.00 0.00 0.00 60.65 60.56 3k67 s ILE 138 Cb -0.14 -0.54 -0.05 0.00 0.01 0.00 0.00 42.46 41.74 3k67 s ILE 138 CO 0.08 0.24 0.93 -1.81 0.00 0.00 0.00 174.94 174.38 3k67 s ASP 139 N 1.49 7.39 -0.02 3.58 1.01 -0.20 -1.00 116.67 128.93 3k67 s ASP 139 Ca -0.02 1.67 0.02 0.00 0.71 0.00 0.00 52.55 54.93 3k67 s ASP 139 Cb -0.13 -2.56 0.01 0.00 1.01 0.00 0.00 42.92 41.25 3k67 s ASP 139 CO -0.03 -0.12 -0.06 -0.69 0.21 0.00 0.00 175.17 174.47 3k67 s VAL 140 N 0.36 0.58 -0.01 -1.27 1.01 -0.20 -1.26 120.40 119.61 3k67 s VAL 140 Ca 0.47 -0.25 0.05 0.00 0.00 0.00 0.00 61.98 62.25 3k67 s VAL 140 Cb -0.22 -0.53 -0.01 0.00 0.00 0.00 0.00 36.38 35.62 3k67 s VAL 140 CO 0.28 0.19 -0.17 -0.54 0.00 0.00 0.00 175.10 174.86 3k67 s LYS 141 N 0.25 1.35 -0.06 2.72 1.02 -0.53 -0.94 119.74 123.55 3k67 s LYS 141 Ca -0.03 -0.59 0.02 0.00 0.02 0.00 0.00 55.97 55.38 3k67 s LYS 141 Cb -0.08 -1.30 -0.03 0.00 -0.52 0.00 0.00 37.83 35.90 3k67 s LYS 141 CO 0.00 0.35 -0.08 0.00 -0.92 0.00 0.00 175.35 174.70 3k67 s TYR 143 N -0.80 1.19 -0.18 0.00 2.02 0.51 -0.37 117.35 119.72 3k67 s TYR 143 Ca 0.12 -0.60 0.01 0.00 -0.37 0.00 0.00 57.07 56.24 3k67 s TYR 143 Cb -0.11 -0.64 0.02 0.00 -0.40 0.00 0.00 41.96 40.83 3k67 s TYR 143 CO 0.01 0.06 -0.19 0.95 -1.57 0.00 0.00 175.55 174.81 3k67 s THR 144 N -2.19 2.11 0.00 -0.71 -4.23 -0.34 -0.73 115.64 109.56 3k67 s THR 144 Ca 0.06 -0.92 0.00 0.00 -1.18 0.00 0.00 61.69 59.64 3k67 s THR 144 Cb -0.04 -1.88 0.00 0.00 1.34 0.00 0.00 72.50 71.91 3k67 s THR 144 CO 0.01 0.54 0.00 0.61 -0.54 0.00 0.00 174.62 175.24 3k67 n GLY 145 N 4.61 3.97 1.10 3.99 0.00 -1.26 -1.26 105.19 116.35 3k67 n GLY 145 Ca -0.21 0.02 0.08 0.00 0.00 0.00 0.00 46.02 45.91 3k67 n GLY 145 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3k67 n ASP 146 N 6.90 3.91 -4.72 1.61 8.00 -1.26 -4.96 116.55 126.04 3k67 n ASP 146 Ca 0.00 -2.41 -0.36 0.00 0.71 0.00 0.00 54.79 52.72 3k67 n ASP 146 Cb 0.00 -0.45 -0.07 0.00 -0.02 0.00 0.00 41.12 40.57 3k67 n ASP 146 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 3k67 s LYS 147 N -1.76 4.22 0.06 -1.24 2.20 -0.38 -5.05 119.74 117.79 3k67 s LYS 147 Ca 0.40 0.02 -0.31 0.00 -0.36 0.00 0.00 55.97 55.72 3k67 s LYS 147 Cb 0.26 -3.45 -0.06 0.00 -1.51 0.00 0.00 37.83 33.07 3k67 s LYS 147 CO 0.18 0.20 1.27 0.08 -0.36 0.00 0.00 175.35 176.73 3k67 s VAL 148 N 0.60 3.83 -0.02 4.02 1.01 -1.26 -1.19 120.40 127.39 3k67 s VAL 148 Ca 0.15 1.29 0.07 0.00 0.00 0.00 0.00 61.98 63.49 3k67 s VAL 148 Cb -0.13 -3.83 -0.10 0.00 0.00 0.00 0.00 36.38 32.32 3k67 s VAL 148 CO 0.03 0.08 0.14 1.33 0.00 0.00 0.00 175.10 176.68 3k67 n VAL 149 N 4.09 0.04 -3.64 2.92 0.24 0.50 -4.17 118.33 118.32 3k67 n VAL 149 Ca 0.10 -0.17 -0.15 0.00 -2.04 0.00 0.00 64.34 62.08 3k67 n VAL 149 Cb 0.45 0.22 -0.07 0.00 -1.47 0.00 0.00 33.84 32.97 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 -2.45 -1.27 -0.09 2.33 0.00 -1.09 -1.24 121.76 117.95 3k67 s ALA 150 Ca -0.03 0.79 -0.14 0.00 0.00 0.00 0.00 51.96 52.59 3k67 s ALA 150 Cb 0.04 0.07 0.03 0.00 0.00 0.00 0.00 23.12 23.26 3k67 s ALA 150 CO 0.29 -0.33 0.36 -1.83 0.00 0.00 0.00 175.76 174.24 3k67 s GLU 151 N -1.37 0.53 0.00 0.00 -1.05 -0.38 -0.57 118.70 115.86 3k67 s GLU 151 Ca -0.12 0.27 0.00 0.00 -0.15 0.00 0.00 54.97 54.98 3k67 s GLU 151 Cb -0.02 0.25 0.00 0.00 -0.44 0.00 0.00 34.13 33.91 3k67 s GLU 151 CO 0.06 -0.10 0.00 0.41 0.95 0.00 0.00 175.26 176.58 3k67 n GLY 152 N 2.29 -0.73 3.17 -3.83 0.00 -0.11 -1.10 105.19 104.88 3k67 n GLY 152 Ca -0.16 -0.32 -0.12 0.00 0.00 0.00 0.00 46.02 45.42 3k67 n GLY 152 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3k67 s VAL 153 N -4.00 0.07 0.18 1.61 -7.23 -0.18 -1.03 120.40 109.82 3k67 s VAL 153 Ca 0.00 -0.61 0.05 0.00 -1.81 0.00 0.00 61.98 59.62 3k67 s VAL 153 Cb 0.00 -0.53 -0.05 0.00 0.56 0.00 0.00 36.38 36.37 3k67 s VAL 153 CO 0.00 -0.33 -0.10 0.68 -0.31 0.00 0.00 175.10 175.04 3k67 s VAL 154 N -1.40 1.30 -0.04 1.32 -7.23 -0.17 -0.61 120.40 113.57 3k67 s VAL 154 Ca -0.14 -2.10 0.04 0.00 -1.81 0.00 0.00 61.98 57.97 3k67 s VAL 154 Cb -0.06 -1.98 0.00 0.00 0.56 0.00 0.00 36.38 34.89 3k67 s VAL 154 CO 0.03 -0.64 -0.15 -0.75 -0.31 0.00 0.00 175.10 173.28 3k67 s LYS 155 N -3.74 1.57 0.09 4.82 2.20 -0.56 -0.48 119.74 123.64 3k67 s LYS 155 Ca 0.20 -0.51 0.08 0.00 -0.36 0.00 0.00 55.97 55.38 3k67 s LYS 155 Cb 0.02 -1.37 -0.03 0.00 -1.51 0.00 0.00 37.83 34.94 3k67 s LYS 155 CO 0.04 0.18 -0.20 0.14 -0.36 0.00 0.00 175.35 175.15 3k67 s VAL 156 N 0.15 1.66 -0.16 4.02 -7.23 -0.18 -0.50 120.40 118.16 3k67 s VAL 156 Ca -0.05 -1.45 -0.13 0.00 -1.81 0.00 0.00 61.98 58.54 3k67 s VAL 156 Cb -0.11 -1.50 -0.05 0.00 0.56 0.00 0.00 36.38 35.28 3k67 s VAL 156 CO 0.02 -0.01 0.27 -0.22 -0.31 0.00 0.00 175.10 174.85 3k67 s LEU 157 N -1.73 4.25 -0.13 1.32 2.96 0.16 -0.62 118.68 124.89 3k67 s LEU 157 Ca 0.06 0.49 -0.00 0.00 -0.22 0.00 0.00 54.13 54.46 3k67 s LEU 157 Cb -0.10 -2.34 0.03 0.00 0.50 0.00 0.00 46.19 44.28 3k67 s LEU 157 CO 0.04 0.13 -0.08 -0.63 -1.32 0.00 0.00 176.35 174.49 3k67 s ILE 158 N 0.36 1.11 -2.71 6.68 1.01 -0.37 -0.95 121.20 126.33 3k67 s ILE 158 Ca 0.16 -0.44 0.26 0.00 0.00 0.00 0.00 60.65 60.63 3k67 s ILE 158 Cb -0.13 -1.17 0.40 0.00 0.01 0.00 0.00 42.46 41.57 3k67 s ILE 158 CO 0.03 0.30 1.54 0.79 0.00 0.00 0.00 174.94 177.61